NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
591103 | 2mmv | 19869 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 38.131 2.297 -16.804 2 H2 GLY 1 H2 GLY 1 38.210 3.123 -18.278 3 H3 GLY 1 H3 GLY 1 37.859 1.468 -18.252 4 HA2 GLY 1 HA3 GLY 1 35.862 2.769 -18.651 5 HA3 GLY 1 HA2 GLY 1 35.774 1.864 -17.146 6 H SER 2 H SER 2 34.388 4.316 -17.999 7 HA SER 2 HA SER 2 35.381 6.176 -15.938 8 HB2 SER 2 HB2 SER 2 33.558 6.855 -18.258 9 HB3 SER 2 HB3 SER 2 34.406 7.976 -17.193 10 HG SER 2 HG SER 2 35.497 6.262 -19.167 11 H HIS 3 H HIS 3 33.448 7.550 -15.026 12 HA HIS 3 HA HIS 3 31.131 5.774 -14.634 13 HB2 HIS 3 HB2 HIS 3 32.842 7.104 -12.571 14 HB3 HIS 3 HB3 HIS 3 31.139 6.822 -12.233 15 HD1 HIS 3 HD1 HIS 3 32.228 4.080 -14.268 16 HD2 HIS 3 HD2 HIS 3 32.615 5.092 -10.249 17 HE1 HIS 3 HE1 HIS 3 32.786 1.935 -13.078 18 HE2 HIS 3 HE2 HIS 3 33.052 2.574 -10.656 19 H MET 4 H MET 4 29.145 6.802 -14.135 20 HA MET 4 HA MET 4 29.016 9.564 -15.116 21 HB2 MET 4 HB2 MET 4 26.892 7.428 -14.897 22 HB3 MET 4 HB3 MET 4 26.572 9.084 -15.391 23 HG2 MET 4 HG2 MET 4 27.990 8.817 -17.330 24 HG3 MET 4 HG3 MET 4 28.414 7.185 -16.824 25 HE1 MET 4 HE1 MET 4 25.828 9.503 -18.500 26 HE2 MET 4 HE2 MET 4 25.011 9.203 -16.968 27 HE3 MET 4 HE3 MET 4 24.340 8.556 -18.463 28 H THR 5 H THR 5 28.142 11.186 -13.942 29 HA THR 5 HA THR 5 27.909 10.760 -11.097 30 HB THR 5 HB THR 5 27.379 13.362 -11.329 31 HG1 THR 5 HG1 THR 5 27.287 13.367 -13.604 32 HG21 THR 5 HG21 THR 5 30.105 12.118 -11.745 33 HG22 THR 5 HG22 THR 5 29.328 12.434 -10.195 34 HG23 THR 5 HG23 THR 5 29.812 13.778 -11.229 35 H GLU 6 H GLU 6 25.918 9.353 -11.657 36 HA GLU 6 HA GLU 6 23.534 11.059 -11.414 37 HB2 GLU 6 HB2 GLU 6 23.872 8.590 -13.110 38 HB3 GLU 6 HB3 GLU 6 22.294 9.199 -12.634 39 HG2 GLU 6 HG2 GLU 6 23.158 11.425 -13.677 40 HG3 GLU 6 HG3 GLU 6 24.288 10.359 -14.515 41 H GLN 7 H GLN 7 21.830 10.168 -10.174 42 HA GLN 7 HA GLN 7 22.509 7.783 -8.607 43 HB2 GLN 7 HB2 GLN 7 22.901 10.072 -7.423 44 HB3 GLN 7 HB3 GLN 7 21.148 10.134 -7.321 45 HG2 GLN 7 HG2 GLN 7 21.133 8.031 -6.094 46 HG3 GLN 7 HG3 GLN 7 22.889 7.945 -6.206 47 HE21 GLN 7 HE21 GLN 7 21.013 10.856 -5.619 48 HE22 GLN 7 HE22 GLN 7 21.584 11.126 -4.011 49 HA PRO 8 HA PRO 8 18.296 7.273 -10.272 50 HB2 PRO 8 HB2 PRO 8 18.473 4.637 -10.746 51 HB3 PRO 8 HB3 PRO 8 19.226 5.822 -11.821 52 HG2 PRO 8 HG2 PRO 8 20.466 4.146 -9.673 53 HG3 PRO 8 HG3 PRO 8 21.076 4.513 -11.296 54 HD2 PRO 8 HD2 PRO 8 21.895 5.806 -9.018 55 HD3 PRO 8 HD3 PRO 8 21.961 6.521 -10.641 56 H LYS 9 H LYS 9 16.676 5.357 -9.713 57 HA LYS 9 HA LYS 9 16.049 5.551 -6.989 58 HB2 LYS 9 HB2 LYS 9 15.112 3.489 -8.991 59 HB3 LYS 9 HB3 LYS 9 14.338 3.853 -7.457 60 HG2 LYS 9 HG2 LYS 9 14.676 6.216 -9.104 61 HG3 LYS 9 HG3 LYS 9 13.740 4.961 -9.913 62 HD2 LYS 9 HD2 LYS 9 12.240 4.839 -7.975 63 HD3 LYS 9 HD3 LYS 9 13.179 6.101 -7.175 64 HE2 LYS 9 HE2 LYS 9 11.753 6.422 -9.810 65 HE3 LYS 9 HE3 LYS 9 11.111 6.934 -8.250 66 HZ1 LYS 9 HZ1 LYS 9 12.168 8.755 -9.480 67 HZ2 LYS 9 HZ2 LYS 9 13.645 7.930 -9.443 68 HZ3 LYS 9 HZ3 LYS 9 12.936 8.458 -8.003 69 H THR 10 H THR 10 17.089 4.644 -5.339 70 HA THR 10 HA THR 10 18.782 2.345 -5.752 71 HB THR 10 HB THR 10 19.431 4.320 -4.305 72 HG1 THR 10 HG1 THR 10 20.260 2.827 -2.600 73 HG21 THR 10 HG21 THR 10 18.646 4.341 -1.988 74 HG22 THR 10 HG22 THR 10 17.530 3.024 -2.350 75 HG23 THR 10 HG23 THR 10 17.309 4.602 -3.108 76 H ARG 11 H ARG 11 18.602 0.372 -4.673 77 HA ARG 11 HA ARG 11 15.878 -0.259 -3.767 78 HB2 ARG 11 HB2 ARG 11 17.895 -2.215 -4.872 79 HB3 ARG 11 HB3 ARG 11 16.177 -2.484 -4.604 80 HG2 ARG 11 HG2 ARG 11 15.630 -0.910 -6.363 81 HG3 ARG 11 HG3 ARG 11 17.340 -0.562 -6.610 82 HD2 ARG 11 HD2 ARG 11 17.634 -3.023 -7.106 83 HD3 ARG 11 HD3 ARG 11 15.875 -3.133 -7.141 84 HE ARG 11 HE ARG 11 17.042 -1.108 -8.854 85 HH11 ARG 11 HH11 ARG 11 15.807 -4.380 -8.601 86 HH12 ARG 11 HH12 ARG 11 15.548 -4.546 -10.312 87 HH21 ARG 11 HH21 ARG 11 16.691 -1.319 -11.090 88 HH22 ARG 11 HH22 ARG 11 16.056 -2.801 -11.730 89 H VAL 12 H VAL 12 15.677 -1.818 -2.036 90 HA VAL 12 HA VAL 12 18.110 -2.211 -0.458 91 HB VAL 12 HB VAL 12 17.066 -0.105 0.320 92 HG11 VAL 12 HG11 VAL 12 14.732 -1.891 0.970 93 HG12 VAL 12 HG12 VAL 12 14.753 -0.483 -0.092 94 HG13 VAL 12 HG13 VAL 12 14.955 -0.277 1.648 95 HG21 VAL 12 HG21 VAL 12 16.942 -2.334 2.343 96 HG22 VAL 12 HG22 VAL 12 17.138 -0.616 2.685 97 HG23 VAL 12 HG23 VAL 12 18.406 -1.494 1.832 98 H SER 13 H SER 13 18.041 -3.949 0.973 99 HA SER 13 HA SER 13 15.898 -5.865 0.452 100 HB2 SER 13 HB2 SER 13 18.594 -6.274 1.763 101 HB3 SER 13 HB3 SER 13 17.447 -7.542 1.331 102 HG SER 13 HG SER 13 17.723 -6.983 -0.852 103 H VAL 14 H VAL 14 14.314 -6.028 1.890 104 HA VAL 14 HA VAL 14 14.905 -5.400 4.711 105 HB VAL 14 HB VAL 14 12.507 -4.797 4.959 106 HG11 VAL 14 HG11 VAL 14 12.663 -2.617 3.765 107 HG12 VAL 14 HG12 VAL 14 14.123 -3.215 2.977 108 HG13 VAL 14 HG13 VAL 14 14.086 -3.020 4.729 109 HG21 VAL 14 HG21 VAL 14 11.071 -4.489 3.102 110 HG22 VAL 14 HG22 VAL 14 11.768 -6.099 2.922 111 HG23 VAL 14 HG23 VAL 14 12.380 -4.757 1.952 112 H ARG 15 H ARG 15 13.186 -6.461 6.195 113 HA ARG 15 HA ARG 15 12.740 -9.215 5.272 114 HB2 ARG 15 HB2 ARG 15 14.576 -8.946 6.960 115 HB3 ARG 15 HB3 ARG 15 13.373 -8.351 8.094 116 HG2 ARG 15 HG2 ARG 15 12.636 -10.903 6.914 117 HG3 ARG 15 HG3 ARG 15 14.169 -10.961 7.788 118 HD2 ARG 15 HD2 ARG 15 11.475 -10.112 8.825 119 HD3 ARG 15 HD3 ARG 15 12.453 -11.484 9.347 120 HE ARG 15 HE ARG 15 13.947 -9.162 9.749 121 HH11 ARG 15 HH11 ARG 15 11.049 -10.680 10.988 122 HH12 ARG 15 HH12 ARG 15 11.182 -9.942 12.551 123 HH21 ARG 15 HH21 ARG 15 14.105 -8.165 11.785 124 HH22 ARG 15 HH22 ARG 15 12.917 -8.499 13.003 125 H ILE 16 H ILE 16 10.646 -9.664 5.104 126 HA ILE 16 HA ILE 16 8.779 -8.458 7.040 127 HB ILE 16 HB ILE 16 7.958 -9.086 4.213 128 HG12 ILE 16 HG12 ILE 16 8.763 -6.326 5.136 129 HG13 ILE 16 HG13 ILE 16 9.893 -7.400 4.318 130 HG21 ILE 16 HG21 ILE 16 6.128 -7.583 4.702 131 HG22 ILE 16 HG22 ILE 16 6.842 -7.173 6.261 132 HG23 ILE 16 HG23 ILE 16 6.242 -8.806 5.967 133 HD11 ILE 16 HD11 ILE 16 8.987 -5.921 2.702 134 HD12 ILE 16 HD12 ILE 16 7.338 -6.254 3.229 135 HD13 ILE 16 HD13 ILE 16 8.276 -7.509 2.418 136 H TYR 17 H TYR 17 7.609 -9.897 8.112 137 HA TYR 17 HA TYR 17 6.732 -11.852 8.833 138 HB2 TYR 17 HB2 TYR 17 5.656 -11.465 6.403 139 HB3 TYR 17 HB3 TYR 17 6.461 -13.005 6.114 140 HD1 TYR 17 HD2 TYR 17 4.346 -11.418 8.764 141 HD2 TYR 17 HD1 TYR 17 5.191 -14.905 6.474 142 HE1 TYR 17 HE2 TYR 17 2.476 -12.582 9.859 143 HE2 TYR 17 HE1 TYR 17 3.326 -16.078 7.565 144 HH TYR 17 HH TYR 17 1.028 -14.430 9.565 145 H GLY 18 H GLY 18 9.642 -11.663 8.279 146 HA2 GLY 18 HA2 GLY 18 11.251 -13.239 9.020 147 HA3 GLY 18 HA3 GLY 18 10.175 -14.531 8.525 148 H GLN 19 H GLN 19 9.863 -12.936 5.883 149 HA GLN 19 HA GLN 19 12.187 -14.216 4.640 150 HB2 GLN 19 HB2 GLN 19 9.443 -13.538 3.746 151 HB3 GLN 19 HB3 GLN 19 10.710 -13.459 2.531 152 HG2 GLN 19 HG2 GLN 19 9.701 -15.615 2.444 153 HG3 GLN 19 HG3 GLN 19 11.328 -15.788 3.097 154 HE21 GLN 19 HE21 GLN 19 11.603 -16.391 5.225 155 HE22 GLN 19 HE22 GLN 19 10.311 -17.014 6.195 156 H ASP 20 H ASP 20 13.476 -13.146 3.094 157 HA ASP 20 HA ASP 20 13.664 -10.259 3.534 158 HB2 ASP 20 HB2 ASP 20 15.942 -10.418 2.732 159 HB3 ASP 20 HB3 ASP 20 15.680 -11.675 3.932 160 H TYR 21 H TYR 21 13.387 -8.781 1.947 161 HA TYR 21 HA TYR 21 13.058 -9.719 -0.823 162 HB2 TYR 21 HB2 TYR 21 11.171 -7.786 0.543 163 HB3 TYR 21 HB3 TYR 21 11.064 -8.351 -1.118 164 HD1 TYR 21 HD2 TYR 21 10.456 -10.733 -1.561 165 HD2 TYR 21 HD1 TYR 21 10.274 -9.040 2.335 166 HE1 TYR 21 HE2 TYR 21 9.010 -12.582 -0.830 167 HE2 TYR 21 HE1 TYR 21 8.829 -10.883 3.078 168 HH TYR 21 HH TYR 21 7.436 -12.568 2.280 169 H THR 22 H THR 22 13.767 -8.299 -2.379 170 HA THR 22 HA THR 22 14.972 -5.795 -1.397 171 HB THR 22 HB THR 22 15.763 -7.308 -3.892 172 HG1 THR 22 HG1 THR 22 17.389 -8.235 -2.709 173 HG21 THR 22 HG21 THR 22 17.720 -5.900 -3.875 174 HG22 THR 22 HG22 THR 22 17.230 -5.169 -2.345 175 HG23 THR 22 HG23 THR 22 16.282 -4.880 -3.805 176 H ILE 23 H ILE 23 13.507 -4.227 -1.811 177 HA ILE 23 HA ILE 23 12.440 -4.092 -4.548 178 HB ILE 23 HB ILE 23 10.373 -3.309 -3.899 179 HG12 ILE 23 HG12 ILE 23 11.190 -1.563 -2.319 180 HG13 ILE 23 HG13 ILE 23 9.731 -2.378 -1.780 181 HG21 ILE 23 HG21 ILE 23 10.260 -5.550 -3.431 182 HG22 ILE 23 HG22 ILE 23 9.636 -4.824 -1.951 183 HG23 ILE 23 HG23 ILE 23 11.296 -5.423 -2.011 184 HD11 ILE 23 HD11 ILE 23 12.515 -2.608 -0.702 185 HD12 ILE 23 HD12 ILE 23 11.280 -3.814 -0.348 186 HD13 ILE 23 HD13 ILE 23 11.035 -2.139 0.129 187 H VAL 24 H VAL 24 11.588 -1.708 -4.919 188 HA VAL 24 HA VAL 24 13.944 -0.056 -4.674 189 HB VAL 24 HB VAL 24 11.320 0.643 -5.996 190 HG11 VAL 24 HG11 VAL 24 14.087 1.763 -6.409 191 HG12 VAL 24 HG12 VAL 24 12.796 2.542 -5.494 192 HG13 VAL 24 HG13 VAL 24 12.612 2.277 -7.229 193 HG21 VAL 24 HG21 VAL 24 13.752 -0.731 -7.130 194 HG22 VAL 24 HG22 VAL 24 12.497 0.014 -8.117 195 HG23 VAL 24 HG23 VAL 24 12.100 -1.346 -7.067 196 H GLY 25 H GLY 25 14.244 1.389 -3.093 197 HA2 GLY 25 HA2 GLY 25 11.985 2.078 -1.368 198 HA3 GLY 25 HA3 GLY 25 13.685 2.398 -1.037 199 H ALA 26 H ALA 26 14.678 3.900 -2.789 200 HA ALA 26 HA ALA 26 14.865 6.002 -3.606 201 HB1 ALA 26 HB1 ALA 26 13.107 6.831 -5.019 202 HB2 ALA 26 HB2 ALA 26 11.944 5.725 -4.287 203 HB3 ALA 26 HB3 ALA 26 13.272 5.090 -5.258 204 H GLU 27 H GLU 27 14.685 6.047 -0.947 205 HA GLU 27 HA GLU 27 13.817 8.669 -0.408 206 HB2 GLU 27 HB2 GLU 27 12.110 8.168 1.325 207 HB3 GLU 27 HB3 GLU 27 11.591 7.738 -0.294 208 HG2 GLU 27 HG2 GLU 27 12.129 5.386 0.180 209 HG3 GLU 27 HG3 GLU 27 12.565 5.840 1.829 210 H SER 28 H SER 28 13.917 8.992 2.136 211 HA SER 28 HA SER 28 16.470 8.681 2.983 212 HB2 SER 28 HB2 SER 28 14.996 10.186 4.112 213 HB3 SER 28 HB3 SER 28 13.935 8.871 4.610 214 HG SER 28 HG SER 28 15.966 9.885 5.933 215 HA PRO 29 HA PRO 29 17.253 4.456 3.964 216 HB2 PRO 29 HB2 PRO 29 19.129 4.862 5.937 217 HB3 PRO 29 HB3 PRO 29 19.469 4.938 4.206 218 HG2 PRO 29 HG2 PRO 29 18.933 7.161 6.132 219 HG3 PRO 29 HG3 PRO 29 20.141 7.070 4.835 220 HD2 PRO 29 HD2 PRO 29 17.871 8.450 4.527 221 HD3 PRO 29 HD3 PRO 29 18.575 7.533 3.180 222 H ALA 30 H ALA 30 16.231 6.753 6.369 223 HA ALA 30 HA ALA 30 15.753 4.682 8.356 224 HB1 ALA 30 HB1 ALA 30 14.978 6.514 9.778 225 HB2 ALA 30 HB2 ALA 30 15.151 7.637 8.430 226 HB3 ALA 30 HB3 ALA 30 16.574 6.850 9.110 227 H HIS 31 H HIS 31 14.117 6.324 5.847 228 HA HIS 31 HA HIS 31 11.446 5.962 6.826 229 HB2 HIS 31 HB2 HIS 31 12.650 7.329 4.662 230 HB3 HIS 31 HB3 HIS 31 11.542 6.156 3.956 231 HD1 HIS 31 HD1 HIS 31 11.601 9.131 6.261 232 HD2 HIS 31 HD2 HIS 31 8.845 6.759 4.237 233 HE1 HIS 31 HE1 HIS 31 9.399 10.314 6.485 234 HE2 HIS 31 HE2 HIS 31 7.749 8.903 5.211 235 H ILE 32 H ILE 32 13.408 4.380 4.352 236 HA ILE 32 HA ILE 32 11.623 2.400 3.577 237 HB ILE 32 HB ILE 32 13.689 1.052 2.985 238 HG12 ILE 32 HG12 ILE 32 15.313 3.496 3.489 239 HG13 ILE 32 HG13 ILE 32 14.964 2.459 4.869 240 HG21 ILE 32 HG21 ILE 32 14.360 2.616 1.198 241 HG22 ILE 32 HG22 ILE 32 13.435 3.885 2.000 242 HG23 ILE 32 HG23 ILE 32 12.611 2.460 1.365 243 HD11 ILE 32 HD11 ILE 32 17.118 1.968 3.787 244 HD12 ILE 32 HD12 ILE 32 16.253 1.538 2.312 245 HD13 ILE 32 HD13 ILE 32 16.014 0.594 3.782 246 H ARG 33 H ARG 33 13.440 2.667 6.495 247 HA ARG 33 HA ARG 33 13.472 -0.093 7.200 248 HB2 ARG 33 HB2 ARG 33 13.777 2.409 8.860 249 HB3 ARG 33 HB3 ARG 33 13.962 0.789 9.508 250 HG2 ARG 33 HG2 ARG 33 15.636 2.011 7.327 251 HG3 ARG 33 HG3 ARG 33 16.111 1.834 9.017 252 HD2 ARG 33 HD2 ARG 33 15.632 -0.327 6.979 253 HD3 ARG 33 HD3 ARG 33 17.121 0.054 7.838 254 HE ARG 33 HE ARG 33 14.823 -0.830 9.412 255 HH11 ARG 33 HH11 ARG 33 17.930 -1.582 8.006 256 HH12 ARG 33 HH12 ARG 33 18.197 -2.964 9.013 257 HH21 ARG 33 HH21 ARG 33 15.167 -2.632 10.756 258 HH22 ARG 33 HH22 ARG 33 16.627 -3.554 10.598 259 H LEU 34 H LEU 34 11.220 2.566 7.781 260 HA LEU 34 HA LEU 34 9.641 0.949 9.588 261 HB2 LEU 34 HB2 LEU 34 8.167 2.861 9.791 262 HB3 LEU 34 HB3 LEU 34 9.835 3.344 10.010 263 HG LEU 34 HG LEU 34 9.491 3.845 7.352 264 HD11 LEU 34 HD11 LEU 34 6.901 4.612 8.681 265 HD12 LEU 34 HD12 LEU 34 7.082 3.274 7.546 266 HD13 LEU 34 HD13 LEU 34 7.381 4.930 7.015 267 HD21 LEU 34 HD21 LEU 34 10.504 5.321 9.014 268 HD22 LEU 34 HD22 LEU 34 8.904 5.706 9.646 269 HD23 LEU 34 HD23 LEU 34 9.343 6.185 8.007 270 H VAL 35 H VAL 35 9.803 1.480 6.225 271 HA VAL 35 HA VAL 35 7.137 1.112 5.441 272 HB VAL 35 HB VAL 35 9.613 0.141 3.991 273 HG11 VAL 35 HG11 VAL 35 8.244 0.285 1.973 274 HG12 VAL 35 HG12 VAL 35 6.849 0.758 2.945 275 HG13 VAL 35 HG13 VAL 35 7.549 -0.849 3.133 276 HG21 VAL 35 HG21 VAL 35 8.150 2.739 3.581 277 HG22 VAL 35 HG22 VAL 35 9.674 2.231 2.860 278 HG23 VAL 35 HG23 VAL 35 9.588 2.583 4.586 279 H ALA 36 H ALA 36 9.734 -1.279 5.847 280 HA ALA 36 HA ALA 36 8.177 -3.554 5.272 281 HB1 ALA 36 HB1 ALA 36 10.649 -3.482 5.247 282 HB2 ALA 36 HB2 ALA 36 10.001 -4.833 6.178 283 HB3 ALA 36 HB3 ALA 36 10.635 -3.413 7.009 284 H ALA 37 H ALA 37 9.008 -1.985 8.330 285 HA ALA 37 HA ALA 37 7.871 -3.856 10.068 286 HB1 ALA 37 HB1 ALA 37 7.938 -2.123 11.745 287 HB2 ALA 37 HB2 ALA 37 8.090 -0.879 10.503 288 HB3 ALA 37 HB3 ALA 37 9.396 -2.036 10.756 289 H PHE 38 H PHE 38 6.451 -1.112 8.378 290 HA PHE 38 HA PHE 38 3.973 -1.062 9.692 291 HB2 PHE 38 HB2 PHE 38 4.742 0.774 8.281 292 HB3 PHE 38 HB3 PHE 38 4.683 -0.265 6.862 293 HD1 PHE 38 HD1 PHE 38 2.372 0.683 9.643 294 HD2 PHE 38 HD2 PHE 38 2.933 0.128 5.461 295 HE1 PHE 38 HE1 PHE 38 0.043 1.357 9.250 296 HE2 PHE 38 HE2 PHE 38 0.602 0.805 5.063 297 HZ PHE 38 HZ PHE 38 -0.845 1.422 6.950 298 H VAL 39 H VAL 39 5.049 -2.827 6.824 299 HA VAL 39 HA VAL 39 2.484 -3.982 6.300 300 HB VAL 39 HB VAL 39 5.192 -4.918 5.332 301 HG11 VAL 39 HG11 VAL 39 3.929 -5.948 3.498 302 HG12 VAL 39 HG12 VAL 39 2.420 -5.429 4.246 303 HG13 VAL 39 HG13 VAL 39 3.450 -6.604 5.063 304 HG21 VAL 39 HG21 VAL 39 5.037 -2.711 4.576 305 HG22 VAL 39 HG22 VAL 39 3.302 -2.836 4.280 306 HG23 VAL 39 HG23 VAL 39 4.439 -3.675 3.226 307 H ASP 40 H ASP 40 5.451 -5.069 7.874 308 HA ASP 40 HA ASP 40 4.715 -7.727 8.366 309 HB2 ASP 40 HB2 ASP 40 7.008 -6.756 8.615 310 HB3 ASP 40 HB3 ASP 40 6.468 -5.978 10.099 311 H ASP 41 H ASP 41 4.353 -4.827 10.383 312 HA ASP 41 HA ASP 41 3.133 -6.107 12.579 313 HB2 ASP 41 HB2 ASP 41 3.273 -3.270 11.625 314 HB3 ASP 41 HB3 ASP 41 2.166 -3.689 12.927 315 H LYS 42 H LYS 42 1.811 -4.569 9.692 316 HA LYS 42 HA LYS 42 -0.904 -4.737 10.429 317 HB2 LYS 42 HB2 LYS 42 0.276 -3.450 8.466 318 HB3 LYS 42 HB3 LYS 42 -0.049 -4.923 7.564 319 HG2 LYS 42 HG2 LYS 42 -2.171 -4.356 7.259 320 HG3 LYS 42 HG3 LYS 42 -2.403 -4.050 8.981 321 HD2 LYS 42 HD2 LYS 42 -1.027 -1.858 8.391 322 HD3 LYS 42 HD3 LYS 42 -1.698 -2.171 6.786 323 HE2 LYS 42 HE2 LYS 42 -3.910 -1.988 7.557 324 HE3 LYS 42 HE3 LYS 42 -3.418 -2.137 9.246 325 HZ1 LYS 42 HZ1 LYS 42 -3.935 0.128 8.815 326 HZ2 LYS 42 HZ2 LYS 42 -2.955 0.175 7.435 327 HZ3 LYS 42 HZ3 LYS 42 -2.257 0.019 8.976 328 H MET 43 H MET 43 1.233 -6.967 8.707 329 HA MET 43 HA MET 43 -0.787 -8.861 8.077 330 HB2 MET 43 HB2 MET 43 2.210 -8.964 8.204 331 HB3 MET 43 HB3 MET 43 1.291 -10.448 8.002 332 HG2 MET 43 HG2 MET 43 0.204 -9.398 6.008 333 HG3 MET 43 HG3 MET 43 1.347 -8.066 6.169 334 HE1 MET 43 HE1 MET 43 2.436 -12.414 5.078 335 HE2 MET 43 HE2 MET 43 0.794 -11.791 5.223 336 HE3 MET 43 HE3 MET 43 1.794 -11.982 6.663 337 H HIS 44 H HIS 44 1.388 -8.431 10.803 338 HA HIS 44 HA HIS 44 0.859 -10.864 12.114 339 HB2 HIS 44 HB2 HIS 44 2.652 -8.985 12.568 340 HB3 HIS 44 HB3 HIS 44 1.430 -8.373 13.676 341 HD1 HIS 44 HD1 HIS 44 4.360 -10.105 13.948 342 HD2 HIS 44 HD2 HIS 44 0.502 -11.025 15.211 343 HE1 HIS 44 HE1 HIS 44 4.630 -11.781 15.804 344 HE2 HIS 44 HE2 HIS 44 2.289 -12.382 16.500 345 H GLU 45 H GLU 45 -0.728 -7.688 12.340 346 HA GLU 45 HA GLU 45 -2.464 -8.419 14.463 347 HB2 GLU 45 HB2 GLU 45 -3.543 -6.350 14.158 348 HB3 GLU 45 HB3 GLU 45 -1.861 -6.060 13.743 349 HG2 GLU 45 HG2 GLU 45 -2.361 -6.047 11.411 350 HG3 GLU 45 HG3 GLU 45 -4.004 -6.616 11.704 351 H PHE 46 H PHE 46 -2.590 -9.021 11.059 352 HA PHE 46 HA PHE 46 -5.431 -9.683 11.214 353 HB2 PHE 46 HB2 PHE 46 -3.493 -9.334 8.958 354 HB3 PHE 46 HB3 PHE 46 -4.967 -10.262 8.699 355 HD1 PHE 46 HD2 PHE 46 -7.134 -8.998 9.740 356 HD2 PHE 46 HD1 PHE 46 -3.571 -7.135 8.342 357 HE1 PHE 46 HE2 PHE 46 -8.376 -6.906 9.370 358 HE2 PHE 46 HE1 PHE 46 -4.808 -5.042 7.971 359 HZ PHE 46 HZ PHE 46 -7.213 -4.927 8.488 360 H SER 47 H SER 47 -2.335 -11.192 11.249 361 HA SER 47 HA SER 47 -3.048 -13.773 10.362 362 HB2 SER 47 HB2 SER 47 -0.859 -12.904 12.269 363 HB3 SER 47 HB3 SER 47 -1.002 -14.517 11.574 364 HG SER 47 HG SER 47 -0.800 -12.142 10.026 365 H GLU 48 H GLU 48 -3.253 -12.172 13.456 366 HA GLU 48 HA GLU 48 -3.946 -14.512 14.940 367 HB2 GLU 48 HB2 GLU 48 -4.541 -12.868 16.735 368 HB3 GLU 48 HB3 GLU 48 -2.902 -12.714 16.120 369 HG2 GLU 48 HG2 GLU 48 -3.277 -10.675 15.226 370 HG3 GLU 48 HG3 GLU 48 -4.957 -11.039 14.826 371 H LYS 49 H LYS 49 -5.689 -12.356 12.925 372 HA LYS 49 HA LYS 49 -8.251 -12.933 14.155 373 HB2 LYS 49 HB2 LYS 49 -7.276 -11.099 12.061 374 HB3 LYS 49 HB3 LYS 49 -8.879 -11.756 11.772 375 HG2 LYS 49 HG2 LYS 49 -9.361 -9.830 12.919 376 HG3 LYS 49 HG3 LYS 49 -9.339 -11.012 14.226 377 HD2 LYS 49 HD2 LYS 49 -6.944 -10.377 14.627 378 HD3 LYS 49 HD3 LYS 49 -7.164 -9.068 13.466 379 HE2 LYS 49 HE2 LYS 49 -7.589 -7.969 15.432 380 HE3 LYS 49 HE3 LYS 49 -9.217 -8.482 14.987 381 HZ1 LYS 49 HZ1 LYS 49 -8.704 -8.911 17.323 382 HZ2 LYS 49 HZ2 LYS 49 -7.423 -9.926 16.873 383 HZ3 LYS 49 HZ3 LYS 49 -9.020 -10.346 16.488 384 H GLN 50 H GLN 50 -6.278 -14.027 11.542 385 HA GLN 50 HA GLN 50 -6.458 -15.676 9.998 386 HB2 GLN 50 HB2 GLN 50 -8.290 -16.773 12.125 387 HB3 GLN 50 HB3 GLN 50 -7.766 -17.693 10.724 388 HG2 GLN 50 HG2 GLN 50 -5.917 -18.275 11.785 389 HG3 GLN 50 HG3 GLN 50 -5.466 -16.582 11.953 390 HE21 GLN 50 HE21 GLN 50 -4.542 -16.905 13.953 391 HE22 GLN 50 HE22 GLN 50 -5.475 -17.217 15.374 392 HA PRO 51 HA PRO 51 -10.416 -13.845 8.318 393 HB2 PRO 51 HB2 PRO 51 -9.230 -13.258 5.878 394 HB3 PRO 51 HB3 PRO 51 -9.475 -12.116 7.199 395 HG2 PRO 51 HG2 PRO 51 -7.016 -13.552 6.373 396 HG3 PRO 51 HG3 PRO 51 -7.195 -11.966 7.137 397 HD2 PRO 51 HD2 PRO 51 -6.365 -14.206 8.455 398 HD3 PRO 51 HD3 PRO 51 -7.189 -12.846 9.241 399 H MET 52 H MET 52 -8.120 -15.366 6.042 400 HA MET 52 HA MET 52 -10.257 -17.245 5.315 401 HB2 MET 52 HB2 MET 52 -7.866 -16.404 3.674 402 HB3 MET 52 HB3 MET 52 -9.143 -17.492 3.153 403 HG2 MET 52 HG2 MET 52 -9.337 -14.545 3.703 404 HG3 MET 52 HG3 MET 52 -9.568 -15.381 2.170 405 HE1 MET 52 HE1 MET 52 -11.553 -16.928 1.626 406 HE2 MET 52 HE2 MET 52 -12.980 -17.163 2.636 407 HE3 MET 52 HE3 MET 52 -11.444 -17.902 3.092 408 H LEU 53 H LEU 53 -7.622 -17.138 7.179 409 HA LEU 53 HA LEU 53 -6.200 -18.641 8.100 410 HB2 LEU 53 HB2 LEU 53 -8.378 -20.411 7.053 411 HB3 LEU 53 HB3 LEU 53 -6.968 -21.105 7.826 412 HG LEU 53 HG LEU 53 -8.448 -18.964 9.276 413 HD11 LEU 53 HD11 LEU 53 -9.999 -20.585 10.199 414 HD12 LEU 53 HD12 LEU 53 -9.343 -21.839 9.146 415 HD13 LEU 53 HD13 LEU 53 -10.204 -20.466 8.451 416 HD21 LEU 53 HD21 LEU 53 -7.110 -21.513 10.166 417 HD22 LEU 53 HD22 LEU 53 -7.702 -20.214 11.202 418 HD23 LEU 53 HD23 LEU 53 -6.337 -19.931 10.120 419 H ASP 54 H ASP 54 -5.063 -17.707 5.897 420 HA ASP 54 HA ASP 54 -3.471 -19.919 5.004 421 HB2 ASP 54 HB2 ASP 54 -5.490 -19.891 3.447 422 HB3 ASP 54 HB3 ASP 54 -4.887 -18.353 2.847 423 H VAL 55 H VAL 55 -1.512 -19.260 4.040 424 HA VAL 55 HA VAL 55 -0.510 -16.814 5.024 425 HB VAL 55 HB VAL 55 0.824 -18.551 2.950 426 HG11 VAL 55 HG11 VAL 55 1.843 -16.341 3.318 427 HG12 VAL 55 HG12 VAL 55 2.887 -17.653 3.864 428 HG13 VAL 55 HG13 VAL 55 1.975 -16.704 5.038 429 HG21 VAL 55 HG21 VAL 55 1.857 -19.752 4.796 430 HG22 VAL 55 HG22 VAL 55 0.101 -19.893 4.880 431 HG23 VAL 55 HG23 VAL 55 0.950 -18.783 5.957 432 HA PRO 56 HA PRO 56 -0.249 -15.249 0.443 433 HB2 PRO 56 HB2 PRO 56 -2.032 -16.366 -1.320 434 HB3 PRO 56 HB3 PRO 56 -0.339 -16.847 -1.181 435 HG2 PRO 56 HG2 PRO 56 -2.776 -18.132 -0.049 436 HG3 PRO 56 HG3 PRO 56 -1.335 -18.884 -0.755 437 HD2 PRO 56 HD2 PRO 56 -1.741 -18.755 1.912 438 HD3 PRO 56 HD3 PRO 56 -0.119 -18.674 1.199 439 H LYS 57 H LYS 57 -3.287 -16.381 1.770 440 HA LYS 57 HA LYS 57 -4.844 -14.212 0.712 441 HB2 LYS 57 HB2 LYS 57 -5.344 -16.474 2.596 442 HB3 LYS 57 HB3 LYS 57 -6.441 -15.104 2.637 443 HG2 LYS 57 HG2 LYS 57 -7.470 -16.577 1.182 444 HG3 LYS 57 HG3 LYS 57 -6.649 -15.454 0.100 445 HD2 LYS 57 HD2 LYS 57 -5.381 -17.074 -0.767 446 HD3 LYS 57 HD3 LYS 57 -4.955 -17.693 0.832 447 HE2 LYS 57 HE2 LYS 57 -7.153 -18.846 0.911 448 HE3 LYS 57 HE3 LYS 57 -7.459 -18.303 -0.741 449 HZ1 LYS 57 HZ1 LYS 57 -5.087 -19.933 0.000 450 HZ2 LYS 57 HZ2 LYS 57 -5.717 -19.643 -1.553 451 HZ3 LYS 57 HZ3 LYS 57 -6.564 -20.623 -0.468 452 H LEU 58 H LEU 58 -2.624 -14.491 3.199 453 HA LEU 58 HA LEU 58 -3.859 -12.535 4.952 454 HB2 LEU 58 HB2 LEU 58 -2.010 -14.598 5.306 455 HB3 LEU 58 HB3 LEU 58 -1.052 -13.144 5.460 456 HG LEU 58 HG LEU 58 -1.778 -13.958 7.628 457 HD11 LEU 58 HD11 LEU 58 -2.646 -11.920 8.526 458 HD12 LEU 58 HD12 LEU 58 -3.250 -11.425 6.946 459 HD13 LEU 58 HD13 LEU 58 -1.514 -11.527 7.232 460 HD21 LEU 58 HD21 LEU 58 -3.904 -14.464 8.218 461 HD22 LEU 58 HD22 LEU 58 -4.018 -14.818 6.493 462 HD23 LEU 58 HD23 LEU 58 -4.614 -13.282 7.123 463 H ALA 59 H ALA 59 -0.937 -12.806 2.976 464 HA ALA 59 HA ALA 59 -0.013 -10.182 3.387 465 HB1 ALA 59 HB1 ALA 59 1.425 -10.619 1.420 466 HB2 ALA 59 HB2 ALA 59 0.548 -12.127 1.161 467 HB3 ALA 59 HB3 ALA 59 1.483 -11.893 2.637 468 H VAL 60 H VAL 60 -2.123 -11.548 0.895 469 HA VAL 60 HA VAL 60 -2.126 -9.194 -0.709 470 HB VAL 60 HB VAL 60 -2.715 -11.532 -1.495 471 HG11 VAL 60 HG11 VAL 60 -5.457 -10.870 -0.447 472 HG12 VAL 60 HG12 VAL 60 -4.339 -11.962 0.368 473 HG13 VAL 60 HG13 VAL 60 -4.931 -12.352 -1.248 474 HG21 VAL 60 HG21 VAL 60 -3.013 -9.616 -2.922 475 HG22 VAL 60 HG22 VAL 60 -4.558 -9.247 -2.157 476 HG23 VAL 60 HG23 VAL 60 -4.382 -10.712 -3.123 477 H LEU 61 H LEU 61 -3.908 -10.214 2.084 478 HA LEU 61 HA LEU 61 -6.132 -8.468 1.769 479 HB2 LEU 61 HB2 LEU 61 -6.041 -10.491 3.265 480 HB3 LEU 61 HB3 LEU 61 -5.017 -9.569 4.349 481 HG LEU 61 HG LEU 61 -6.969 -7.864 4.385 482 HD11 LEU 61 HD11 LEU 61 -8.394 -10.337 3.412 483 HD12 LEU 61 HD12 LEU 61 -8.248 -8.804 2.551 484 HD13 LEU 61 HD13 LEU 61 -9.173 -8.890 4.050 485 HD21 LEU 61 HD21 LEU 61 -8.054 -9.118 6.200 486 HD22 LEU 61 HD22 LEU 61 -6.294 -9.172 6.305 487 HD23 LEU 61 HD23 LEU 61 -7.184 -10.566 5.697 488 H THR 62 H THR 62 -3.024 -8.237 3.423 489 HA THR 62 HA THR 62 -3.546 -5.681 4.554 490 HB THR 62 HB THR 62 -0.944 -5.689 4.737 491 HG1 THR 62 HG1 THR 62 -0.514 -7.350 3.262 492 HG21 THR 62 HG21 THR 62 -2.580 -6.159 6.555 493 HG22 THR 62 HG22 THR 62 -1.057 -7.029 6.712 494 HG23 THR 62 HG23 THR 62 -2.493 -7.868 6.120 495 H ALA 63 H ALA 63 -2.109 -6.816 1.559 496 HA ALA 63 HA ALA 63 -0.892 -4.445 0.693 497 HB1 ALA 63 HB1 ALA 63 -2.185 -6.540 -1.047 498 HB2 ALA 63 HB2 ALA 63 -0.583 -6.684 -0.325 499 HB3 ALA 63 HB3 ALA 63 -0.907 -5.415 -1.508 500 H VAL 64 H VAL 64 -4.172 -5.672 0.097 501 HA VAL 64 HA VAL 64 -4.935 -3.431 -1.474 502 HB VAL 64 HB VAL 64 -5.991 -5.687 -1.611 503 HG11 VAL 64 HG11 VAL 64 -7.750 -6.303 -0.080 504 HG12 VAL 64 HG12 VAL 64 -7.485 -4.839 0.866 505 HG13 VAL 64 HG13 VAL 64 -6.244 -6.088 0.807 506 HG21 VAL 64 HG21 VAL 64 -6.997 -3.719 -2.642 507 HG22 VAL 64 HG22 VAL 64 -7.883 -3.386 -1.154 508 HG23 VAL 64 HG23 VAL 64 -8.227 -4.848 -2.079 509 H GLN 65 H GLN 65 -5.104 -4.095 1.981 510 HA GLN 65 HA GLN 65 -6.891 -1.921 2.500 511 HB2 GLN 65 HB2 GLN 65 -5.280 -3.773 4.195 512 HB3 GLN 65 HB3 GLN 65 -5.873 -2.282 4.915 513 HG2 GLN 65 HG2 GLN 65 -7.737 -4.110 3.445 514 HG3 GLN 65 HG3 GLN 65 -7.300 -4.434 5.120 515 HE21 GLN 65 HE21 GLN 65 -7.687 -1.203 3.765 516 HE22 GLN 65 HE22 GLN 65 -9.110 -0.809 4.655 517 H ILE 66 H ILE 66 -3.388 -2.365 2.578 518 HA ILE 66 HA ILE 66 -2.708 0.110 3.705 519 HB ILE 66 HB ILE 66 -1.235 -1.767 1.873 520 HG12 ILE 66 HG12 ILE 66 -0.645 -0.892 4.707 521 HG13 ILE 66 HG13 ILE 66 -1.645 -2.283 4.317 522 HG21 ILE 66 HG21 ILE 66 -0.474 0.472 1.289 523 HG22 ILE 66 HG22 ILE 66 0.781 -0.403 2.162 524 HG23 ILE 66 HG23 ILE 66 -0.171 0.828 2.989 525 HD11 ILE 66 HD11 ILE 66 0.481 -3.131 4.805 526 HD12 ILE 66 HD12 ILE 66 1.286 -1.909 3.825 527 HD13 ILE 66 HD13 ILE 66 0.349 -3.184 3.047 528 H ALA 67 H ALA 67 -3.317 -0.881 0.382 529 HA ALA 67 HA ALA 67 -2.599 1.548 -0.852 530 HB1 ALA 67 HB1 ALA 67 -4.574 -0.496 -1.850 531 HB2 ALA 67 HB2 ALA 67 -2.824 -0.613 -2.027 532 HB3 ALA 67 HB3 ALA 67 -3.703 0.696 -2.814 533 H SER 68 H SER 68 -5.730 0.355 0.338 534 HA SER 68 HA SER 68 -7.228 2.540 -0.675 535 HB2 SER 68 HB2 SER 68 -8.824 1.646 1.283 536 HB3 SER 68 HB3 SER 68 -8.641 0.797 -0.252 537 HG SER 68 HG SER 68 -7.382 -0.693 0.698 538 H GLU 69 H GLU 69 -5.820 1.872 2.528 539 HA GLU 69 HA GLU 69 -6.920 4.180 3.752 540 HB2 GLU 69 HB2 GLU 69 -5.524 3.698 5.621 541 HB3 GLU 69 HB3 GLU 69 -6.080 2.163 4.969 542 HG2 GLU 69 HG2 GLU 69 -3.950 1.826 3.883 543 HG3 GLU 69 HG3 GLU 69 -3.382 3.394 4.453 544 H TYR 70 H TYR 70 -4.275 3.810 1.599 545 HA TYR 70 HA TYR 70 -3.182 6.393 2.442 546 HB2 TYR 70 HB2 TYR 70 -2.069 4.090 0.929 547 HB3 TYR 70 HB3 TYR 70 -1.450 5.697 0.550 548 HD1 TYR 70 HD2 TYR 70 -0.328 7.031 2.293 549 HD2 TYR 70 HD1 TYR 70 -1.535 3.017 3.006 550 HE1 TYR 70 HE2 TYR 70 1.111 6.955 4.277 551 HE2 TYR 70 HE1 TYR 70 -0.105 2.938 5.004 552 HH TYR 70 HH TYR 70 2.009 4.184 5.826 553 H LEU 71 H LEU 71 -5.016 4.915 -0.098 554 HA LEU 71 HA LEU 71 -4.604 6.808 -2.138 555 HB2 LEU 71 HB2 LEU 71 -6.676 4.779 -1.516 556 HB3 LEU 71 HB3 LEU 71 -7.152 6.066 -2.608 557 HG LEU 71 HG LEU 71 -4.647 4.466 -3.104 558 HD11 LEU 71 HD11 LEU 71 -7.451 3.749 -3.941 559 HD12 LEU 71 HD12 LEU 71 -6.341 2.785 -2.964 560 HD13 LEU 71 HD13 LEU 71 -5.991 3.074 -4.665 561 HD21 LEU 71 HD21 LEU 71 -4.740 5.289 -5.271 562 HD22 LEU 71 HD22 LEU 71 -5.251 6.671 -4.303 563 HD23 LEU 71 HD23 LEU 71 -6.452 5.698 -5.152 564 H LYS 72 H LYS 72 -6.882 6.670 0.536 565 HA LYS 72 HA LYS 72 -8.402 8.943 -0.088 566 HB2 LYS 72 HB2 LYS 72 -8.949 8.924 2.380 567 HB3 LYS 72 HB3 LYS 72 -9.256 7.418 1.526 568 HG2 LYS 72 HG2 LYS 72 -7.530 6.314 2.566 569 HG3 LYS 72 HG3 LYS 72 -6.644 7.799 2.909 570 HD2 LYS 72 HD2 LYS 72 -7.429 7.129 4.994 571 HD3 LYS 72 HD3 LYS 72 -8.602 8.344 4.492 572 HE2 LYS 72 HE2 LYS 72 -9.317 5.675 3.597 573 HE3 LYS 72 HE3 LYS 72 -9.156 5.775 5.350 574 HZ1 LYS 72 HZ1 LYS 72 -10.613 7.836 5.131 575 HZ2 LYS 72 HZ2 LYS 72 -11.355 6.333 4.931 576 HZ3 LYS 72 HZ3 LYS 72 -10.985 7.274 3.574 577 H LEU 73 H LEU 73 -5.240 8.613 1.300 578 HA LEU 73 HA LEU 73 -5.201 11.226 2.486 579 HB2 LEU 73 HB2 LEU 73 -3.791 9.080 3.058 580 HB3 LEU 73 HB3 LEU 73 -2.719 9.695 1.819 581 HG LEU 73 HG LEU 73 -2.079 10.270 4.174 582 HD11 LEU 73 HD11 LEU 73 -1.202 11.533 2.295 583 HD12 LEU 73 HD12 LEU 73 -1.462 12.570 3.695 584 HD13 LEU 73 HD13 LEU 73 -2.600 12.608 2.348 585 HD21 LEU 73 HD21 LEU 73 -4.557 10.762 4.772 586 HD22 LEU 73 HD22 LEU 73 -4.198 12.378 4.151 587 HD23 LEU 73 HD23 LEU 73 -3.273 11.722 5.499 588 H LYS 74 H LYS 74 -3.723 9.757 -0.407 589 HA LYS 74 HA LYS 74 -2.572 12.194 -1.282 590 HB2 LYS 74 HB2 LYS 74 -2.143 11.075 -3.403 591 HB3 LYS 74 HB3 LYS 74 -1.713 10.038 -2.059 592 HG2 LYS 74 HG2 LYS 74 -4.039 8.975 -2.404 593 HG3 LYS 74 HG3 LYS 74 -3.997 9.775 -3.972 594 HD2 LYS 74 HD2 LYS 74 -1.785 7.983 -2.993 595 HD3 LYS 74 HD3 LYS 74 -3.158 7.385 -3.917 596 HE2 LYS 74 HE2 LYS 74 -1.287 9.552 -4.859 597 HE3 LYS 74 HE3 LYS 74 -1.135 7.849 -5.286 598 HZ1 LYS 74 HZ1 LYS 74 -3.339 7.964 -6.305 599 HZ2 LYS 74 HZ2 LYS 74 -2.266 9.057 -7.017 600 HZ3 LYS 74 HZ3 LYS 74 -3.435 9.610 -5.932 601 H GLU 75 H GLU 75 -5.721 10.808 -1.572 602 HA GLU 75 HA GLU 75 -6.666 12.328 -3.763 603 HB2 GLU 75 HB2 GLU 75 -7.778 10.279 -2.843 604 HB3 GLU 75 HB3 GLU 75 -8.266 11.222 -1.444 605 HG2 GLU 75 HG2 GLU 75 -10.106 11.043 -2.967 606 HG3 GLU 75 HG3 GLU 75 -9.549 12.715 -2.923 607 H GLU 76 H GLU 76 -6.631 12.886 -0.260 608 HA GLU 76 HA GLU 76 -8.181 15.218 -0.218 609 HB2 GLU 76 HB2 GLU 76 -7.553 14.029 1.843 610 HB3 GLU 76 HB3 GLU 76 -5.871 14.496 1.605 611 HG2 GLU 76 HG2 GLU 76 -6.708 16.903 1.661 612 HG3 GLU 76 HG3 GLU 76 -8.215 16.241 2.282 613 H TYR 77 H TYR 77 -4.722 14.743 -0.713 614 HA TYR 77 HA TYR 77 -3.927 17.414 -0.712 615 HB2 TYR 77 HB2 TYR 77 -2.321 15.582 -0.650 616 HB3 TYR 77 HB3 TYR 77 -2.791 15.079 -2.268 617 HD1 TYR 77 HD2 TYR 77 -2.108 18.529 -1.025 618 HD2 TYR 77 HD1 TYR 77 -0.827 15.315 -3.502 619 HE1 TYR 77 HE2 TYR 77 -0.368 19.972 -1.973 620 HE2 TYR 77 HE1 TYR 77 0.925 16.749 -4.460 621 HH TYR 77 HH TYR 77 1.358 19.151 -4.782 622 H GLN 78 H GLN 78 -5.262 15.426 -3.291 623 HA GLN 78 HA GLN 78 -4.845 17.330 -5.372 624 HB2 GLN 78 HB2 GLN 78 -6.787 15.018 -5.211 625 HB3 GLN 78 HB3 GLN 78 -6.414 15.925 -6.670 626 HG2 GLN 78 HG2 GLN 78 -4.544 14.176 -5.093 627 HG3 GLN 78 HG3 GLN 78 -5.216 13.856 -6.689 628 HE21 GLN 78 HE21 GLN 78 -2.730 15.347 -4.913 629 HE22 GLN 78 HE22 GLN 78 -1.865 16.021 -6.250 630 H ARG 79 H ARG 79 -7.474 16.651 -3.145 631 HA ARG 79 HA ARG 79 -9.345 18.389 -4.476 632 HB2 ARG 79 HB2 ARG 79 -9.512 17.323 -1.653 633 HB3 ARG 79 HB3 ARG 79 -10.833 17.943 -2.630 634 HG2 ARG 79 HG2 ARG 79 -9.271 15.434 -3.229 635 HG3 ARG 79 HG3 ARG 79 -10.844 15.494 -2.439 636 HD2 ARG 79 HD2 ARG 79 -10.177 16.331 -5.257 637 HD3 ARG 79 HD3 ARG 79 -11.165 14.962 -4.753 638 HE ARG 79 HE ARG 79 -11.963 17.725 -4.948 639 HH11 ARG 79 HH11 ARG 79 -12.665 14.617 -3.497 640 HH12 ARG 79 HH12 ARG 79 -14.330 14.988 -3.185 641 HH21 ARG 79 HH21 ARG 79 -14.160 18.218 -4.537 642 HH22 ARG 79 HH22 ARG 79 -15.179 17.041 -3.767 643 H LEU 80 H LEU 80 -7.179 18.585 -1.740 644 HA LEU 80 HA LEU 80 -8.067 21.047 -0.704 645 HB2 LEU 80 HB2 LEU 80 -6.709 19.467 0.553 646 HB3 LEU 80 HB3 LEU 80 -5.375 19.706 -0.561 647 HG LEU 80 HG LEU 80 -5.475 22.184 0.181 648 HD11 LEU 80 HD11 LEU 80 -6.325 22.522 2.448 649 HD12 LEU 80 HD12 LEU 80 -6.947 20.871 2.460 650 HD13 LEU 80 HD13 LEU 80 -7.612 22.054 1.336 651 HD21 LEU 80 HD21 LEU 80 -4.527 19.987 2.016 652 HD22 LEU 80 HD22 LEU 80 -4.052 21.682 2.147 653 HD23 LEU 80 HD23 LEU 80 -3.614 20.752 0.714 654 H ARG 81 H ARG 81 -5.453 20.255 -2.978 655 HA ARG 81 HA ARG 81 -4.588 22.952 -3.227 656 HB2 ARG 81 HB2 ARG 81 -4.042 20.458 -4.809 657 HB3 ARG 81 HB3 ARG 81 -3.428 22.025 -5.331 658 HG2 ARG 81 HG2 ARG 81 -2.839 21.707 -2.568 659 HG3 ARG 81 HG3 ARG 81 -2.334 20.248 -3.422 660 HD2 ARG 81 HD2 ARG 81 -0.610 22.084 -3.237 661 HD3 ARG 81 HD3 ARG 81 -0.907 21.467 -4.857 662 HE ARG 81 HE ARG 81 -2.055 23.476 -5.379 663 HH11 ARG 81 HH11 ARG 81 -0.498 23.531 -2.241 664 HH12 ARG 81 HH12 ARG 81 -0.519 25.259 -2.122 665 HH21 ARG 81 HH21 ARG 81 -2.061 25.752 -5.223 666 HH22 ARG 81 HH22 ARG 81 -1.396 26.515 -3.813 667 H GLU 82 H GLU 82 -6.951 21.011 -4.955 668 HA GLU 82 HA GLU 82 -7.219 22.808 -7.140 669 HB2 GLU 82 HB2 GLU 82 -8.871 21.417 -7.916 670 HB3 GLU 82 HB3 GLU 82 -8.014 20.314 -6.852 671 HG2 GLU 82 HG2 GLU 82 -9.670 20.758 -5.093 672 HG3 GLU 82 HG3 GLU 82 -10.543 21.809 -6.207 673 H GLN 83 H GLN 83 -8.592 22.629 -3.944 674 HA GLN 83 HA GLN 83 -10.661 24.549 -4.433 675 HB2 GLN 83 HB2 GLN 83 -10.557 22.738 -2.586 676 HB3 GLN 83 HB3 GLN 83 -9.546 23.887 -1.717 677 HG2 GLN 83 HG2 GLN 83 -11.720 24.216 -0.909 678 HG3 GLN 83 HG3 GLN 83 -11.418 25.556 -2.010 679 HE21 GLN 83 HE21 GLN 83 -13.944 24.491 -1.127 680 HE22 GLN 83 HE22 GLN 83 -14.794 23.973 -2.540 681 H LEU 84 H LEU 84 -7.327 24.623 -3.563 682 HA LEU 84 HA LEU 84 -7.351 27.319 -2.564 683 HB2 LEU 84 HB2 LEU 84 -5.385 25.195 -2.853 684 HB3 LEU 84 HB3 LEU 84 -4.737 26.739 -3.360 685 HG LEU 84 HG LEU 84 -4.201 26.344 -1.031 686 HD11 LEU 84 HD11 LEU 84 -6.353 28.388 -0.830 687 HD12 LEU 84 HD12 LEU 84 -5.026 28.659 -1.959 688 HD13 LEU 84 HD13 LEU 84 -4.694 28.434 -0.242 689 HD21 LEU 84 HD21 LEU 84 -5.954 24.826 -0.388 690 HD22 LEU 84 HD22 LEU 84 -7.180 26.069 -0.640 691 HD23 LEU 84 HD23 LEU 84 -6.010 26.237 0.668 692 H LYS 85 H LYS 85 -7.136 25.783 -5.617 693 HA LYS 85 HA LYS 85 -6.034 28.095 -6.970 694 HB2 LYS 85 HB2 LYS 85 -7.024 25.406 -7.908 695 HB3 LYS 85 HB3 LYS 85 -6.570 26.677 -9.034 696 HG2 LYS 85 HG2 LYS 85 -4.319 26.644 -8.301 697 HG3 LYS 85 HG3 LYS 85 -4.717 25.625 -6.915 698 HD2 LYS 85 HD2 LYS 85 -3.646 24.302 -8.648 699 HD3 LYS 85 HD3 LYS 85 -5.327 23.806 -8.458 700 HE2 LYS 85 HE2 LYS 85 -4.923 25.919 -10.442 701 HE3 LYS 85 HE3 LYS 85 -4.110 24.404 -10.835 702 HZ1 LYS 85 HZ1 LYS 85 -6.178 23.245 -10.697 703 HZ2 LYS 85 HZ2 LYS 85 -6.398 24.581 -11.709 704 HZ3 LYS 85 HZ3 LYS 85 -6.985 24.618 -10.126 705 H LYS 86 H LYS 86 -9.010 27.268 -5.790 706 HA LYS 86 HA LYS 86 -10.523 28.511 -7.953 707 HB2 LYS 86 HB2 LYS 86 -11.198 26.351 -6.670 708 HB3 LYS 86 HB3 LYS 86 -11.716 27.457 -5.409 709 HG2 LYS 86 HG2 LYS 86 -12.684 27.709 -8.238 710 HG3 LYS 86 HG3 LYS 86 -13.474 26.659 -7.063 711 HD2 LYS 86 HD2 LYS 86 -13.984 28.506 -5.644 712 HD3 LYS 86 HD3 LYS 86 -12.983 29.592 -6.607 713 HE2 LYS 86 HE2 LYS 86 -14.522 29.165 -8.531 714 HE3 LYS 86 HE3 LYS 86 -15.563 28.275 -7.419 715 HZ1 LYS 86 HZ1 LYS 86 -16.248 30.600 -7.742 716 HZ2 LYS 86 HZ2 LYS 86 -14.780 31.115 -7.079 717 HZ3 LYS 86 HZ3 LYS 86 -15.877 30.252 -6.128 718 H1 GLY 1 H1 GLY 1 -38.902 -0.610 18.178 719 H2 GLY 1 H2 GLY 1 -37.604 -1.223 19.068 720 H3 GLY 1 H3 GLY 1 -38.523 -2.253 18.097 721 HA2 GLY 1 HA3 GLY 1 -36.366 -1.692 17.100 722 HA3 GLY 1 HA2 GLY 1 -37.744 -1.235 16.110 723 H SER 2 H SER 2 -34.916 -0.189 16.406 724 HA SER 2 HA SER 2 -35.640 2.602 16.254 725 HB2 SER 2 HB2 SER 2 -33.641 1.647 18.319 726 HB3 SER 2 HB3 SER 2 -33.953 3.333 17.907 727 HG SER 2 HG SER 2 -36.287 2.180 18.440 728 H HIS 3 H HIS 3 -34.041 3.874 15.181 729 HA HIS 3 HA HIS 3 -31.771 2.369 14.092 730 HB2 HIS 3 HB2 HIS 3 -34.077 3.178 12.606 731 HB3 HIS 3 HB3 HIS 3 -32.693 4.115 12.052 732 HD1 HIS 3 HD1 HIS 3 -31.352 3.016 10.288 733 HD2 HIS 3 HD2 HIS 3 -33.413 0.265 12.624 734 HE1 HIS 3 HE1 HIS 3 -30.862 0.771 9.275 735 HE2 HIS 3 HE2 HIS 3 -31.978 -0.888 10.805 736 H MET 4 H MET 4 -29.969 3.414 14.445 737 HA MET 4 HA MET 4 -30.012 6.204 15.226 738 HB2 MET 4 HB2 MET 4 -27.724 4.233 15.003 739 HB3 MET 4 HB3 MET 4 -27.602 5.853 15.679 740 HG2 MET 4 HG2 MET 4 -28.926 5.300 17.533 741 HG3 MET 4 HG3 MET 4 -29.508 3.815 16.785 742 HE1 MET 4 HE1 MET 4 -25.961 5.417 17.222 743 HE2 MET 4 HE2 MET 4 -25.305 4.463 18.549 744 HE3 MET 4 HE3 MET 4 -26.675 5.540 18.830 745 H THR 5 H THR 5 -29.446 7.881 13.958 746 HA THR 5 HA THR 5 -28.953 7.375 11.166 747 HB THR 5 HB THR 5 -28.704 10.151 12.067 748 HG1 THR 5 HG1 THR 5 -30.261 9.977 13.509 749 HG21 THR 5 HG21 THR 5 -30.468 10.456 10.350 750 HG22 THR 5 HG22 THR 5 -30.535 8.706 10.151 751 HG23 THR 5 HG23 THR 5 -29.062 9.583 9.739 752 H GLU 6 H GLU 6 -26.884 6.336 11.405 753 HA GLU 6 HA GLU 6 -24.684 8.275 11.613 754 HB2 GLU 6 HB2 GLU 6 -23.314 6.426 12.649 755 HB3 GLU 6 HB3 GLU 6 -24.597 7.061 13.675 756 HG2 GLU 6 HG2 GLU 6 -25.951 5.172 13.323 757 HG3 GLU 6 HG3 GLU 6 -24.957 4.617 11.978 758 H GLN 7 H GLN 7 -22.730 7.590 10.467 759 HA GLN 7 HA GLN 7 -23.168 5.520 8.445 760 HB2 GLN 7 HB2 GLN 7 -23.788 7.659 7.397 761 HB3 GLN 7 HB3 GLN 7 -22.214 8.321 7.819 762 HG2 GLN 7 HG2 GLN 7 -21.235 6.408 6.450 763 HG3 GLN 7 HG3 GLN 7 -22.868 6.176 5.832 764 HE21 GLN 7 HE21 GLN 7 -21.543 9.312 6.644 765 HE22 GLN 7 HE22 GLN 7 -21.447 9.901 5.020 766 HA PRO 8 HA PRO 8 -18.972 5.126 10.224 767 HB2 PRO 8 HB2 PRO 8 -18.980 2.451 10.448 768 HB3 PRO 8 HB3 PRO 8 -19.778 3.481 11.641 769 HG2 PRO 8 HG2 PRO 8 -20.971 1.933 9.379 770 HG3 PRO 8 HG3 PRO 8 -21.569 2.134 11.036 771 HD2 PRO 8 HD2 PRO 8 -22.500 3.553 8.880 772 HD3 PRO 8 HD3 PRO 8 -22.566 4.135 10.553 773 H LYS 9 H LYS 9 -17.204 3.425 9.449 774 HA LYS 9 HA LYS 9 -16.883 3.850 6.661 775 HB2 LYS 9 HB2 LYS 9 -15.333 2.120 8.596 776 HB3 LYS 9 HB3 LYS 9 -14.855 2.395 6.926 777 HG2 LYS 9 HG2 LYS 9 -14.747 4.834 7.427 778 HG3 LYS 9 HG3 LYS 9 -15.057 4.444 9.120 779 HD2 LYS 9 HD2 LYS 9 -12.998 2.778 8.641 780 HD3 LYS 9 HD3 LYS 9 -12.613 4.064 7.498 781 HE2 LYS 9 HE2 LYS 9 -13.200 4.526 10.416 782 HE3 LYS 9 HE3 LYS 9 -11.575 4.318 9.763 783 HZ1 LYS 9 HZ1 LYS 9 -11.907 6.271 8.392 784 HZ2 LYS 9 HZ2 LYS 9 -12.157 6.649 10.019 785 HZ3 LYS 9 HZ3 LYS 9 -13.481 6.462 8.984 786 H THR 10 H THR 10 -17.794 2.716 5.072 787 HA THR 10 HA THR 10 -19.054 0.191 5.613 788 HB THR 10 HB THR 10 -20.040 1.950 4.093 789 HG1 THR 10 HG1 THR 10 -20.238 0.047 2.331 790 HG21 THR 10 HG21 THR 10 -19.283 1.954 1.746 791 HG22 THR 10 HG22 THR 10 -17.905 0.952 2.202 792 HG23 THR 10 HG23 THR 10 -18.060 2.589 2.843 793 H ARG 11 H ARG 11 -18.676 -1.721 4.285 794 HA ARG 11 HA ARG 11 -15.826 -1.999 3.597 795 HB2 ARG 11 HB2 ARG 11 -15.979 -4.347 4.216 796 HB3 ARG 11 HB3 ARG 11 -16.478 -3.337 5.562 797 HG2 ARG 11 HG2 ARG 11 -18.861 -3.770 4.857 798 HG3 ARG 11 HG3 ARG 11 -18.216 -4.974 3.743 799 HD2 ARG 11 HD2 ARG 11 -17.168 -6.137 5.636 800 HD3 ARG 11 HD3 ARG 11 -17.863 -4.945 6.736 801 HE ARG 11 HE ARG 11 -19.589 -6.601 5.023 802 HH11 ARG 11 HH11 ARG 11 -18.594 -5.540 8.201 803 HH12 ARG 11 HH12 ARG 11 -19.937 -6.279 9.008 804 HH21 ARG 11 HH21 ARG 11 -21.352 -7.595 6.081 805 HH22 ARG 11 HH22 ARG 11 -21.503 -7.462 7.804 806 H VAL 12 H VAL 12 -15.311 -3.347 1.782 807 HA VAL 12 HA VAL 12 -17.572 -3.831 -0.039 808 HB VAL 12 HB VAL 12 -16.558 -1.701 -0.682 809 HG11 VAL 12 HG11 VAL 12 -14.012 -3.283 -1.005 810 HG12 VAL 12 HG12 VAL 12 -14.318 -2.016 0.181 811 HG13 VAL 12 HG13 VAL 12 -14.249 -1.618 -1.536 812 HG21 VAL 12 HG21 VAL 12 -16.036 -3.972 -2.591 813 HG22 VAL 12 HG22 VAL 12 -16.001 -2.269 -3.044 814 HG23 VAL 12 HG23 VAL 12 -17.499 -2.995 -2.460 815 H SER 13 H SER 13 -17.374 -5.543 -1.428 816 HA SER 13 HA SER 13 -15.129 -7.367 -0.919 817 HB2 SER 13 HB2 SER 13 -17.782 -8.038 -2.214 818 HB3 SER 13 HB3 SER 13 -16.580 -9.162 -1.577 819 HG SER 13 HG SER 13 -18.628 -8.172 -0.300 820 H VAL 14 H VAL 14 -13.724 -7.811 -2.514 821 HA VAL 14 HA VAL 14 -14.477 -7.254 -5.292 822 HB VAL 14 HB VAL 14 -11.933 -6.404 -5.410 823 HG11 VAL 14 HG11 VAL 14 -13.835 -5.228 -6.336 824 HG12 VAL 14 HG12 VAL 14 -12.834 -4.103 -5.418 825 HG13 VAL 14 HG13 VAL 14 -14.336 -4.713 -4.725 826 HG21 VAL 14 HG21 VAL 14 -11.570 -4.813 -3.515 827 HG22 VAL 14 HG22 VAL 14 -11.457 -6.514 -3.064 828 HG23 VAL 14 HG23 VAL 14 -12.908 -5.594 -2.675 829 H ARG 15 H ARG 15 -12.933 -8.187 -6.854 830 HA ARG 15 HA ARG 15 -11.957 -10.765 -5.854 831 HB2 ARG 15 HB2 ARG 15 -13.581 -10.731 -7.742 832 HB3 ARG 15 HB3 ARG 15 -12.396 -9.854 -8.701 833 HG2 ARG 15 HG2 ARG 15 -11.031 -12.094 -7.782 834 HG3 ARG 15 HG3 ARG 15 -12.640 -12.683 -8.211 835 HD2 ARG 15 HD2 ARG 15 -11.457 -12.872 -10.198 836 HD3 ARG 15 HD3 ARG 15 -12.311 -11.343 -10.385 837 HE ARG 15 HE ARG 15 -9.979 -10.497 -9.405 838 HH11 ARG 15 HH11 ARG 15 -10.728 -12.743 -11.979 839 HH12 ARG 15 HH12 ARG 15 -9.221 -12.510 -12.807 840 HH21 ARG 15 HH21 ARG 15 -7.959 -10.181 -10.499 841 HH22 ARG 15 HH22 ARG 15 -7.663 -11.055 -11.975 842 H ILE 16 H ILE 16 -9.894 -10.542 -5.159 843 HA ILE 16 HA ILE 16 -8.006 -9.104 -6.899 844 HB ILE 16 HB ILE 16 -7.489 -9.923 -4.045 845 HG12 ILE 16 HG12 ILE 16 -8.363 -7.174 -4.930 846 HG13 ILE 16 HG13 ILE 16 -9.513 -8.382 -4.365 847 HG21 ILE 16 HG21 ILE 16 -5.747 -8.223 -4.155 848 HG22 ILE 16 HG22 ILE 16 -6.225 -7.822 -5.804 849 HG23 ILE 16 HG23 ILE 16 -5.536 -9.404 -5.447 850 HD11 ILE 16 HD11 ILE 16 -7.299 -7.062 -2.829 851 HD12 ILE 16 HD12 ILE 16 -8.128 -8.507 -2.253 852 HD13 ILE 16 HD13 ILE 16 -9.034 -7.018 -2.515 853 H TYR 17 H TYR 17 -6.762 -10.289 -8.122 854 HA TYR 17 HA TYR 17 -5.495 -11.954 -8.959 855 HB2 TYR 17 HB2 TYR 17 -4.485 -11.606 -6.534 856 HB3 TYR 17 HB3 TYR 17 -5.103 -13.239 -6.296 857 HD1 TYR 17 HD2 TYR 17 -3.318 -11.451 -9.062 858 HD2 TYR 17 HD1 TYR 17 -3.461 -14.847 -6.506 859 HE1 TYR 17 HE2 TYR 17 -1.317 -12.360 -10.170 860 HE2 TYR 17 HE1 TYR 17 -1.464 -15.764 -7.603 861 HH TYR 17 HH TYR 17 0.417 -13.918 -9.890 862 H GLY 18 H GLY 18 -8.445 -12.381 -8.245 863 HA2 GLY 18 HA2 GLY 18 -9.620 -14.173 -9.386 864 HA3 GLY 18 HA3 GLY 18 -8.389 -15.278 -8.798 865 H GLN 19 H GLN 19 -8.619 -13.796 -6.093 866 HA GLN 19 HA GLN 19 -10.938 -15.379 -5.214 867 HB2 GLN 19 HB2 GLN 19 -8.448 -14.500 -3.768 868 HB3 GLN 19 HB3 GLN 19 -9.850 -15.140 -2.920 869 HG2 GLN 19 HG2 GLN 19 -8.470 -16.627 -5.133 870 HG3 GLN 19 HG3 GLN 19 -7.993 -16.770 -3.443 871 HE21 GLN 19 HE21 GLN 19 -8.504 -18.965 -3.451 872 HE22 GLN 19 HE22 GLN 19 -10.138 -19.525 -3.404 873 H ASP 20 H ASP 20 -12.374 -14.538 -3.642 874 HA ASP 20 HA ASP 20 -12.777 -11.671 -3.930 875 HB2 ASP 20 HB2 ASP 20 -14.974 -12.168 -2.776 876 HB3 ASP 20 HB3 ASP 20 -14.743 -12.972 -4.323 877 H TYR 21 H TYR 21 -12.499 -10.208 -2.365 878 HA TYR 21 HA TYR 21 -12.103 -11.134 0.395 879 HB2 TYR 21 HB2 TYR 21 -10.322 -9.143 -1.038 880 HB3 TYR 21 HB3 TYR 21 -10.216 -9.570 0.665 881 HD1 TYR 21 HD2 TYR 21 -9.567 -11.933 1.282 882 HD2 TYR 21 HD1 TYR 21 -9.226 -10.433 -2.682 883 HE1 TYR 21 HE2 TYR 21 -8.004 -13.748 0.732 884 HE2 TYR 21 HE1 TYR 21 -7.662 -12.242 -3.239 885 HH TYR 21 HH TYR 21 -6.131 -13.750 -2.111 886 H THR 22 H THR 22 -12.878 -9.757 1.948 887 HA THR 22 HA THR 22 -14.259 -7.344 0.978 888 HB THR 22 HB THR 22 -14.931 -9.026 3.405 889 HG1 THR 22 HG1 THR 22 -16.311 -8.734 0.913 890 HG21 THR 22 HG21 THR 22 -16.976 -7.654 3.490 891 HG22 THR 22 HG22 THR 22 -16.358 -6.669 2.164 892 HG23 THR 22 HG23 THR 22 -15.524 -6.678 3.718 893 H ILE 23 H ILE 23 -13.285 -5.532 1.543 894 HA ILE 23 HA ILE 23 -11.925 -5.404 4.146 895 HB ILE 23 HB ILE 23 -10.169 -3.979 3.181 896 HG12 ILE 23 HG12 ILE 23 -11.606 -3.380 1.120 897 HG13 ILE 23 HG13 ILE 23 -9.875 -3.565 0.902 898 HG21 ILE 23 HG21 ILE 23 -10.446 -6.809 2.258 899 HG22 ILE 23 HG22 ILE 23 -9.448 -6.140 3.547 900 HG23 ILE 23 HG23 ILE 23 -9.011 -5.861 1.863 901 HD11 ILE 23 HD11 ILE 23 -11.527 -5.963 0.395 902 HD12 ILE 23 HD12 ILE 23 -10.110 -5.361 -0.454 903 HD13 ILE 23 HD13 ILE 23 -11.683 -4.628 -0.741 904 H VAL 24 H VAL 24 -11.337 -2.985 4.580 905 HA VAL 24 HA VAL 24 -13.833 -1.571 4.562 906 HB VAL 24 HB VAL 24 -11.110 -0.759 5.595 907 HG11 VAL 24 HG11 VAL 24 -12.282 0.991 6.844 908 HG12 VAL 24 HG12 VAL 24 -13.792 0.552 6.046 909 HG13 VAL 24 HG13 VAL 24 -12.458 1.216 5.105 910 HG21 VAL 24 HG21 VAL 24 -12.085 -2.700 6.732 911 HG22 VAL 24 HG22 VAL 24 -13.548 -1.771 7.060 912 HG23 VAL 24 HG23 VAL 24 -12.017 -1.292 7.791 913 H GLY 25 H GLY 25 -14.490 -0.046 3.177 914 HA2 GLY 25 HA2 GLY 25 -12.574 1.576 1.716 915 HA3 GLY 25 HA3 GLY 25 -13.554 0.497 0.729 916 H ALA 26 H ALA 26 -13.630 3.224 2.931 917 HA ALA 26 HA ALA 26 -16.439 3.709 2.237 918 HB1 ALA 26 HB1 ALA 26 -14.828 5.062 4.388 919 HB2 ALA 26 HB2 ALA 26 -15.772 3.596 4.642 920 HB3 ALA 26 HB3 ALA 26 -16.579 5.092 4.172 921 H GLU 27 H GLU 27 -13.863 4.359 0.681 922 HA GLU 27 HA GLU 27 -13.767 7.213 0.598 923 HB2 GLU 27 HB2 GLU 27 -12.511 4.985 -0.931 924 HB3 GLU 27 HB3 GLU 27 -12.575 6.560 -1.710 925 HG2 GLU 27 HG2 GLU 27 -10.520 5.857 -0.267 926 HG3 GLU 27 HG3 GLU 27 -11.127 7.512 -0.222 927 H SER 28 H SER 28 -14.516 5.104 -2.179 928 HA SER 28 HA SER 28 -17.087 6.251 -2.597 929 HB2 SER 28 HB2 SER 28 -16.117 7.060 -4.996 930 HB3 SER 28 HB3 SER 28 -16.313 8.135 -3.613 931 HG SER 28 HG SER 28 -14.255 8.454 -4.100 932 HA PRO 29 HA PRO 29 -17.847 2.466 -4.671 933 HB2 PRO 29 HB2 PRO 29 -19.239 3.449 -6.897 934 HB3 PRO 29 HB3 PRO 29 -19.940 2.989 -5.344 935 HG2 PRO 29 HG2 PRO 29 -19.181 5.688 -6.358 936 HG3 PRO 29 HG3 PRO 29 -20.551 5.219 -5.336 937 HD2 PRO 29 HD2 PRO 29 -18.417 6.444 -4.300 938 HD3 PRO 29 HD3 PRO 29 -19.236 5.141 -3.412 939 H ALA 30 H ALA 30 -16.896 5.066 -6.925 940 HA ALA 30 HA ALA 30 -15.874 3.191 -8.835 941 HB1 ALA 30 HB1 ALA 30 -15.366 6.154 -8.747 942 HB2 ALA 30 HB2 ALA 30 -16.824 5.423 -9.416 943 HB3 ALA 30 HB3 ALA 30 -15.254 5.076 -10.139 944 H HIS 31 H HIS 31 -14.462 5.251 -6.343 945 HA HIS 31 HA HIS 31 -11.764 4.890 -7.085 946 HB2 HIS 31 HB2 HIS 31 -13.183 5.943 -4.726 947 HB3 HIS 31 HB3 HIS 31 -11.583 5.292 -4.402 948 HD1 HIS 31 HD1 HIS 31 -13.171 7.768 -6.826 949 HD2 HIS 31 HD2 HIS 31 -9.622 7.104 -4.771 950 HE1 HIS 31 HE1 HIS 31 -11.730 9.768 -7.307 951 HE2 HIS 31 HE2 HIS 31 -9.682 9.452 -5.865 952 H ILE 32 H ILE 32 -13.842 3.101 -4.841 953 HA ILE 32 HA ILE 32 -11.796 1.408 -3.865 954 HB ILE 32 HB ILE 32 -13.542 -0.019 -2.959 955 HG12 ILE 32 HG12 ILE 32 -15.434 1.673 -4.617 956 HG13 ILE 32 HG13 ILE 32 -15.116 -0.044 -4.806 957 HG21 ILE 32 HG21 ILE 32 -12.905 2.167 -1.913 958 HG22 ILE 32 HG22 ILE 32 -14.494 1.555 -1.455 959 HG23 ILE 32 HG23 ILE 32 -14.355 2.858 -2.638 960 HD11 ILE 32 HD11 ILE 32 -16.020 -0.278 -2.425 961 HD12 ILE 32 HD12 ILE 32 -17.164 0.057 -3.726 962 HD13 ILE 32 HD13 ILE 32 -16.647 1.355 -2.652 963 H ARG 33 H ARG 33 -13.444 1.389 -6.863 964 HA ARG 33 HA ARG 33 -13.215 -1.419 -7.369 965 HB2 ARG 33 HB2 ARG 33 -13.630 0.891 -9.272 966 HB3 ARG 33 HB3 ARG 33 -13.693 -0.801 -9.736 967 HG2 ARG 33 HG2 ARG 33 -15.567 0.641 -7.876 968 HG3 ARG 33 HG3 ARG 33 -15.920 0.024 -9.489 969 HD2 ARG 33 HD2 ARG 33 -15.352 -1.551 -6.993 970 HD3 ARG 33 HD3 ARG 33 -16.844 -1.503 -7.924 971 HE ARG 33 HE ARG 33 -14.771 -2.421 -9.590 972 HH11 ARG 33 HH11 ARG 33 -16.688 -3.461 -6.852 973 HH12 ARG 33 HH12 ARG 33 -16.497 -5.149 -7.194 974 HH21 ARG 33 HH21 ARG 33 -14.508 -4.652 -10.036 975 HH22 ARG 33 HH22 ARG 33 -15.250 -5.829 -8.997 976 H LEU 34 H LEU 34 -11.206 1.401 -8.009 977 HA LEU 34 HA LEU 34 -9.387 -0.104 -9.661 978 HB2 LEU 34 HB2 LEU 34 -8.082 1.916 -9.808 979 HB3 LEU 34 HB3 LEU 34 -9.773 2.271 -10.087 980 HG LEU 34 HG LEU 34 -9.587 2.787 -7.426 981 HD11 LEU 34 HD11 LEU 34 -7.556 4.112 -7.080 982 HD12 LEU 34 HD12 LEU 34 -6.952 3.590 -8.652 983 HD13 LEU 34 HD13 LEU 34 -7.189 2.409 -7.362 984 HD21 LEU 34 HD21 LEU 34 -9.502 5.147 -8.093 985 HD22 LEU 34 HD22 LEU 34 -10.622 4.209 -9.084 986 HD23 LEU 34 HD23 LEU 34 -9.040 4.658 -9.722 987 H VAL 35 H VAL 35 -9.795 0.334 -6.320 988 HA VAL 35 HA VAL 35 -7.122 0.233 -5.432 989 HB VAL 35 HB VAL 35 -9.561 -0.884 -4.030 990 HG11 VAL 35 HG11 VAL 35 -8.281 -0.575 -1.987 991 HG12 VAL 35 HG12 VAL 35 -6.910 0.029 -2.914 992 HG13 VAL 35 HG13 VAL 35 -7.424 -1.648 -3.091 993 HG21 VAL 35 HG21 VAL 35 -9.732 1.263 -2.922 994 HG22 VAL 35 HG22 VAL 35 -9.831 1.480 -4.670 995 HG23 VAL 35 HG23 VAL 35 -8.336 1.863 -3.816 996 H ALA 36 H ALA 36 -9.517 -2.333 -5.967 997 HA ALA 36 HA ALA 36 -7.804 -4.483 -5.299 998 HB1 ALA 36 HB1 ALA 36 -10.258 -4.677 -5.355 999 HB2 ALA 36 HB2 ALA 36 -9.471 -5.911 -6.336 1000 HB3 ALA 36 HB3 ALA 36 -10.220 -4.515 -7.110 1001 H ALA 37 H ALA 37 -8.638 -2.905 -8.336 1002 HA ALA 37 HA ALA 37 -7.247 -4.629 -10.058 1003 HB1 ALA 37 HB1 ALA 37 -8.952 -3.026 -10.813 1004 HB2 ALA 37 HB2 ALA 37 -7.444 -2.863 -11.713 1005 HB3 ALA 37 HB3 ALA 37 -7.847 -1.699 -10.452 1006 H PHE 38 H PHE 38 -6.197 -1.898 -8.127 1007 HA PHE 38 HA PHE 38 -3.722 -1.420 -9.381 1008 HB2 PHE 38 HB2 PHE 38 -4.948 -0.004 -7.612 1009 HB3 PHE 38 HB3 PHE 38 -4.208 -1.071 -6.425 1010 HD1 PHE 38 HD1 PHE 38 -3.571 1.476 -8.993 1011 HD2 PHE 38 HD2 PHE 38 -1.885 -0.901 -5.891 1012 HE1 PHE 38 HE1 PHE 38 -1.545 2.872 -9.029 1013 HE2 PHE 38 HE2 PHE 38 0.144 0.487 -5.926 1014 HZ PHE 38 HZ PHE 38 0.317 2.377 -7.497 1015 H VAL 39 H VAL 39 -4.613 -3.496 -6.654 1016 HA VAL 39 HA VAL 39 -1.958 -4.477 -6.236 1017 HB VAL 39 HB VAL 39 -4.557 -5.736 -5.333 1018 HG11 VAL 39 HG11 VAL 39 -3.142 -6.707 -3.549 1019 HG12 VAL 39 HG12 VAL 39 -1.721 -6.035 -4.346 1020 HG13 VAL 39 HG13 VAL 39 -2.693 -7.261 -5.159 1021 HG21 VAL 39 HG21 VAL 39 -2.876 -3.573 -4.095 1022 HG22 VAL 39 HG22 VAL 39 -3.971 -4.574 -3.146 1023 HG23 VAL 39 HG23 VAL 39 -4.606 -3.558 -4.437 1024 H ASP 40 H ASP 40 -4.865 -5.691 -7.815 1025 HA ASP 40 HA ASP 40 -3.982 -8.236 -8.536 1026 HB2 ASP 40 HB2 ASP 40 -6.330 -7.131 -8.736 1027 HB3 ASP 40 HB3 ASP 40 -5.768 -6.582 -10.309 1028 H ASP 41 H ASP 41 -3.768 -5.173 -10.293 1029 HA ASP 41 HA ASP 41 -2.518 -6.192 -12.608 1030 HB2 ASP 41 HB2 ASP 41 -3.659 -3.872 -12.118 1031 HB3 ASP 41 HB3 ASP 41 -2.027 -3.394 -11.662 1032 H LYS 42 H LYS 42 -1.182 -4.551 -9.743 1033 HA LYS 42 HA LYS 42 1.501 -4.646 -10.554 1034 HB2 LYS 42 HB2 LYS 42 0.582 -3.215 -8.716 1035 HB3 LYS 42 HB3 LYS 42 0.502 -4.652 -7.702 1036 HG2 LYS 42 HG2 LYS 42 2.754 -4.735 -7.402 1037 HG3 LYS 42 HG3 LYS 42 3.103 -4.032 -8.979 1038 HD2 LYS 42 HD2 LYS 42 1.921 -2.455 -6.702 1039 HD3 LYS 42 HD3 LYS 42 3.660 -2.595 -6.975 1040 HE2 LYS 42 HE2 LYS 42 2.902 -1.867 -9.432 1041 HE3 LYS 42 HE3 LYS 42 1.598 -1.118 -8.510 1042 HZ1 LYS 42 HZ1 LYS 42 4.428 -0.709 -7.758 1043 HZ2 LYS 42 HZ2 LYS 42 3.082 0.255 -7.375 1044 HZ3 LYS 42 HZ3 LYS 42 3.695 0.238 -8.953 1045 H MET 43 H MET 43 -0.466 -6.987 -8.768 1046 HA MET 43 HA MET 43 1.710 -8.717 -8.140 1047 HB2 MET 43 HB2 MET 43 -1.270 -9.027 -8.166 1048 HB3 MET 43 HB3 MET 43 -0.247 -10.444 -7.975 1049 HG2 MET 43 HG2 MET 43 0.834 -9.287 -6.034 1050 HG3 MET 43 HG3 MET 43 -0.409 -8.044 -6.175 1051 HE1 MET 43 HE1 MET 43 -0.619 -12.012 -6.580 1052 HE2 MET 43 HE2 MET 43 -1.115 -12.429 -4.940 1053 HE3 MET 43 HE3 MET 43 0.460 -11.689 -5.222 1054 H HIS 44 H HIS 44 -0.610 -8.568 -10.780 1055 HA HIS 44 HA HIS 44 0.139 -10.973 -12.037 1056 HB2 HIS 44 HB2 HIS 44 -1.968 -9.754 -12.501 1057 HB3 HIS 44 HB3 HIS 44 -1.037 -8.494 -13.306 1058 HD1 HIS 44 HD1 HIS 44 -0.842 -8.758 -15.756 1059 HD2 HIS 44 HD2 HIS 44 -1.570 -12.386 -13.859 1060 HE1 HIS 44 HE1 HIS 44 -1.059 -10.452 -17.598 1061 HE2 HIS 44 HE2 HIS 44 -1.626 -12.614 -16.433 1062 H GLU 45 H GLU 45 1.311 -7.644 -12.420 1063 HA GLU 45 HA GLU 45 2.980 -8.233 -14.637 1064 HB2 GLU 45 HB2 GLU 45 3.810 -6.053 -14.453 1065 HB3 GLU 45 HB3 GLU 45 2.158 -5.939 -13.865 1066 HG2 GLU 45 HG2 GLU 45 2.926 -5.919 -11.577 1067 HG3 GLU 45 HG3 GLU 45 4.588 -6.182 -12.098 1068 H PHE 46 H PHE 46 3.387 -8.593 -11.202 1069 HA PHE 46 HA PHE 46 6.254 -8.958 -11.427 1070 HB2 PHE 46 HB2 PHE 46 4.305 -8.755 -9.202 1071 HB3 PHE 46 HB3 PHE 46 5.725 -9.747 -8.907 1072 HD1 PHE 46 HD2 PHE 46 8.015 -8.666 -9.449 1073 HD2 PHE 46 HD1 PHE 46 4.414 -6.465 -8.871 1074 HE1 PHE 46 HE2 PHE 46 9.331 -6.644 -8.953 1075 HE2 PHE 46 HE1 PHE 46 5.723 -4.441 -8.376 1076 HZ PHE 46 HZ PHE 46 8.188 -4.530 -8.416 1077 H SER 47 H SER 47 3.402 -10.869 -11.514 1078 HA SER 47 HA SER 47 4.356 -13.350 -10.642 1079 HB2 SER 47 HB2 SER 47 2.252 -12.725 -12.726 1080 HB3 SER 47 HB3 SER 47 2.504 -14.313 -12.002 1081 HG SER 47 HG SER 47 2.050 -12.036 -10.387 1082 H GLU 48 H GLU 48 4.838 -11.671 -13.671 1083 HA GLU 48 HA GLU 48 5.845 -14.049 -14.985 1084 HB2 GLU 48 HB2 GLU 48 6.297 -12.551 -16.895 1085 HB3 GLU 48 HB3 GLU 48 4.627 -12.474 -16.353 1086 HG2 GLU 48 HG2 GLU 48 4.773 -10.299 -15.948 1087 HG3 GLU 48 HG3 GLU 48 6.264 -10.498 -15.032 1088 H LYS 49 H LYS 49 7.117 -11.624 -12.969 1089 HA LYS 49 HA LYS 49 9.806 -11.734 -14.029 1090 HB2 LYS 49 HB2 LYS 49 8.454 -10.299 -11.809 1091 HB3 LYS 49 HB3 LYS 49 10.175 -10.600 -11.623 1092 HG2 LYS 49 HG2 LYS 49 10.131 -8.515 -12.603 1093 HG3 LYS 49 HG3 LYS 49 10.362 -9.580 -13.992 1094 HD2 LYS 49 HD2 LYS 49 7.934 -9.507 -14.412 1095 HD3 LYS 49 HD3 LYS 49 7.754 -8.382 -13.066 1096 HE2 LYS 49 HE2 LYS 49 7.817 -7.009 -14.956 1097 HE3 LYS 49 HE3 LYS 49 9.452 -6.923 -14.308 1098 HZ1 LYS 49 HZ1 LYS 49 8.712 -8.843 -16.441 1099 HZ2 LYS 49 HZ2 LYS 49 10.260 -8.320 -15.981 1100 HZ3 LYS 49 HZ3 LYS 49 9.217 -7.263 -16.786 1101 H GLN 50 H GLN 50 7.915 -13.283 -11.586 1102 HA GLN 50 HA GLN 50 8.296 -14.966 -10.107 1103 HB2 GLN 50 HB2 GLN 50 10.350 -15.724 -12.190 1104 HB3 GLN 50 HB3 GLN 50 9.769 -16.785 -10.913 1105 HG2 GLN 50 HG2 GLN 50 7.607 -16.879 -11.834 1106 HG3 GLN 50 HG3 GLN 50 7.932 -15.532 -12.923 1107 HE21 GLN 50 HE21 GLN 50 7.417 -16.653 -14.760 1108 HE22 GLN 50 HE22 GLN 50 8.373 -17.953 -15.379 1109 HA PRO 51 HA PRO 51 12.160 -12.836 -8.468 1110 HB2 PRO 51 HB2 PRO 51 10.973 -11.747 -6.252 1111 HB3 PRO 51 HB3 PRO 51 11.166 -10.900 -7.789 1112 HG2 PRO 51 HG2 PRO 51 8.761 -12.227 -6.642 1113 HG3 PRO 51 HG3 PRO 51 8.875 -10.764 -7.633 1114 HD2 PRO 51 HD2 PRO 51 8.093 -13.203 -8.593 1115 HD3 PRO 51 HD3 PRO 51 8.844 -11.944 -9.589 1116 H MET 52 H MET 52 9.531 -14.290 -6.540 1117 HA MET 52 HA MET 52 11.586 -15.816 -5.080 1118 HB2 MET 52 HB2 MET 52 8.861 -14.881 -4.181 1119 HB3 MET 52 HB3 MET 52 9.860 -16.003 -3.266 1120 HG2 MET 52 HG2 MET 52 10.626 -13.192 -4.015 1121 HG3 MET 52 HG3 MET 52 10.037 -13.710 -2.436 1122 HE1 MET 52 HE1 MET 52 13.849 -12.895 -1.869 1123 HE2 MET 52 HE2 MET 52 12.187 -12.383 -1.579 1124 HE3 MET 52 HE3 MET 52 12.919 -12.141 -3.165 1125 H LEU 53 H LEU 53 9.289 -16.162 -7.434 1126 HA LEU 53 HA LEU 53 8.091 -17.884 -8.313 1127 HB2 LEU 53 HB2 LEU 53 10.383 -19.317 -6.995 1128 HB3 LEU 53 HB3 LEU 53 9.177 -20.171 -7.939 1129 HG LEU 53 HG LEU 53 10.516 -17.848 -9.219 1130 HD11 LEU 53 HD11 LEU 53 11.848 -20.507 -8.753 1131 HD12 LEU 53 HD12 LEU 53 12.417 -18.921 -8.231 1132 HD13 LEU 53 HD13 LEU 53 12.372 -19.320 -9.947 1133 HD21 LEU 53 HD21 LEU 53 9.667 -20.577 -10.176 1134 HD22 LEU 53 HD22 LEU 53 10.314 -19.286 -11.190 1135 HD23 LEU 53 HD23 LEU 53 8.763 -19.078 -10.376 1136 H ASP 54 H ASP 54 6.876 -16.919 -6.153 1137 HA ASP 54 HA ASP 54 5.433 -19.186 -5.124 1138 HB2 ASP 54 HB2 ASP 54 7.350 -19.064 -3.566 1139 HB3 ASP 54 HB3 ASP 54 6.964 -17.382 -3.231 1140 H VAL 55 H VAL 55 3.370 -18.587 -4.418 1141 HA VAL 55 HA VAL 55 2.467 -16.043 -5.354 1142 HB VAL 55 HB VAL 55 0.913 -18.162 -3.861 1143 HG11 VAL 55 HG11 VAL 55 -0.064 -15.797 -5.459 1144 HG12 VAL 55 HG12 VAL 55 -0.144 -15.960 -3.704 1145 HG13 VAL 55 HG13 VAL 55 -1.075 -17.048 -4.734 1146 HG21 VAL 55 HG21 VAL 55 1.857 -18.943 -5.983 1147 HG22 VAL 55 HG22 VAL 55 1.102 -17.580 -6.810 1148 HG23 VAL 55 HG23 VAL 55 0.097 -18.817 -6.054 1149 HA PRO 56 HA PRO 56 1.473 -15.255 -0.576 1150 HB2 PRO 56 HB2 PRO 56 3.776 -16.809 0.508 1151 HB3 PRO 56 HB3 PRO 56 2.179 -16.527 1.210 1152 HG2 PRO 56 HG2 PRO 56 2.779 -18.875 0.129 1153 HG3 PRO 56 HG3 PRO 56 1.175 -18.157 -0.100 1154 HD2 PRO 56 HD2 PRO 56 3.461 -18.331 -2.006 1155 HD3 PRO 56 HD3 PRO 56 1.720 -18.454 -2.310 1156 H LYS 57 H LYS 57 4.822 -15.940 -1.501 1157 HA LYS 57 HA LYS 57 5.973 -13.688 -0.250 1158 HB2 LYS 57 HB2 LYS 57 6.836 -15.659 -2.302 1159 HB3 LYS 57 HB3 LYS 57 7.746 -14.164 -2.194 1160 HG2 LYS 57 HG2 LYS 57 8.567 -16.182 -0.859 1161 HG3 LYS 57 HG3 LYS 57 8.495 -14.620 -0.047 1162 HD2 LYS 57 HD2 LYS 57 6.829 -15.271 1.351 1163 HD3 LYS 57 HD3 LYS 57 6.073 -16.306 0.135 1164 HE2 LYS 57 HE2 LYS 57 8.678 -17.009 1.457 1165 HE3 LYS 57 HE3 LYS 57 7.118 -17.457 2.148 1166 HZ1 LYS 57 HZ1 LYS 57 8.374 -18.380 -0.351 1167 HZ2 LYS 57 HZ2 LYS 57 6.691 -18.437 -0.182 1168 HZ3 LYS 57 HZ3 LYS 57 7.684 -19.291 0.896 1169 H LEU 58 H LEU 58 4.480 -14.163 -3.367 1170 HA LEU 58 HA LEU 58 5.433 -11.764 -4.568 1171 HB2 LEU 58 HB2 LEU 58 4.439 -13.910 -5.646 1172 HB3 LEU 58 HB3 LEU 58 2.891 -13.143 -5.353 1173 HG LEU 58 HG LEU 58 3.909 -11.134 -6.650 1174 HD11 LEU 58 HD11 LEU 58 5.476 -12.041 -8.446 1175 HD12 LEU 58 HD12 LEU 58 5.774 -13.379 -7.338 1176 HD13 LEU 58 HD13 LEU 58 6.166 -11.730 -6.853 1177 HD21 LEU 58 HD21 LEU 58 3.157 -12.110 -8.762 1178 HD22 LEU 58 HD22 LEU 58 2.043 -12.470 -7.442 1179 HD23 LEU 58 HD23 LEU 58 3.160 -13.708 -8.020 1180 H ALA 59 H ALA 59 2.482 -12.680 -2.858 1181 HA ALA 59 HA ALA 59 1.023 -10.319 -3.290 1182 HB1 ALA 59 HB1 ALA 59 0.852 -12.231 -0.967 1183 HB2 ALA 59 HB2 ALA 59 0.002 -12.389 -2.505 1184 HB3 ALA 59 HB3 ALA 59 -0.367 -11.043 -1.426 1185 H VAL 60 H VAL 60 3.323 -11.179 -0.740 1186 HA VAL 60 HA VAL 60 2.850 -8.707 0.669 1187 HB VAL 60 HB VAL 60 3.542 -10.819 1.831 1188 HG11 VAL 60 HG11 VAL 60 5.975 -11.303 1.908 1189 HG12 VAL 60 HG12 VAL 60 6.188 -10.208 0.542 1190 HG13 VAL 60 HG13 VAL 60 5.210 -11.665 0.361 1191 HG21 VAL 60 HG21 VAL 60 5.374 -8.471 2.298 1192 HG22 VAL 60 HG22 VAL 60 4.948 -9.731 3.458 1193 HG23 VAL 60 HG23 VAL 60 3.717 -8.602 2.889 1194 H LEU 61 H LEU 61 4.943 -9.825 -1.830 1195 HA LEU 61 HA LEU 61 7.024 -7.937 -1.595 1196 HB2 LEU 61 HB2 LEU 61 7.202 -9.966 -2.963 1197 HB3 LEU 61 HB3 LEU 61 5.957 -9.359 -4.038 1198 HG LEU 61 HG LEU 61 7.582 -7.370 -4.422 1199 HD11 LEU 61 HD11 LEU 61 9.474 -9.459 -3.355 1200 HD12 LEU 61 HD12 LEU 61 9.153 -7.874 -2.654 1201 HD13 LEU 61 HD13 LEU 61 9.948 -8.000 -4.223 1202 HD21 LEU 61 HD21 LEU 61 8.681 -8.596 -6.223 1203 HD22 LEU 61 HD22 LEU 61 6.971 -9.004 -6.118 1204 HD23 LEU 61 HD23 LEU 61 8.183 -10.121 -5.494 1205 H THR 62 H THR 62 3.980 -7.945 -3.396 1206 HA THR 62 HA THR 62 4.403 -5.389 -4.578 1207 HB THR 62 HB THR 62 1.868 -5.556 -4.998 1208 HG1 THR 62 HG1 THR 62 0.893 -7.154 -4.019 1209 HG21 THR 62 HG21 THR 62 3.799 -6.282 -6.535 1210 HG22 THR 62 HG22 THR 62 2.198 -6.940 -6.857 1211 HG23 THR 62 HG23 THR 62 3.402 -7.924 -6.026 1212 H ALA 63 H ALA 63 2.907 -6.550 -1.638 1213 HA ALA 63 HA ALA 63 1.450 -4.300 -0.881 1214 HB1 ALA 63 HB1 ALA 63 1.388 -6.540 0.225 1215 HB2 ALA 63 HB2 ALA 63 1.469 -5.177 1.340 1216 HB3 ALA 63 HB3 ALA 63 2.912 -6.133 1.012 1217 H VAL 64 H VAL 64 4.800 -5.157 -0.031 1218 HA VAL 64 HA VAL 64 5.286 -2.755 1.392 1219 HB VAL 64 HB VAL 64 6.595 -4.874 1.664 1220 HG11 VAL 64 HG11 VAL 64 7.988 -3.978 -0.850 1221 HG12 VAL 64 HG12 VAL 64 6.924 -5.377 -0.715 1222 HG13 VAL 64 HG13 VAL 64 8.448 -5.339 0.174 1223 HG21 VAL 64 HG21 VAL 64 8.784 -3.723 1.969 1224 HG22 VAL 64 HG22 VAL 64 7.413 -2.881 2.690 1225 HG23 VAL 64 HG23 VAL 64 8.096 -2.312 1.166 1226 H GLN 65 H GLN 65 5.573 -3.649 -1.968 1227 HA GLN 65 HA GLN 65 7.173 -1.457 -2.780 1228 HB2 GLN 65 HB2 GLN 65 6.465 -3.699 -4.023 1229 HB3 GLN 65 HB3 GLN 65 5.187 -2.667 -4.656 1230 HG2 GLN 65 HG2 GLN 65 7.997 -1.687 -4.811 1231 HG3 GLN 65 HG3 GLN 65 7.486 -2.951 -5.931 1232 HE21 GLN 65 HE21 GLN 65 7.135 0.357 -4.989 1233 HE22 GLN 65 HE22 GLN 65 6.196 0.872 -6.353 1234 H ILE 66 H ILE 66 3.666 -2.011 -2.797 1235 HA ILE 66 HA ILE 66 2.873 0.440 -3.887 1236 HB ILE 66 HB ILE 66 1.450 -1.343 -1.903 1237 HG12 ILE 66 HG12 ILE 66 0.981 -1.009 -4.869 1238 HG13 ILE 66 HG13 ILE 66 2.011 -2.261 -4.183 1239 HG21 ILE 66 HG21 ILE 66 0.648 1.036 -1.887 1240 HG22 ILE 66 HG22 ILE 66 -0.571 -0.160 -2.323 1241 HG23 ILE 66 HG23 ILE 66 0.193 0.820 -3.577 1242 HD11 ILE 66 HD11 ILE 66 0.018 -3.048 -2.884 1243 HD12 ILE 66 HD12 ILE 66 -0.094 -3.238 -4.633 1244 HD13 ILE 66 HD13 ILE 66 -0.951 -1.922 -3.834 1245 H ALA 67 H ALA 67 3.443 -0.520 -0.528 1246 HA ALA 67 HA ALA 67 2.647 1.875 0.698 1247 HB1 ALA 67 HB1 ALA 67 3.812 1.101 2.647 1248 HB2 ALA 67 HB2 ALA 67 4.769 -0.022 1.683 1249 HB3 ALA 67 HB3 ALA 67 3.035 -0.279 1.873 1250 H SER 68 H SER 68 5.799 0.849 -0.554 1251 HA SER 68 HA SER 68 7.299 3.009 0.424 1252 HB2 SER 68 HB2 SER 68 7.816 1.404 -2.088 1253 HB3 SER 68 HB3 SER 68 8.999 2.342 -1.179 1254 HG SER 68 HG SER 68 7.564 0.086 -0.196 1255 H GLU 69 H GLU 69 5.616 2.602 -2.695 1256 HA GLU 69 HA GLU 69 6.551 5.143 -3.642 1257 HB2 GLU 69 HB2 GLU 69 5.213 4.758 -5.617 1258 HB3 GLU 69 HB3 GLU 69 6.112 3.310 -5.206 1259 HG2 GLU 69 HG2 GLU 69 3.939 2.529 -4.070 1260 HG3 GLU 69 HG3 GLU 69 3.173 3.828 -4.983 1261 H TYR 70 H TYR 70 3.969 4.245 -1.615 1262 HA TYR 70 HA TYR 70 2.513 6.713 -2.254 1263 HB2 TYR 70 HB2 TYR 70 1.754 4.149 -0.938 1264 HB3 TYR 70 HB3 TYR 70 0.875 5.609 -0.496 1265 HD1 TYR 70 HD1 TYR 70 2.138 5.446 -3.906 1266 HD2 TYR 70 HD2 TYR 70 -1.163 4.475 -1.399 1267 HE1 TYR 70 HE1 TYR 70 0.708 5.211 -5.887 1268 HE2 TYR 70 HE2 TYR 70 -2.600 4.231 -3.378 1269 HH TYR 70 HH TYR 70 -1.329 4.183 -6.582 1270 H LEU 71 H LEU 71 4.385 5.236 0.291 1271 HA LEU 71 HA LEU 71 3.642 6.972 2.388 1272 HB2 LEU 71 HB2 LEU 71 5.764 5.007 1.904 1273 HB3 LEU 71 HB3 LEU 71 6.237 6.312 2.977 1274 HG LEU 71 HG LEU 71 3.684 4.779 3.430 1275 HD11 LEU 71 HD11 LEU 71 4.854 3.353 5.012 1276 HD12 LEU 71 HD12 LEU 71 6.391 4.082 4.558 1277 HD13 LEU 71 HD13 LEU 71 5.487 3.123 3.384 1278 HD21 LEU 71 HD21 LEU 71 3.674 5.729 5.526 1279 HD22 LEU 71 HD22 LEU 71 4.342 7.034 4.547 1280 HD23 LEU 71 HD23 LEU 71 5.411 6.025 5.521 1281 H LYS 72 H LYS 72 6.187 7.198 -0.053 1282 HA LYS 72 HA LYS 72 7.357 9.554 1.006 1283 HB2 LYS 72 HB2 LYS 72 8.536 9.733 -1.118 1284 HB3 LYS 72 HB3 LYS 72 8.582 8.082 -0.527 1285 HG2 LYS 72 HG2 LYS 72 6.808 7.473 -2.098 1286 HG3 LYS 72 HG3 LYS 72 6.765 9.134 -2.687 1287 HD2 LYS 72 HD2 LYS 72 8.132 8.149 -4.255 1288 HD3 LYS 72 HD3 LYS 72 9.322 8.738 -3.094 1289 HE2 LYS 72 HE2 LYS 72 8.200 5.968 -2.872 1290 HE3 LYS 72 HE3 LYS 72 9.517 6.315 -3.989 1291 HZ1 LYS 72 HZ1 LYS 72 10.473 5.571 -1.981 1292 HZ2 LYS 72 HZ2 LYS 72 9.526 6.604 -1.029 1293 HZ3 LYS 72 HZ3 LYS 72 10.741 7.242 -2.031 1294 H LEU 73 H LEU 73 4.539 8.961 -0.854 1295 HA LEU 73 HA LEU 73 4.321 11.538 -2.061 1296 HB2 LEU 73 HB2 LEU 73 3.183 9.296 -2.720 1297 HB3 LEU 73 HB3 LEU 73 2.001 9.707 -1.498 1298 HG LEU 73 HG LEU 73 1.309 10.256 -3.829 1299 HD11 LEU 73 HD11 LEU 73 0.392 12.437 -3.336 1300 HD12 LEU 73 HD12 LEU 73 1.544 12.647 -2.016 1301 HD13 LEU 73 HD13 LEU 73 0.307 11.396 -1.916 1302 HD21 LEU 73 HD21 LEU 73 3.710 11.034 -4.415 1303 HD22 LEU 73 HD22 LEU 73 3.169 12.591 -3.780 1304 HD23 LEU 73 HD23 LEU 73 2.327 11.851 -5.139 1305 H LYS 74 H LYS 74 2.819 10.003 0.788 1306 HA LYS 74 HA LYS 74 1.344 12.305 1.548 1307 HB2 LYS 74 HB2 LYS 74 0.992 11.182 3.688 1308 HB3 LYS 74 HB3 LYS 74 0.751 10.060 2.355 1309 HG2 LYS 74 HG2 LYS 74 2.647 8.858 2.845 1310 HG3 LYS 74 HG3 LYS 74 3.413 10.203 3.690 1311 HD2 LYS 74 HD2 LYS 74 0.902 9.016 4.786 1312 HD3 LYS 74 HD3 LYS 74 2.435 8.181 5.031 1313 HE2 LYS 74 HE2 LYS 74 2.276 11.087 5.629 1314 HE3 LYS 74 HE3 LYS 74 1.550 9.950 6.761 1315 HZ1 LYS 74 HZ1 LYS 74 4.391 10.027 5.889 1316 HZ2 LYS 74 HZ2 LYS 74 3.727 8.806 6.860 1317 HZ3 LYS 74 HZ3 LYS 74 3.788 10.396 7.424 1318 H GLU 75 H GLU 75 4.618 11.325 1.964 1319 HA GLU 75 HA GLU 75 5.220 13.045 4.160 1320 HB2 GLU 75 HB2 GLU 75 6.605 11.056 2.712 1321 HB3 GLU 75 HB3 GLU 75 7.537 12.538 2.537 1322 HG2 GLU 75 HG2 GLU 75 8.242 11.222 4.470 1323 HG3 GLU 75 HG3 GLU 75 7.627 12.814 4.924 1324 H GLU 76 H GLU 76 5.811 13.241 0.655 1325 HA GLU 76 HA GLU 76 6.973 15.768 0.579 1326 HB2 GLU 76 HB2 GLU 76 6.959 14.395 -1.401 1327 HB3 GLU 76 HB3 GLU 76 5.203 14.350 -1.423 1328 HG2 GLU 76 HG2 GLU 76 5.765 15.841 -3.120 1329 HG3 GLU 76 HG3 GLU 76 5.304 16.874 -1.771 1330 H TYR 77 H TYR 77 3.610 14.777 0.610 1331 HA TYR 77 HA TYR 77 2.324 17.194 0.177 1332 HB2 TYR 77 HB2 TYR 77 0.991 15.244 0.204 1333 HB3 TYR 77 HB3 TYR 77 1.588 14.754 1.783 1334 HD1 TYR 77 HD2 TYR 77 -0.364 17.481 0.152 1335 HD2 TYR 77 HD1 TYR 77 0.268 15.151 3.648 1336 HE1 TYR 77 HE2 TYR 77 -2.327 18.535 1.198 1337 HE2 TYR 77 HE1 TYR 77 -1.687 16.194 4.704 1338 HH TYR 77 HH TYR 77 -3.990 17.418 3.510 1339 H GLN 78 H GLN 78 3.459 15.774 3.212 1340 HA GLN 78 HA GLN 78 2.549 17.904 4.852 1341 HB2 GLN 78 HB2 GLN 78 4.518 15.664 5.275 1342 HB3 GLN 78 HB3 GLN 78 4.169 16.852 6.522 1343 HG2 GLN 78 HG2 GLN 78 2.133 15.057 5.224 1344 HG3 GLN 78 HG3 GLN 78 2.879 14.791 6.802 1345 HE21 GLN 78 HE21 GLN 78 0.071 15.181 6.110 1346 HE22 GLN 78 HE22 GLN 78 -0.457 16.555 7.013 1347 H ARG 79 H ARG 79 5.503 17.356 3.064 1348 HA ARG 79 HA ARG 79 7.089 19.254 4.483 1349 HB2 ARG 79 HB2 ARG 79 7.480 18.276 1.653 1350 HB3 ARG 79 HB3 ARG 79 8.688 19.033 2.681 1351 HG2 ARG 79 HG2 ARG 79 7.457 16.311 2.959 1352 HG3 ARG 79 HG3 ARG 79 9.148 16.728 2.684 1353 HD2 ARG 79 HD2 ARG 79 7.559 17.258 5.196 1354 HD3 ARG 79 HD3 ARG 79 8.795 16.023 4.983 1355 HE ARG 79 HE ARG 79 9.204 18.770 5.615 1356 HH11 ARG 79 HH11 ARG 79 10.607 16.088 3.848 1357 HH12 ARG 79 HH12 ARG 79 12.232 16.678 3.977 1358 HH21 ARG 79 HH21 ARG 79 11.354 19.527 5.820 1359 HH22 ARG 79 HH22 ARG 79 12.655 18.633 5.099 1360 H LEU 80 H LEU 80 5.388 19.434 1.343 1361 HA LEU 80 HA LEU 80 6.105 22.144 0.910 1362 HB2 LEU 80 HB2 LEU 80 4.624 22.128 -0.934 1363 HB3 LEU 80 HB3 LEU 80 5.386 20.553 -0.865 1364 HG LEU 80 HG LEU 80 3.070 20.170 0.587 1365 HD11 LEU 80 HD11 LEU 80 2.287 22.408 -0.179 1366 HD12 LEU 80 HD12 LEU 80 1.246 21.073 -0.668 1367 HD13 LEU 80 HD13 LEU 80 2.343 21.808 -1.837 1368 HD21 LEU 80 HD21 LEU 80 3.619 19.668 -2.329 1369 HD22 LEU 80 HD22 LEU 80 2.308 18.935 -1.407 1370 HD23 LEU 80 HD23 LEU 80 3.984 18.594 -0.979 1371 H ARG 81 H ARG 81 3.530 20.638 2.696 1372 HA ARG 81 HA ARG 81 1.909 22.996 2.833 1373 HB2 ARG 81 HB2 ARG 81 1.842 20.425 4.410 1374 HB3 ARG 81 HB3 ARG 81 0.669 21.721 4.602 1375 HG2 ARG 81 HG2 ARG 81 1.050 20.844 1.833 1376 HG3 ARG 81 HG3 ARG 81 0.403 19.604 2.909 1377 HD2 ARG 81 HD2 ARG 81 -0.768 22.358 2.888 1378 HD3 ARG 81 HD3 ARG 81 -1.217 21.187 1.652 1379 HE ARG 81 HE ARG 81 -1.986 19.727 3.460 1380 HH11 ARG 81 HH11 ARG 81 -1.585 23.128 4.236 1381 HH12 ARG 81 HH12 ARG 81 -2.733 23.083 5.533 1382 HH21 ARG 81 HH21 ARG 81 -3.488 19.684 5.142 1383 HH22 ARG 81 HH22 ARG 81 -3.812 21.129 6.045 1384 H GLU 82 H GLU 82 4.439 21.559 4.808 1385 HA GLU 82 HA GLU 82 3.993 23.273 7.048 1386 HB2 GLU 82 HB2 GLU 82 5.880 22.296 8.031 1387 HB3 GLU 82 HB3 GLU 82 5.201 21.013 7.044 1388 HG2 GLU 82 HG2 GLU 82 6.883 21.285 5.387 1389 HG3 GLU 82 HG3 GLU 82 7.462 22.773 6.134 1390 H GLN 83 H GLN 83 5.993 23.425 4.165 1391 HA GLN 83 HA GLN 83 7.499 25.699 5.004 1392 HB2 GLN 83 HB2 GLN 83 8.513 25.647 2.913 1393 HB3 GLN 83 HB3 GLN 83 8.050 23.968 3.145 1394 HG2 GLN 83 HG2 GLN 83 6.036 24.377 1.775 1395 HG3 GLN 83 HG3 GLN 83 6.607 26.019 1.484 1396 HE21 GLN 83 HE21 GLN 83 6.092 23.938 -0.434 1397 HE22 GLN 83 HE22 GLN 83 7.577 23.651 -1.271 1398 H LEU 84 H LEU 84 4.345 25.263 3.836 1399 HA LEU 84 HA LEU 84 4.071 27.941 2.759 1400 HB2 LEU 84 HB2 LEU 84 2.565 25.482 2.649 1401 HB3 LEU 84 HB3 LEU 84 1.525 26.790 3.165 1402 HG LEU 84 HG LEU 84 1.427 26.437 0.743 1403 HD11 LEU 84 HD11 LEU 84 2.729 29.061 1.456 1404 HD12 LEU 84 HD12 LEU 84 1.019 28.677 1.646 1405 HD13 LEU 84 HD13 LEU 84 1.735 28.733 0.037 1406 HD21 LEU 84 HD21 LEU 84 3.751 25.630 0.445 1407 HD22 LEU 84 HD22 LEU 84 4.322 27.283 0.676 1408 HD23 LEU 84 HD23 LEU 84 3.296 26.889 -0.701 1409 H LYS 85 H LYS 85 4.234 26.630 5.747 1410 HA LYS 85 HA LYS 85 2.394 28.603 6.920 1411 HB2 LYS 85 HB2 LYS 85 3.464 26.014 8.063 1412 HB3 LYS 85 HB3 LYS 85 2.516 27.176 8.977 1413 HG2 LYS 85 HG2 LYS 85 0.629 26.848 7.509 1414 HG3 LYS 85 HG3 LYS 85 1.577 25.754 6.501 1415 HD2 LYS 85 HD2 LYS 85 0.213 24.407 7.914 1416 HD3 LYS 85 HD3 LYS 85 1.868 24.292 8.516 1417 HE2 LYS 85 HE2 LYS 85 0.272 26.449 9.711 1418 HE3 LYS 85 HE3 LYS 85 -0.318 24.825 10.056 1419 HZ1 LYS 85 HZ1 LYS 85 1.896 24.251 10.872 1420 HZ2 LYS 85 HZ2 LYS 85 1.233 25.541 11.738 1421 HZ3 LYS 85 HZ3 LYS 85 2.428 25.827 10.581 1422 H LYS 86 H LYS 86 5.285 28.769 5.968 1423 HA LYS 86 HA LYS 86 6.634 29.441 8.467 1424 HB2 LYS 86 HB2 LYS 86 7.661 28.138 6.414 1425 HB3 LYS 86 HB3 LYS 86 7.925 29.757 5.786 1426 HG2 LYS 86 HG2 LYS 86 8.802 29.415 8.551 1427 HG3 LYS 86 HG3 LYS 86 9.649 28.385 7.396 1428 HD2 LYS 86 HD2 LYS 86 10.219 30.328 6.051 1429 HD3 LYS 86 HD3 LYS 86 9.322 31.375 7.151 1430 HE2 LYS 86 HE2 LYS 86 10.850 30.897 8.942 1431 HE3 LYS 86 HE3 LYS 86 11.671 29.675 7.969 1432 HZ1 LYS 86 HZ1 LYS 86 12.926 31.719 8.009 1433 HZ2 LYS 86 HZ2 LYS 86 11.606 32.590 7.416 1434 HZ3 LYS 86 HZ3 LYS 86 12.359 31.434 6.442 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 32.948 -0.607 -23.264 2 H2 GLY 1 H2 GLY 1 32.578 0.135 -21.789 3 H3 GLY 1 H3 GLY 1 33.586 0.917 -22.897 4 HA2 GLY 1 HA3 GLY 1 31.736 1.041 -24.485 5 HA3 GLY 1 HA2 GLY 1 30.701 0.334 -23.250 6 H SER 2 H SER 2 30.094 1.566 -21.472 7 HA SER 2 HA SER 2 30.144 4.417 -21.912 8 HB2 SER 2 HB2 SER 2 28.987 3.088 -19.478 9 HB3 SER 2 HB3 SER 2 28.442 4.547 -20.308 10 HG SER 2 HG SER 2 27.067 2.815 -20.771 11 H HIS 3 H HIS 3 31.937 5.481 -21.339 12 HA HIS 3 HA HIS 3 33.591 4.558 -19.153 13 HB2 HIS 3 HB2 HIS 3 34.386 5.645 -21.373 14 HB3 HIS 3 HB3 HIS 3 33.969 7.169 -20.600 15 HD1 HIS 3 HD1 HIS 3 35.473 7.985 -18.694 16 HD2 HIS 3 HD2 HIS 3 36.634 4.335 -20.299 17 HE1 HIS 3 HE1 HIS 3 37.767 7.552 -17.784 18 HE2 HIS 3 HE2 HIS 3 38.368 5.254 -18.615 19 H MET 4 H MET 4 30.947 6.606 -19.555 20 HA MET 4 HA MET 4 31.529 8.414 -17.398 21 HB2 MET 4 HB2 MET 4 29.385 9.355 -17.806 22 HB3 MET 4 HB3 MET 4 30.049 8.946 -19.381 23 HG2 MET 4 HG2 MET 4 28.709 6.867 -19.349 24 HG3 MET 4 HG3 MET 4 27.979 7.408 -17.837 25 HE1 MET 4 HE1 MET 4 26.201 6.579 -20.225 26 HE2 MET 4 HE2 MET 4 25.046 7.908 -20.349 27 HE3 MET 4 HE3 MET 4 25.510 7.286 -18.766 28 H THR 5 H THR 5 29.939 8.610 -15.551 29 HA THR 5 HA THR 5 29.562 5.958 -14.374 30 HB THR 5 HB THR 5 29.232 8.529 -12.871 31 HG1 THR 5 HG1 THR 5 31.712 7.234 -13.447 32 HG21 THR 5 HG21 THR 5 29.976 7.215 -10.993 33 HG22 THR 5 HG22 THR 5 30.370 5.857 -12.048 34 HG23 THR 5 HG23 THR 5 28.688 6.337 -11.819 35 H GLU 6 H GLU 6 27.601 5.099 -14.475 36 HA GLU 6 HA GLU 6 25.271 6.803 -14.867 37 HB2 GLU 6 HB2 GLU 6 25.578 3.794 -14.916 38 HB3 GLU 6 HB3 GLU 6 24.083 4.655 -15.247 39 HG2 GLU 6 HG2 GLU 6 25.022 5.655 -17.209 40 HG3 GLU 6 HG3 GLU 6 26.611 4.985 -16.838 41 H GLN 7 H GLN 7 23.550 6.899 -13.451 42 HA GLN 7 HA GLN 7 24.045 5.782 -10.773 43 HB2 GLN 7 HB2 GLN 7 23.916 8.312 -11.079 44 HB3 GLN 7 HB3 GLN 7 22.213 8.085 -11.442 45 HG2 GLN 7 HG2 GLN 7 22.291 8.684 -9.183 46 HG3 GLN 7 HG3 GLN 7 22.030 6.940 -9.189 47 HE21 GLN 7 HE21 GLN 7 24.349 9.486 -8.632 48 HE22 GLN 7 HE22 GLN 7 25.457 8.540 -7.703 49 HA PRO 8 HA PRO 8 20.342 3.495 -12.027 50 HB2 PRO 8 HB2 PRO 8 21.037 1.135 -11.018 51 HB3 PRO 8 HB3 PRO 8 21.805 1.757 -12.482 52 HG2 PRO 8 HG2 PRO 8 22.858 1.628 -9.699 53 HG3 PRO 8 HG3 PRO 8 23.720 1.453 -11.237 54 HD2 PRO 8 HD2 PRO 8 23.563 3.778 -9.644 55 HD3 PRO 8 HD3 PRO 8 24.185 3.670 -11.302 56 H LYS 9 H LYS 9 18.970 1.869 -10.662 57 HA LYS 9 HA LYS 9 18.221 3.266 -8.238 58 HB2 LYS 9 HB2 LYS 9 16.250 1.874 -8.225 59 HB3 LYS 9 HB3 LYS 9 16.507 2.461 -9.861 60 HG2 LYS 9 HG2 LYS 9 17.568 0.254 -10.392 61 HG3 LYS 9 HG3 LYS 9 17.077 -0.296 -8.793 62 HD2 LYS 9 HD2 LYS 9 14.772 -0.069 -9.341 63 HD3 LYS 9 HD3 LYS 9 15.141 0.795 -10.833 64 HE2 LYS 9 HE2 LYS 9 16.096 -2.011 -10.350 65 HE3 LYS 9 HE3 LYS 9 14.495 -1.679 -11.006 66 HZ1 LYS 9 HZ1 LYS 9 15.622 -0.384 -12.787 67 HZ2 LYS 9 HZ2 LYS 9 15.974 -2.036 -12.812 68 HZ3 LYS 9 HZ3 LYS 9 17.109 -0.943 -12.201 69 H THR 10 H THR 10 18.318 2.436 -6.167 70 HA THR 10 HA THR 10 20.086 0.127 -5.851 71 HB THR 10 HB THR 10 20.753 2.312 -4.810 72 HG1 THR 10 HG1 THR 10 21.628 1.276 -3.109 73 HG21 THR 10 HG21 THR 10 19.671 2.971 -2.705 74 HG22 THR 10 HG22 THR 10 18.445 1.726 -2.951 75 HG23 THR 10 HG23 THR 10 18.558 3.086 -4.068 76 H ARG 11 H ARG 11 19.627 -1.456 -4.253 77 HA ARG 11 HA ARG 11 16.762 -1.739 -3.679 78 HB2 ARG 11 HB2 ARG 11 17.010 -4.126 -3.854 79 HB3 ARG 11 HB3 ARG 11 17.688 -3.395 -5.302 80 HG2 ARG 11 HG2 ARG 11 19.942 -3.661 -4.367 81 HG3 ARG 11 HG3 ARG 11 19.245 -4.430 -2.940 82 HD2 ARG 11 HD2 ARG 11 18.140 -5.998 -4.752 83 HD3 ARG 11 HD3 ARG 11 19.511 -5.459 -5.724 84 HE ARG 11 HE ARG 11 20.767 -6.219 -3.522 85 HH11 ARG 11 HH11 ARG 11 18.237 -7.817 -5.332 86 HH12 ARG 11 HH12 ARG 11 18.675 -9.407 -4.798 87 HH21 ARG 11 HH21 ARG 11 21.358 -8.311 -2.809 88 HH22 ARG 11 HH22 ARG 11 20.446 -9.688 -3.343 89 H VAL 12 H VAL 12 16.209 -2.792 -1.691 90 HA VAL 12 HA VAL 12 18.332 -2.788 0.344 91 HB VAL 12 HB VAL 12 17.128 -0.660 0.533 92 HG11 VAL 12 HG11 VAL 12 15.006 -1.140 -0.393 93 HG12 VAL 12 HG12 VAL 12 14.726 -0.734 1.300 94 HG13 VAL 12 HG13 VAL 12 14.701 -2.418 0.782 95 HG21 VAL 12 HG21 VAL 12 17.978 -1.538 2.581 96 HG22 VAL 12 HG22 VAL 12 16.608 -2.632 2.752 97 HG23 VAL 12 HG23 VAL 12 16.372 -0.892 2.911 98 H SER 13 H SER 13 18.167 -4.388 1.872 99 HA SER 13 HA SER 13 16.034 -6.352 1.424 100 HB2 SER 13 HB2 SER 13 18.686 -6.672 2.862 101 HB3 SER 13 HB3 SER 13 17.518 -7.957 2.556 102 HG SER 13 HG SER 13 19.034 -6.488 0.657 103 H VAL 14 H VAL 14 14.354 -6.123 2.765 104 HA VAL 14 HA VAL 14 14.878 -5.256 5.533 105 HB VAL 14 HB VAL 14 12.536 -4.524 5.638 106 HG11 VAL 14 HG11 VAL 14 14.055 -3.333 3.326 107 HG12 VAL 14 HG12 VAL 14 14.262 -2.916 5.027 108 HG13 VAL 14 HG13 VAL 14 12.743 -2.551 4.206 109 HG21 VAL 14 HG21 VAL 14 11.069 -4.525 3.796 110 HG22 VAL 14 HG22 VAL 14 11.767 -6.144 3.841 111 HG23 VAL 14 HG23 VAL 14 12.354 -4.960 2.673 112 H ARG 15 H ARG 15 13.010 -6.096 7.052 113 HA ARG 15 HA ARG 15 12.582 -8.937 6.418 114 HB2 ARG 15 HB2 ARG 15 14.326 -8.327 8.228 115 HB3 ARG 15 HB3 ARG 15 12.931 -7.926 9.220 116 HG2 ARG 15 HG2 ARG 15 12.097 -10.283 8.643 117 HG3 ARG 15 HG3 ARG 15 13.762 -10.592 8.145 118 HD2 ARG 15 HD2 ARG 15 13.560 -11.282 10.412 119 HD3 ARG 15 HD3 ARG 15 14.491 -9.786 10.398 120 HE ARG 15 HE ARG 15 11.638 -9.488 10.827 121 HH11 ARG 15 HH11 ARG 15 14.803 -9.789 12.293 122 HH12 ARG 15 HH12 ARG 15 14.298 -9.114 13.808 123 HH21 ARG 15 HH21 ARG 15 10.972 -8.608 12.808 124 HH22 ARG 15 HH22 ARG 15 12.112 -8.438 14.106 125 H ILE 16 H ILE 16 10.511 -9.535 6.376 126 HA ILE 16 HA ILE 16 8.582 -8.102 8.072 127 HB ILE 16 HB ILE 16 8.044 -8.882 5.196 128 HG12 ILE 16 HG12 ILE 16 8.167 -6.068 6.260 129 HG13 ILE 16 HG13 ILE 16 9.611 -6.878 5.659 130 HG21 ILE 16 HG21 ILE 16 5.929 -7.713 5.487 131 HG22 ILE 16 HG22 ILE 16 6.352 -7.328 7.155 132 HG23 ILE 16 HG23 ILE 16 6.086 -9.004 6.677 133 HD11 ILE 16 HD11 ILE 16 8.654 -5.496 3.938 134 HD12 ILE 16 HD12 ILE 16 7.100 -6.311 4.104 135 HD13 ILE 16 HD13 ILE 16 8.497 -7.194 3.492 136 H TYR 17 H TYR 17 7.430 -9.444 9.273 137 HA TYR 17 HA TYR 17 6.443 -11.300 10.115 138 HB2 TYR 17 HB2 TYR 17 5.539 -11.244 7.590 139 HB3 TYR 17 HB3 TYR 17 6.420 -12.766 7.528 140 HD1 TYR 17 HD1 TYR 17 4.039 -11.022 9.835 141 HD2 TYR 17 HD2 TYR 17 5.198 -14.663 7.970 142 HE1 TYR 17 HE1 TYR 17 2.125 -12.159 10.882 143 HE2 TYR 17 HE2 TYR 17 3.290 -15.810 9.010 144 HH TYR 17 HH TYR 17 1.782 -15.596 10.826 145 H GLY 18 H GLY 18 9.412 -11.105 9.604 146 HA2 GLY 18 HA2 GLY 18 11.015 -12.490 10.668 147 HA3 GLY 18 HA3 GLY 18 9.988 -13.879 10.344 148 H GLN 19 H GLN 19 9.775 -12.595 7.486 149 HA GLN 19 HA GLN 19 12.172 -13.983 6.507 150 HB2 GLN 19 HB2 GLN 19 9.481 -13.434 5.296 151 HB3 GLN 19 HB3 GLN 19 10.858 -13.828 4.278 152 HG2 GLN 19 HG2 GLN 19 10.420 -15.969 4.603 153 HG3 GLN 19 HG3 GLN 19 10.840 -15.758 6.303 154 HE21 GLN 19 HE21 GLN 19 9.185 -15.454 7.817 155 HE22 GLN 19 HE22 GLN 19 7.545 -15.869 7.469 156 H ASP 20 H ASP 20 13.470 -13.059 4.889 157 HA ASP 20 HA ASP 20 13.488 -10.146 4.949 158 HB2 ASP 20 HB2 ASP 20 15.752 -10.252 4.276 159 HB3 ASP 20 HB3 ASP 20 15.551 -11.582 5.409 160 H TYR 21 H TYR 21 13.317 -8.856 3.166 161 HA TYR 21 HA TYR 21 12.796 -10.134 0.576 162 HB2 TYR 21 HB2 TYR 21 11.031 -8.022 1.834 163 HB3 TYR 21 HB3 TYR 21 10.857 -8.665 0.206 164 HD1 TYR 21 HD2 TYR 21 10.377 -11.160 -0.046 165 HD2 TYR 21 HD1 TYR 21 9.992 -9.078 3.646 166 HE1 TYR 21 HE2 TYR 21 8.956 -12.968 0.818 167 HE2 TYR 21 HE1 TYR 21 8.570 -10.890 4.521 168 HH TYR 21 HH TYR 21 7.260 -12.693 3.842 169 H THR 22 H THR 22 13.627 -9.070 -1.132 170 HA THR 22 HA THR 22 15.095 -6.610 -0.606 171 HB THR 22 HB THR 22 15.267 -7.668 -3.318 172 HG1 THR 22 HG1 THR 22 16.224 -9.331 -1.208 173 HG21 THR 22 HG21 THR 22 17.681 -7.578 -2.793 174 HG22 THR 22 HG22 THR 22 17.279 -7.189 -1.119 175 HG23 THR 22 HG23 THR 22 16.853 -6.068 -2.413 176 H ILE 23 H ILE 23 14.256 -4.704 -1.136 177 HA ILE 23 HA ILE 23 12.307 -4.586 -3.340 178 HB ILE 23 HB ILE 23 11.209 -2.684 -2.006 179 HG12 ILE 23 HG12 ILE 23 12.632 -4.136 0.244 180 HG13 ILE 23 HG13 ILE 23 12.943 -2.482 -0.277 181 HG21 ILE 23 HG21 ILE 23 9.688 -4.229 -0.938 182 HG22 ILE 23 HG22 ILE 23 10.901 -5.507 -0.994 183 HG23 ILE 23 HG23 ILE 23 10.204 -4.888 -2.490 184 HD11 ILE 23 HD11 ILE 23 11.641 -2.228 1.612 185 HD12 ILE 23 HD12 ILE 23 10.605 -3.592 1.209 186 HD13 ILE 23 HD13 ILE 23 10.465 -2.081 0.305 187 H VAL 24 H VAL 24 11.970 -2.220 -4.034 188 HA VAL 24 HA VAL 24 14.646 -1.121 -4.474 189 HB VAL 24 HB VAL 24 12.047 -0.325 -5.797 190 HG11 VAL 24 HG11 VAL 24 14.895 0.185 -6.643 191 HG12 VAL 24 HG12 VAL 24 13.850 1.367 -5.858 192 HG13 VAL 24 HG13 VAL 24 13.436 0.747 -7.457 193 HG21 VAL 24 HG21 VAL 24 12.750 -1.691 -7.688 194 HG22 VAL 24 HG22 VAL 24 12.582 -2.678 -6.236 195 HG23 VAL 24 HG23 VAL 24 14.183 -2.206 -6.799 196 H GLY 25 H GLY 25 15.305 0.385 -3.078 197 HA2 GLY 25 HA2 GLY 25 13.325 2.366 -2.144 198 HA3 GLY 25 HA3 GLY 25 14.597 1.732 -1.108 199 H ALA 26 H ALA 26 14.058 3.509 -4.123 200 HA ALA 26 HA ALA 26 16.731 4.675 -3.904 201 HB1 ALA 26 HB1 ALA 26 16.291 5.577 -6.150 202 HB2 ALA 26 HB2 ALA 26 14.676 4.864 -6.101 203 HB3 ALA 26 HB3 ALA 26 16.102 3.825 -6.080 204 H GLU 27 H GLU 27 14.130 5.355 -2.323 205 HA GLU 27 HA GLU 27 13.951 8.201 -2.946 206 HB2 GLU 27 HB2 GLU 27 11.875 6.841 -2.597 207 HB3 GLU 27 HB3 GLU 27 12.351 6.626 -0.921 208 HG2 GLU 27 HG2 GLU 27 12.162 9.392 -1.983 209 HG3 GLU 27 HG3 GLU 27 10.671 8.513 -1.656 210 H SER 28 H SER 28 14.229 6.292 0.078 211 HA SER 28 HA SER 28 16.503 7.792 0.941 212 HB2 SER 28 HB2 SER 28 15.497 8.833 2.904 213 HB3 SER 28 HB3 SER 28 14.660 9.398 1.457 214 HG SER 28 HG SER 28 12.971 8.009 1.901 215 HA PRO 29 HA PRO 29 17.003 3.953 3.087 216 HB2 PRO 29 HB2 PRO 29 18.938 4.689 4.846 217 HB3 PRO 29 HB3 PRO 29 19.255 4.405 3.131 218 HG2 PRO 29 HG2 PRO 29 18.834 6.993 4.576 219 HG3 PRO 29 HG3 PRO 29 20.032 6.590 3.333 220 HD2 PRO 29 HD2 PRO 29 17.773 7.966 2.777 221 HD3 PRO 29 HD3 PRO 29 18.516 6.852 1.611 222 H ALA 30 H ALA 30 15.775 6.772 4.476 223 HA ALA 30 HA ALA 30 15.483 5.699 7.153 224 HB1 ALA 30 HB1 ALA 30 14.436 7.826 7.687 225 HB2 ALA 30 HB2 ALA 30 14.419 8.268 5.979 226 HB3 ALA 30 HB3 ALA 30 15.955 8.083 6.830 227 H HIS 31 H HIS 31 13.278 6.742 4.536 228 HA HIS 31 HA HIS 31 10.922 5.903 5.847 229 HB2 HIS 31 HB2 HIS 31 11.528 6.395 2.941 230 HB3 HIS 31 HB3 HIS 31 9.934 5.916 3.503 231 HD1 HIS 31 HD1 HIS 31 11.281 8.765 2.312 232 HD2 HIS 31 HD2 HIS 31 9.494 7.940 5.979 233 HE1 HIS 31 HE1 HIS 31 10.567 10.985 3.239 234 HE2 HIS 31 HE2 HIS 31 9.243 10.433 5.299 235 H ILE 32 H ILE 32 12.977 4.292 3.465 236 HA ILE 32 HA ILE 32 11.350 1.997 3.174 237 HB ILE 32 HB ILE 32 13.212 0.957 2.045 238 HG12 ILE 32 HG12 ILE 32 14.867 3.293 3.053 239 HG13 ILE 32 HG13 ILE 32 15.015 1.625 3.587 240 HG21 ILE 32 HG21 ILE 32 13.277 3.865 1.282 241 HG22 ILE 32 HG22 ILE 32 11.852 2.858 1.025 242 HG23 ILE 32 HG23 ILE 32 13.372 2.448 0.239 243 HD11 ILE 32 HD11 ILE 32 16.756 1.856 2.094 244 HD12 ILE 32 HD12 ILE 32 15.812 2.848 0.985 245 HD13 ILE 32 HD13 ILE 32 15.498 1.117 1.105 246 H ARG 33 H ARG 33 13.081 2.984 5.831 247 HA ARG 33 HA ARG 33 13.819 0.304 6.693 248 HB2 ARG 33 HB2 ARG 33 14.768 2.899 7.269 249 HB3 ARG 33 HB3 ARG 33 14.059 2.297 8.759 250 HG2 ARG 33 HG2 ARG 33 16.327 1.706 8.833 251 HG3 ARG 33 HG3 ARG 33 15.461 0.223 8.443 252 HD2 ARG 33 HD2 ARG 33 16.186 0.230 6.234 253 HD3 ARG 33 HD3 ARG 33 16.557 1.954 6.259 254 HE ARG 33 HE ARG 33 18.201 -0.206 7.365 255 HH11 ARG 33 HH11 ARG 33 17.786 3.201 6.632 256 HH12 ARG 33 HH12 ARG 33 19.452 3.590 6.941 257 HH21 ARG 33 HH21 ARG 33 20.382 0.315 7.763 258 HH22 ARG 33 HH22 ARG 33 20.924 1.954 7.580 259 H LEU 34 H LEU 34 11.260 2.589 7.046 260 HA LEU 34 HA LEU 34 10.191 1.131 9.353 261 HB2 LEU 34 HB2 LEU 34 8.705 3.014 9.718 262 HB3 LEU 34 HB3 LEU 34 10.373 3.539 9.645 263 HG LEU 34 HG LEU 34 9.578 3.926 7.059 264 HD11 LEU 34 HD11 LEU 34 7.268 3.370 7.523 265 HD12 LEU 34 HD12 LEU 34 7.420 5.091 7.168 266 HD13 LEU 34 HD13 LEU 34 7.223 4.549 8.834 267 HD21 LEU 34 HD21 LEU 34 10.835 5.495 8.410 268 HD22 LEU 34 HD22 LEU 34 9.402 5.842 9.378 269 HD23 LEU 34 HD23 LEU 34 9.450 6.302 7.678 270 H VAL 35 H VAL 35 9.669 1.555 5.975 271 HA VAL 35 HA VAL 35 6.912 1.088 5.824 272 HB VAL 35 HB VAL 35 7.296 0.310 3.514 273 HG11 VAL 35 HG11 VAL 35 8.678 2.810 4.445 274 HG12 VAL 35 HG12 VAL 35 7.058 2.634 3.769 275 HG13 VAL 35 HG13 VAL 35 8.472 2.417 2.740 276 HG21 VAL 35 HG21 VAL 35 9.617 0.400 2.615 277 HG22 VAL 35 HG22 VAL 35 9.345 -0.919 3.755 278 HG23 VAL 35 HG23 VAL 35 10.207 0.530 4.271 279 H ALA 36 H ALA 36 9.580 -1.127 6.254 280 HA ALA 36 HA ALA 36 8.196 -3.521 5.653 281 HB1 ALA 36 HB1 ALA 36 10.676 -3.227 5.771 282 HB2 ALA 36 HB2 ALA 36 10.055 -4.651 6.608 283 HB3 ALA 36 HB3 ALA 36 10.528 -3.220 7.529 284 H ALA 37 H ALA 37 8.898 -1.871 8.716 285 HA ALA 37 HA ALA 37 7.614 -3.734 10.391 286 HB1 ALA 37 HB1 ALA 37 8.029 -0.791 10.911 287 HB2 ALA 37 HB2 ALA 37 9.251 -2.039 11.161 288 HB3 ALA 37 HB3 ALA 37 7.767 -2.056 12.114 289 H PHE 38 H PHE 38 6.467 -1.018 8.535 290 HA PHE 38 HA PHE 38 3.968 -0.639 9.752 291 HB2 PHE 38 HB2 PHE 38 5.122 0.849 8.036 292 HB3 PHE 38 HB3 PHE 38 4.548 -0.277 6.811 293 HD1 PHE 38 HD1 PHE 38 2.116 -0.526 6.403 294 HD2 PHE 38 HD2 PHE 38 3.678 2.445 9.028 295 HE1 PHE 38 HE1 PHE 38 -0.019 0.689 6.292 296 HE2 PHE 38 HE2 PHE 38 1.544 3.662 8.921 297 HZ PHE 38 HZ PHE 38 -0.309 2.786 7.550 298 H VAL 39 H VAL 39 4.870 -2.580 6.912 299 HA VAL 39 HA VAL 39 2.274 -3.688 6.563 300 HB VAL 39 HB VAL 39 4.947 -4.613 5.506 301 HG11 VAL 39 HG11 VAL 39 3.645 -5.845 3.822 302 HG12 VAL 39 HG12 VAL 39 2.160 -5.402 4.665 303 HG13 VAL 39 HG13 VAL 39 3.342 -6.445 5.454 304 HG21 VAL 39 HG21 VAL 39 3.085 -2.501 4.768 305 HG22 VAL 39 HG22 VAL 39 3.478 -3.581 3.433 306 HG23 VAL 39 HG23 VAL 39 4.769 -2.741 4.297 307 H ASP 40 H ASP 40 5.162 -4.680 8.290 308 HA ASP 40 HA ASP 40 4.526 -7.341 8.826 309 HB2 ASP 40 HB2 ASP 40 6.687 -6.064 9.372 310 HB3 ASP 40 HB3 ASP 40 5.864 -5.530 10.833 311 H ASP 41 H ASP 41 3.638 -4.387 10.542 312 HA ASP 41 HA ASP 41 2.212 -5.640 12.651 313 HB2 ASP 41 HB2 ASP 41 2.281 -2.864 11.524 314 HB3 ASP 41 HB3 ASP 41 1.040 -3.295 12.692 315 H LYS 42 H LYS 42 1.246 -4.252 9.555 316 HA LYS 42 HA LYS 42 -1.511 -4.508 9.807 317 HB2 LYS 42 HB2 LYS 42 0.213 -4.650 7.331 318 HB3 LYS 42 HB3 LYS 42 -1.539 -4.517 7.311 319 HG2 LYS 42 HG2 LYS 42 -0.379 -2.468 8.966 320 HG3 LYS 42 HG3 LYS 42 0.313 -2.441 7.344 321 HD2 LYS 42 HD2 LYS 42 -1.559 -1.020 7.234 322 HD3 LYS 42 HD3 LYS 42 -2.092 -2.531 6.497 323 HE2 LYS 42 HE2 LYS 42 -3.196 -3.174 8.561 324 HE3 LYS 42 HE3 LYS 42 -2.601 -1.717 9.356 325 HZ1 LYS 42 HZ1 LYS 42 -3.905 -0.379 7.817 326 HZ2 LYS 42 HZ2 LYS 42 -4.897 -1.473 8.644 327 HZ3 LYS 42 HZ3 LYS 42 -4.466 -1.773 7.038 328 H MET 43 H MET 43 0.779 -6.795 8.272 329 HA MET 43 HA MET 43 -1.136 -8.764 7.685 330 HB2 MET 43 HB2 MET 43 1.841 -8.885 8.091 331 HB3 MET 43 HB3 MET 43 0.908 -10.341 7.775 332 HG2 MET 43 HG2 MET 43 0.028 -8.749 5.783 333 HG3 MET 43 HG3 MET 43 1.674 -8.149 5.974 334 HE1 MET 43 HE1 MET 43 2.961 -10.968 7.081 335 HE2 MET 43 HE2 MET 43 3.822 -9.888 5.983 336 HE3 MET 43 HE3 MET 43 3.654 -11.597 5.585 337 H HIS 44 H HIS 44 0.679 -8.086 10.588 338 HA HIS 44 HA HIS 44 0.099 -10.510 11.942 339 HB2 HIS 44 HB2 HIS 44 1.288 -7.906 12.646 340 HB3 HIS 44 HB3 HIS 44 0.470 -8.724 13.969 341 HD1 HIS 44 HD1 HIS 44 3.666 -8.567 12.293 342 HD2 HIS 44 HD2 HIS 44 1.487 -11.500 14.293 343 HE1 HIS 44 HE1 HIS 44 5.326 -10.350 12.905 344 HE2 HIS 44 HE2 HIS 44 4.023 -12.003 14.281 345 H GLU 45 H GLU 45 -1.522 -7.357 11.856 346 HA GLU 45 HA GLU 45 -3.460 -8.129 13.822 347 HB2 GLU 45 HB2 GLU 45 -4.423 -5.991 13.544 348 HB3 GLU 45 HB3 GLU 45 -2.688 -5.762 13.383 349 HG2 GLU 45 HG2 GLU 45 -2.910 -5.685 10.958 350 HG3 GLU 45 HG3 GLU 45 -4.644 -5.949 11.098 351 H PHE 46 H PHE 46 -3.304 -8.259 10.319 352 HA PHE 46 HA PHE 46 -6.128 -8.719 10.031 353 HB2 PHE 46 HB2 PHE 46 -3.794 -8.929 8.134 354 HB3 PHE 46 HB3 PHE 46 -5.406 -9.464 7.669 355 HD1 PHE 46 HD1 PHE 46 -7.237 -7.538 8.568 356 HD2 PHE 46 HD2 PHE 46 -3.257 -6.908 7.204 357 HE1 PHE 46 HE1 PHE 46 -7.817 -5.229 7.951 358 HE2 PHE 46 HE2 PHE 46 -3.829 -4.599 6.587 359 HZ PHE 46 HZ PHE 46 -6.110 -3.758 6.960 360 H SER 47 H SER 47 -3.388 -10.615 10.762 361 HA SER 47 HA SER 47 -4.233 -13.137 9.867 362 HB2 SER 47 HB2 SER 47 -1.938 -12.300 10.850 363 HB3 SER 47 HB3 SER 47 -2.627 -12.836 12.381 364 HG SER 47 HG SER 47 -1.727 -14.307 10.223 365 H GLU 48 H GLU 48 -4.961 -11.336 12.822 366 HA GLU 48 HA GLU 48 -6.288 -13.559 14.063 367 HB2 GLU 48 HB2 GLU 48 -6.891 -12.024 15.830 368 HB3 GLU 48 HB3 GLU 48 -5.205 -11.792 15.401 369 HG2 GLU 48 HG2 GLU 48 -5.827 -9.630 15.540 370 HG3 GLU 48 HG3 GLU 48 -6.251 -9.912 13.855 371 H LYS 49 H LYS 49 -7.137 -11.297 11.695 372 HA LYS 49 HA LYS 49 -9.933 -11.134 12.232 373 HB2 LYS 49 HB2 LYS 49 -8.269 -10.526 9.792 374 HB3 LYS 49 HB3 LYS 49 -10.015 -10.353 9.800 375 HG2 LYS 49 HG2 LYS 49 -8.642 -9.014 12.022 376 HG3 LYS 49 HG3 LYS 49 -8.255 -8.386 10.422 377 HD2 LYS 49 HD2 LYS 49 -10.091 -7.110 11.058 378 HD3 LYS 49 HD3 LYS 49 -10.808 -8.359 10.044 379 HE2 LYS 49 HE2 LYS 49 -12.195 -8.139 11.951 380 HE3 LYS 49 HE3 LYS 49 -11.293 -9.638 12.159 381 HZ1 LYS 49 HZ1 LYS 49 -10.602 -7.038 13.412 382 HZ2 LYS 49 HZ2 LYS 49 -9.779 -8.503 13.647 383 HZ3 LYS 49 HZ3 LYS 49 -11.373 -8.322 14.193 384 H GLN 50 H GLN 50 -7.869 -13.263 10.404 385 HA GLN 50 HA GLN 50 -8.205 -15.197 9.274 386 HB2 GLN 50 HB2 GLN 50 -10.579 -15.303 11.130 387 HB3 GLN 50 HB3 GLN 50 -10.128 -16.628 10.072 388 HG2 GLN 50 HG2 GLN 50 -7.943 -16.753 11.207 389 HG3 GLN 50 HG3 GLN 50 -8.469 -15.473 12.303 390 HE21 GLN 50 HE21 GLN 50 -7.697 -18.225 12.887 391 HE22 GLN 50 HE22 GLN 50 -9.052 -18.950 13.680 392 HA PRO 51 HA PRO 51 -11.354 -13.322 6.464 393 HB2 PRO 51 HB2 PRO 51 -9.408 -13.062 4.408 394 HB3 PRO 51 HB3 PRO 51 -10.170 -11.773 5.336 395 HG2 PRO 51 HG2 PRO 51 -7.482 -12.517 5.460 396 HG3 PRO 51 HG3 PRO 51 -8.334 -11.500 6.631 397 HD2 PRO 51 HD2 PRO 51 -7.585 -14.368 6.808 398 HD3 PRO 51 HD3 PRO 51 -7.780 -13.167 8.101 399 H MET 52 H MET 52 -8.674 -14.982 4.828 400 HA MET 52 HA MET 52 -10.628 -16.874 3.724 401 HB2 MET 52 HB2 MET 52 -7.854 -16.174 2.751 402 HB3 MET 52 HB3 MET 52 -8.973 -17.269 1.952 403 HG2 MET 52 HG2 MET 52 -9.495 -14.346 2.445 404 HG3 MET 52 HG3 MET 52 -8.881 -15.020 0.935 405 HE1 MET 52 HE1 MET 52 -12.848 -13.908 0.773 406 HE2 MET 52 HE2 MET 52 -11.244 -13.365 0.292 407 HE3 MET 52 HE3 MET 52 -11.711 -13.333 1.992 408 H LEU 53 H LEU 53 -8.539 -16.687 6.183 409 HA LEU 53 HA LEU 53 -7.434 -18.128 7.533 410 HB2 LEU 53 HB2 LEU 53 -9.387 -19.965 6.180 411 HB3 LEU 53 HB3 LEU 53 -8.269 -20.554 7.395 412 HG LEU 53 HG LEU 53 -10.130 -18.265 7.965 413 HD11 LEU 53 HD11 LEU 53 -11.441 -20.229 7.180 414 HD12 LEU 53 HD12 LEU 53 -11.741 -19.796 8.862 415 HD13 LEU 53 HD13 LEU 53 -10.714 -21.176 8.477 416 HD21 LEU 53 HD21 LEU 53 -8.369 -18.495 9.555 417 HD22 LEU 53 HD22 LEU 53 -8.611 -20.239 9.653 418 HD23 LEU 53 HD23 LEU 53 -9.835 -19.142 10.290 419 H ASP 54 H ASP 54 -6.067 -17.500 5.153 420 HA ASP 54 HA ASP 54 -4.334 -19.825 4.985 421 HB2 ASP 54 HB2 ASP 54 -6.066 -19.869 3.068 422 HB3 ASP 54 HB3 ASP 54 -5.182 -18.491 2.420 423 H VAL 55 H VAL 55 -2.199 -19.304 4.413 424 HA VAL 55 HA VAL 55 -1.345 -16.760 5.253 425 HB VAL 55 HB VAL 55 0.247 -18.868 3.798 426 HG11 VAL 55 HG11 VAL 55 1.267 -16.591 3.788 427 HG12 VAL 55 HG12 VAL 55 2.214 -17.803 4.654 428 HG13 VAL 55 HG13 VAL 55 1.250 -16.631 5.551 429 HG21 VAL 55 HG21 VAL 55 -0.179 -18.354 6.738 430 HG22 VAL 55 HG22 VAL 55 1.006 -19.476 6.074 431 HG23 VAL 55 HG23 VAL 55 -0.714 -19.763 5.818 432 HA PRO 56 HA PRO 56 -0.047 -15.774 0.665 433 HB2 PRO 56 HB2 PRO 56 -1.470 -17.165 -1.253 434 HB3 PRO 56 HB3 PRO 56 0.177 -17.554 -0.741 435 HG2 PRO 56 HG2 PRO 56 -2.413 -18.781 0.094 436 HG3 PRO 56 HG3 PRO 56 -0.856 -19.561 -0.236 437 HD2 PRO 56 HD2 PRO 56 -1.712 -19.136 2.269 438 HD3 PRO 56 HD3 PRO 56 0.006 -19.005 1.841 439 H LYS 57 H LYS 57 -3.286 -16.715 1.567 440 HA LYS 57 HA LYS 57 -4.528 -14.710 -0.105 441 HB2 LYS 57 HB2 LYS 57 -5.832 -16.377 2.037 442 HB3 LYS 57 HB3 LYS 57 -6.613 -15.564 0.689 443 HG2 LYS 57 HG2 LYS 57 -4.611 -17.769 0.317 444 HG3 LYS 57 HG3 LYS 57 -6.342 -18.059 0.488 445 HD2 LYS 57 HD2 LYS 57 -5.583 -16.031 -1.511 446 HD3 LYS 57 HD3 LYS 57 -5.097 -17.685 -1.881 447 HE2 LYS 57 HE2 LYS 57 -7.887 -16.769 -1.202 448 HE3 LYS 57 HE3 LYS 57 -7.297 -17.167 -2.815 449 HZ1 LYS 57 HZ1 LYS 57 -8.089 -19.188 -2.349 450 HZ2 LYS 57 HZ2 LYS 57 -8.150 -18.908 -0.687 451 HZ3 LYS 57 HZ3 LYS 57 -6.697 -19.387 -1.409 452 H LEU 58 H LEU 58 -2.970 -14.682 2.830 453 HA LEU 58 HA LEU 58 -4.669 -12.662 4.063 454 HB2 LEU 58 HB2 LEU 58 -3.626 -14.400 5.463 455 HB3 LEU 58 HB3 LEU 58 -2.039 -13.850 4.960 456 HG LEU 58 HG LEU 58 -2.635 -11.605 6.012 457 HD11 LEU 58 HD11 LEU 58 -5.020 -11.857 6.154 458 HD12 LEU 58 HD12 LEU 58 -4.353 -11.710 7.780 459 HD13 LEU 58 HD13 LEU 58 -4.845 -13.289 7.171 460 HD21 LEU 58 HD21 LEU 58 -1.084 -13.196 7.024 461 HD22 LEU 58 HD22 LEU 58 -2.432 -14.029 7.796 462 HD23 LEU 58 HD23 LEU 58 -2.043 -12.368 8.250 463 H ALA 59 H ALA 59 -1.497 -12.997 2.587 464 HA ALA 59 HA ALA 59 -0.556 -10.397 3.050 465 HB1 ALA 59 HB1 ALA 59 1.011 -10.863 1.190 466 HB2 ALA 59 HB2 ALA 59 0.110 -12.337 0.841 467 HB3 ALA 59 HB3 ALA 59 0.944 -12.158 2.385 468 H VAL 60 H VAL 60 -2.440 -11.752 0.387 469 HA VAL 60 HA VAL 60 -2.408 -9.455 -1.249 470 HB VAL 60 HB VAL 60 -4.345 -10.360 -2.426 471 HG11 VAL 60 HG11 VAL 60 -2.398 -12.567 -1.779 472 HG12 VAL 60 HG12 VAL 60 -2.106 -11.252 -2.918 473 HG13 VAL 60 HG13 VAL 60 -3.392 -12.418 -3.223 474 HG21 VAL 60 HG21 VAL 60 -5.372 -12.484 -1.741 475 HG22 VAL 60 HG22 VAL 60 -5.662 -11.186 -0.585 476 HG23 VAL 60 HG23 VAL 60 -4.463 -12.426 -0.234 477 H LEU 61 H LEU 61 -4.478 -10.432 1.419 478 HA LEU 61 HA LEU 61 -6.454 -8.426 1.068 479 HB2 LEU 61 HB2 LEU 61 -6.732 -10.500 2.438 480 HB3 LEU 61 HB3 LEU 61 -5.633 -9.815 3.619 481 HG LEU 61 HG LEU 61 -7.511 -7.830 3.368 482 HD11 LEU 61 HD11 LEU 61 -8.922 -9.283 1.977 483 HD12 LEU 61 HD12 LEU 61 -9.690 -8.882 3.512 484 HD13 LEU 61 HD13 LEU 61 -8.965 -10.473 3.277 485 HD21 LEU 61 HD21 LEU 61 -6.582 -8.584 5.458 486 HD22 LEU 61 HD22 LEU 61 -7.411 -10.133 5.312 487 HD23 LEU 61 HD23 LEU 61 -8.342 -8.655 5.551 488 H THR 62 H THR 62 -3.472 -8.655 2.894 489 HA THR 62 HA THR 62 -3.689 -6.198 4.264 490 HB THR 62 HB THR 62 -1.166 -7.677 3.486 491 HG1 THR 62 HG1 THR 62 -2.546 -9.059 4.639 492 HG21 THR 62 HG21 THR 62 -1.739 -5.721 5.710 493 HG22 THR 62 HG22 THR 62 -0.724 -5.427 4.296 494 HG23 THR 62 HG23 THR 62 -0.236 -6.615 5.505 495 H ALA 63 H ALA 63 -2.218 -7.141 1.200 496 HA ALA 63 HA ALA 63 -0.938 -4.733 0.580 497 HB1 ALA 63 HB1 ALA 63 -0.522 -6.878 -0.558 498 HB2 ALA 63 HB2 ALA 63 -0.833 -5.561 -1.685 499 HB3 ALA 63 HB3 ALA 63 -2.096 -6.742 -1.342 500 H VAL 64 H VAL 64 -4.165 -5.893 -0.433 501 HA VAL 64 HA VAL 64 -4.779 -3.546 -1.881 502 HB VAL 64 HB VAL 64 -5.935 -5.692 -2.273 503 HG11 VAL 64 HG11 VAL 64 -7.868 -6.261 -0.808 504 HG12 VAL 64 HG12 VAL 64 -7.255 -5.091 0.360 505 HG13 VAL 64 HG13 VAL 64 -6.289 -6.503 -0.061 506 HG21 VAL 64 HG21 VAL 64 -6.893 -3.640 -3.133 507 HG22 VAL 64 HG22 VAL 64 -7.735 -3.365 -1.607 508 HG23 VAL 64 HG23 VAL 64 -8.175 -4.738 -2.622 509 H GLN 65 H GLN 65 -5.300 -4.436 1.483 510 HA GLN 65 HA GLN 65 -7.067 -2.355 2.153 511 HB2 GLN 65 HB2 GLN 65 -5.332 -4.218 3.633 512 HB3 GLN 65 HB3 GLN 65 -5.654 -2.699 4.458 513 HG2 GLN 65 HG2 GLN 65 -7.792 -4.521 3.359 514 HG3 GLN 65 HG3 GLN 65 -7.258 -4.511 5.040 515 HE21 GLN 65 HE21 GLN 65 -6.909 -1.584 5.054 516 HE22 GLN 65 HE22 GLN 65 -8.514 -0.938 5.122 517 H ILE 66 H ILE 66 -3.527 -2.533 2.348 518 HA ILE 66 HA ILE 66 -3.043 0.011 3.383 519 HB ILE 66 HB ILE 66 -1.360 -1.685 1.534 520 HG12 ILE 66 HG12 ILE 66 -0.993 -1.131 4.479 521 HG13 ILE 66 HG13 ILE 66 -1.950 -2.481 3.885 522 HG21 ILE 66 HG21 ILE 66 -0.729 0.677 1.319 523 HG22 ILE 66 HG22 ILE 66 0.533 -0.271 2.104 524 HG23 ILE 66 HG23 ILE 66 -0.515 0.772 3.066 525 HD11 ILE 66 HD11 ILE 66 0.182 -3.334 4.401 526 HD12 ILE 66 HD12 ILE 66 0.995 -2.022 3.552 527 HD13 ILE 66 HD13 ILE 66 0.100 -3.238 2.643 528 H ALA 67 H ALA 67 -3.563 -1.054 0.067 529 HA ALA 67 HA ALA 67 -2.875 1.304 -1.266 530 HB1 ALA 67 HB1 ALA 67 -4.979 -0.712 -2.041 531 HB2 ALA 67 HB2 ALA 67 -3.258 -0.825 -2.412 532 HB3 ALA 67 HB3 ALA 67 -4.228 0.474 -3.112 533 H SER 68 H SER 68 -6.105 0.207 -0.176 534 HA SER 68 HA SER 68 -7.458 2.560 -0.918 535 HB2 SER 68 HB2 SER 68 -8.889 1.525 1.218 536 HB3 SER 68 HB3 SER 68 -9.092 1.078 -0.477 537 HG SER 68 HG SER 68 -7.483 -0.203 1.482 538 H GLU 69 H GLU 69 -5.811 1.624 2.050 539 HA GLU 69 HA GLU 69 -6.709 3.739 3.677 540 HB2 GLU 69 HB2 GLU 69 -4.280 1.965 3.789 541 HB3 GLU 69 HB3 GLU 69 -4.582 3.205 4.997 542 HG2 GLU 69 HG2 GLU 69 -6.576 2.153 5.714 543 HG3 GLU 69 HG3 GLU 69 -6.566 1.048 4.341 544 H TYR 70 H TYR 70 -4.210 3.582 1.251 545 HA TYR 70 HA TYR 70 -3.230 6.221 2.061 546 HB2 TYR 70 HB2 TYR 70 -2.081 3.996 0.442 547 HB3 TYR 70 HB3 TYR 70 -1.513 5.640 0.154 548 HD1 TYR 70 HD2 TYR 70 -1.705 2.915 2.623 549 HD2 TYR 70 HD1 TYR 70 -0.175 6.794 1.780 550 HE1 TYR 70 HE2 TYR 70 -0.218 2.747 4.575 551 HE2 TYR 70 HE1 TYR 70 1.312 6.638 3.727 552 HH TYR 70 HH TYR 70 1.880 3.734 5.384 553 H LEU 71 H LEU 71 -5.184 4.724 -0.334 554 HA LEU 71 HA LEU 71 -4.838 6.572 -2.439 555 HB2 LEU 71 HB2 LEU 71 -6.643 4.392 -1.835 556 HB3 LEU 71 HB3 LEU 71 -7.536 5.745 -2.482 557 HG LEU 71 HG LEU 71 -6.972 4.210 -4.264 558 HD11 LEU 71 HD11 LEU 71 -6.208 5.707 -5.840 559 HD12 LEU 71 HD12 LEU 71 -5.086 6.480 -4.725 560 HD13 LEU 71 HD13 LEU 71 -6.818 6.774 -4.575 561 HD21 LEU 71 HD21 LEU 71 -4.689 3.704 -4.901 562 HD22 LEU 71 HD22 LEU 71 -4.999 3.170 -3.251 563 HD23 LEU 71 HD23 LEU 71 -4.075 4.644 -3.544 564 H LYS 72 H LYS 72 -6.926 6.560 0.391 565 HA LYS 72 HA LYS 72 -8.390 8.888 -0.360 566 HB2 LYS 72 HB2 LYS 72 -9.388 8.794 1.797 567 HB3 LYS 72 HB3 LYS 72 -9.167 7.127 1.281 568 HG2 LYS 72 HG2 LYS 72 -7.176 6.949 2.681 569 HG3 LYS 72 HG3 LYS 72 -7.381 8.627 3.185 570 HD2 LYS 72 HD2 LYS 72 -9.411 6.439 3.640 571 HD3 LYS 72 HD3 LYS 72 -8.234 6.977 4.837 572 HE2 LYS 72 HE2 LYS 72 -10.302 8.763 3.554 573 HE3 LYS 72 HE3 LYS 72 -10.501 7.978 5.118 574 HZ1 LYS 72 HZ1 LYS 72 -8.428 9.985 4.408 575 HZ2 LYS 72 HZ2 LYS 72 -8.519 9.180 5.888 576 HZ3 LYS 72 HZ3 LYS 72 -9.758 10.228 5.425 577 H LEU 73 H LEU 73 -5.292 8.364 0.972 578 HA LEU 73 HA LEU 73 -5.058 10.855 2.358 579 HB2 LEU 73 HB2 LEU 73 -3.727 8.845 2.922 580 HB3 LEU 73 HB3 LEU 73 -2.903 8.978 1.381 581 HG LEU 73 HG LEU 73 -1.983 11.165 2.091 582 HD11 LEU 73 HD11 LEU 73 -2.098 11.640 4.575 583 HD12 LEU 73 HD12 LEU 73 -3.453 10.513 4.634 584 HD13 LEU 73 HD13 LEU 73 -3.561 11.975 3.651 585 HD21 LEU 73 HD21 LEU 73 -0.403 10.251 3.751 586 HD22 LEU 73 HD22 LEU 73 -0.656 9.168 2.382 587 HD23 LEU 73 HD23 LEU 73 -1.441 8.835 3.925 588 H LYS 74 H LYS 74 -4.197 9.666 -0.860 589 HA LYS 74 HA LYS 74 -2.948 12.168 -1.559 590 HB2 LYS 74 HB2 LYS 74 -2.627 11.238 -3.758 591 HB3 LYS 74 HB3 LYS 74 -2.215 10.016 -2.568 592 HG2 LYS 74 HG2 LYS 74 -3.560 8.608 -3.621 593 HG3 LYS 74 HG3 LYS 74 -4.927 9.623 -3.165 594 HD2 LYS 74 HD2 LYS 74 -5.045 9.395 -5.514 595 HD3 LYS 74 HD3 LYS 74 -4.405 11.013 -5.220 596 HE2 LYS 74 HE2 LYS 74 -2.895 10.363 -6.777 597 HE3 LYS 74 HE3 LYS 74 -2.100 9.662 -5.371 598 HZ1 LYS 74 HZ1 LYS 74 -3.002 7.533 -5.885 599 HZ2 LYS 74 HZ2 LYS 74 -2.310 8.144 -7.304 600 HZ3 LYS 74 HZ3 LYS 74 -3.987 8.174 -7.107 601 H GLU 75 H GLU 75 -6.098 10.830 -1.583 602 HA GLU 75 HA GLU 75 -7.271 12.431 -3.601 603 HB2 GLU 75 HB2 GLU 75 -8.365 10.409 -2.812 604 HB3 GLU 75 HB3 GLU 75 -8.484 11.068 -1.190 605 HG2 GLU 75 HG2 GLU 75 -10.626 11.214 -2.213 606 HG3 GLU 75 HG3 GLU 75 -9.969 12.844 -2.079 607 H GLU 76 H GLU 76 -7.075 12.763 -0.065 608 HA GLU 76 HA GLU 76 -8.476 15.209 0.056 609 HB2 GLU 76 HB2 GLU 76 -7.716 15.400 2.319 610 HB3 GLU 76 HB3 GLU 76 -8.068 13.705 2.012 611 HG2 GLU 76 HG2 GLU 76 -5.781 13.146 1.915 612 HG3 GLU 76 HG3 GLU 76 -5.297 14.838 1.807 613 H TYR 77 H TYR 77 -5.177 14.421 -0.663 614 HA TYR 77 HA TYR 77 -3.957 16.888 -0.164 615 HB2 TYR 77 HB2 TYR 77 -2.548 15.014 -0.586 616 HB3 TYR 77 HB3 TYR 77 -3.319 14.691 -2.135 617 HD1 TYR 77 HD2 TYR 77 -1.787 17.713 -0.574 618 HD2 TYR 77 HD1 TYR 77 -1.855 15.067 -3.897 619 HE1 TYR 77 HE2 TYR 77 -0.102 19.093 -1.686 620 HE2 TYR 77 HE1 TYR 77 -0.159 16.441 -5.030 621 HH TYR 77 HH TYR 77 1.787 18.230 -3.972 622 H GLN 78 H GLN 78 -5.255 15.615 -3.234 623 HA GLN 78 HA GLN 78 -4.840 18.069 -4.611 624 HB2 GLN 78 HB2 GLN 78 -5.926 17.049 -6.470 625 HB3 GLN 78 HB3 GLN 78 -4.949 15.813 -5.695 626 HG2 GLN 78 HG2 GLN 78 -7.014 15.002 -4.556 627 HG3 GLN 78 HG3 GLN 78 -7.933 16.150 -5.529 628 HE21 GLN 78 HE21 GLN 78 -8.292 13.353 -5.548 629 HE22 GLN 78 HE22 GLN 78 -7.905 12.790 -7.134 630 H ARG 79 H ARG 79 -7.400 16.801 -2.663 631 HA ARG 79 HA ARG 79 -9.472 18.529 -3.629 632 HB2 ARG 79 HB2 ARG 79 -9.197 16.532 -1.483 633 HB3 ARG 79 HB3 ARG 79 -10.244 17.879 -1.073 634 HG2 ARG 79 HG2 ARG 79 -11.447 15.952 -2.028 635 HG3 ARG 79 HG3 ARG 79 -11.651 17.437 -2.960 636 HD2 ARG 79 HD2 ARG 79 -9.374 15.910 -3.871 637 HD3 ARG 79 HD3 ARG 79 -10.852 14.949 -3.915 638 HE ARG 79 HE ARG 79 -10.502 17.553 -5.273 639 HH11 ARG 79 HH11 ARG 79 -11.813 14.295 -5.188 640 HH12 ARG 79 HH12 ARG 79 -12.784 14.525 -6.615 641 HH21 ARG 79 HH21 ARG 79 -11.789 17.860 -7.111 642 HH22 ARG 79 HH22 ARG 79 -12.777 16.555 -7.701 643 H LEU 80 H LEU 80 -7.098 18.622 -1.071 644 HA LEU 80 HA LEU 80 -8.050 20.953 0.225 645 HB2 LEU 80 HB2 LEU 80 -6.575 19.415 1.352 646 HB3 LEU 80 HB3 LEU 80 -5.341 19.637 0.128 647 HG LEU 80 HG LEU 80 -5.365 22.123 0.904 648 HD11 LEU 80 HD11 LEU 80 -6.445 20.796 3.380 649 HD12 LEU 80 HD12 LEU 80 -7.389 21.829 2.309 650 HD13 LEU 80 HD13 LEU 80 -6.007 22.492 3.182 651 HD21 LEU 80 HD21 LEU 80 -3.711 21.593 2.656 652 HD22 LEU 80 HD22 LEU 80 -3.457 20.660 1.181 653 HD23 LEU 80 HD23 LEU 80 -4.206 19.903 2.589 654 H ARG 81 H ARG 81 -5.581 20.374 -2.230 655 HA ARG 81 HA ARG 81 -4.683 23.042 -2.421 656 HB2 ARG 81 HB2 ARG 81 -4.527 20.802 -4.437 657 HB3 ARG 81 HB3 ARG 81 -3.651 22.322 -4.551 658 HG2 ARG 81 HG2 ARG 81 -2.713 21.655 -2.214 659 HG3 ARG 81 HG3 ARG 81 -3.244 20.037 -2.675 660 HD2 ARG 81 HD2 ARG 81 -0.910 20.396 -3.270 661 HD3 ARG 81 HD3 ARG 81 -1.904 20.158 -4.703 662 HE ARG 81 HE ARG 81 -1.745 22.891 -4.290 663 HH11 ARG 81 HH11 ARG 81 0.486 20.266 -4.928 664 HH12 ARG 81 HH12 ARG 81 1.583 21.258 -5.840 665 HH21 ARG 81 HH21 ARG 81 -0.277 24.202 -5.487 666 HH22 ARG 81 HH22 ARG 81 1.160 23.485 -6.136 667 H GLU 82 H GLU 82 -7.051 21.217 -4.386 668 HA GLU 82 HA GLU 82 -7.490 23.322 -6.223 669 HB2 GLU 82 HB2 GLU 82 -9.316 22.058 -7.064 670 HB3 GLU 82 HB3 GLU 82 -8.079 20.907 -6.587 671 HG2 GLU 82 HG2 GLU 82 -9.318 20.584 -4.449 672 HG3 GLU 82 HG3 GLU 82 -10.610 21.579 -5.117 673 H GLN 83 H GLN 83 -8.899 22.597 -3.097 674 HA GLN 83 HA GLN 83 -11.121 24.354 -3.344 675 HB2 GLN 83 HB2 GLN 83 -10.917 22.486 -1.674 676 HB3 GLN 83 HB3 GLN 83 -9.765 23.477 -0.790 677 HG2 GLN 83 HG2 GLN 83 -11.434 25.126 -0.329 678 HG3 GLN 83 HG3 GLN 83 -12.588 24.329 -1.395 679 HE21 GLN 83 HE21 GLN 83 -13.697 22.561 -0.680 680 HE22 GLN 83 HE22 GLN 83 -13.671 22.026 0.965 681 H LEU 84 H LEU 84 -7.790 24.825 -2.745 682 HA LEU 84 HA LEU 84 -8.210 27.512 -1.666 683 HB2 LEU 84 HB2 LEU 84 -6.544 25.985 -0.625 684 HB3 LEU 84 HB3 LEU 84 -5.641 25.998 -2.128 685 HG LEU 84 HG LEU 84 -5.620 28.603 -1.765 686 HD11 LEU 84 HD11 LEU 84 -5.862 27.680 1.090 687 HD12 LEU 84 HD12 LEU 84 -7.160 28.467 0.191 688 HD13 LEU 84 HD13 LEU 84 -5.655 29.330 0.501 689 HD21 LEU 84 HD21 LEU 84 -3.886 26.681 -0.211 690 HD22 LEU 84 HD22 LEU 84 -3.535 28.394 -0.430 691 HD23 LEU 84 HD23 LEU 84 -3.587 27.325 -1.828 692 H LYS 85 H LYS 85 -6.791 25.836 -4.430 693 HA LYS 85 HA LYS 85 -5.806 28.191 -5.693 694 HB2 LYS 85 HB2 LYS 85 -6.285 25.394 -6.710 695 HB3 LYS 85 HB3 LYS 85 -5.587 26.673 -7.694 696 HG2 LYS 85 HG2 LYS 85 -3.685 26.838 -6.248 697 HG3 LYS 85 HG3 LYS 85 -4.414 25.729 -5.086 698 HD2 LYS 85 HD2 LYS 85 -2.869 24.417 -6.269 699 HD3 LYS 85 HD3 LYS 85 -4.431 24.022 -6.990 700 HE2 LYS 85 HE2 LYS 85 -3.961 25.644 -8.796 701 HE3 LYS 85 HE3 LYS 85 -2.372 25.931 -8.090 702 HZ1 LYS 85 HZ1 LYS 85 -3.332 23.295 -9.060 703 HZ2 LYS 85 HZ2 LYS 85 -1.778 23.658 -8.501 704 HZ3 LYS 85 HZ3 LYS 85 -2.338 24.340 -9.940 705 H LYS 86 H LYS 86 -8.628 26.107 -6.362 706 HA LYS 86 HA LYS 86 -9.583 27.900 -8.401 707 HB2 LYS 86 HB2 LYS 86 -9.924 25.387 -8.375 708 HB3 LYS 86 HB3 LYS 86 -11.104 25.642 -7.099 709 HG2 LYS 86 HG2 LYS 86 -12.498 26.935 -8.563 710 HG3 LYS 86 HG3 LYS 86 -11.277 26.887 -9.835 711 HD2 LYS 86 HD2 LYS 86 -12.898 25.260 -10.407 712 HD3 LYS 86 HD3 LYS 86 -11.505 24.371 -9.786 713 HE2 LYS 86 HE2 LYS 86 -12.594 24.053 -7.661 714 HE3 LYS 86 HE3 LYS 86 -13.935 25.093 -8.145 715 HZ1 LYS 86 HZ1 LYS 86 -14.371 22.657 -8.303 716 HZ2 LYS 86 HZ2 LYS 86 -13.231 22.576 -9.546 717 HZ3 LYS 86 HZ3 LYS 86 -14.630 23.504 -9.743 718 H1 GLY 1 H1 GLY 1 -33.357 -0.421 23.912 719 H2 GLY 1 H2 GLY 1 -32.255 -1.379 24.761 720 H3 GLY 1 H3 GLY 1 -32.342 -1.480 23.076 721 HA2 GLY 1 HA3 GLY 1 -31.361 0.801 24.686 722 HA3 GLY 1 HA2 GLY 1 -30.422 -0.214 23.600 723 H SER 2 H SER 2 -29.744 1.340 22.208 724 HA SER 2 HA SER 2 -31.177 3.466 21.168 725 HB2 SER 2 HB2 SER 2 -29.165 1.998 19.496 726 HB3 SER 2 HB3 SER 2 -29.397 3.734 19.685 727 HG SER 2 HG SER 2 -27.595 2.398 20.869 728 H HIS 3 H HIS 3 -32.670 3.709 19.608 729 HA HIS 3 HA HIS 3 -33.865 1.331 18.501 730 HB2 HIS 3 HB2 HIS 3 -34.595 4.220 18.600 731 HB3 HIS 3 HB3 HIS 3 -35.343 3.207 17.369 732 HD1 HIS 3 HD1 HIS 3 -36.964 1.349 18.180 733 HD2 HIS 3 HD2 HIS 3 -35.447 3.752 21.216 734 HE1 HIS 3 HE1 HIS 3 -38.389 0.876 20.196 735 HE2 HIS 3 HE2 HIS 3 -37.348 2.214 22.054 736 H MET 4 H MET 4 -32.406 4.288 17.103 737 HA MET 4 HA MET 4 -31.648 2.649 14.799 738 HB2 MET 4 HB2 MET 4 -32.441 4.269 13.188 739 HB3 MET 4 HB3 MET 4 -33.771 3.751 14.212 740 HG2 MET 4 HG2 MET 4 -32.259 6.249 14.843 741 HG3 MET 4 HG3 MET 4 -33.518 6.252 13.610 742 HE1 MET 4 HE1 MET 4 -35.722 7.888 16.225 743 HE2 MET 4 HE2 MET 4 -35.247 7.781 14.530 744 HE3 MET 4 HE3 MET 4 -34.076 8.299 15.742 745 H THR 5 H THR 5 -30.387 4.283 17.149 746 HA THR 5 HA THR 5 -28.686 6.128 15.715 747 HB THR 5 HB THR 5 -27.743 5.475 18.367 748 HG1 THR 5 HG1 THR 5 -29.608 6.083 19.503 749 HG21 THR 5 HG21 THR 5 -27.250 7.563 17.206 750 HG22 THR 5 HG22 THR 5 -28.097 7.883 18.718 751 HG23 THR 5 HG23 THR 5 -28.965 7.972 17.188 752 H GLU 6 H GLU 6 -27.816 4.481 14.224 753 HA GLU 6 HA GLU 6 -25.375 3.346 15.318 754 HB2 GLU 6 HB2 GLU 6 -27.093 1.552 15.534 755 HB3 GLU 6 HB3 GLU 6 -27.324 1.615 13.793 756 HG2 GLU 6 HG2 GLU 6 -25.126 0.822 13.383 757 HG3 GLU 6 HG3 GLU 6 -24.673 1.019 15.076 758 H GLN 7 H GLN 7 -23.744 3.668 13.978 759 HA GLN 7 HA GLN 7 -24.174 3.714 11.095 760 HB2 GLN 7 HB2 GLN 7 -24.406 6.065 11.898 761 HB3 GLN 7 HB3 GLN 7 -22.775 5.967 12.549 762 HG2 GLN 7 HG2 GLN 7 -21.975 5.483 10.234 763 HG3 GLN 7 HG3 GLN 7 -23.606 5.831 9.665 764 HE21 GLN 7 HE21 GLN 7 -20.677 7.153 10.946 765 HE22 GLN 7 HE22 GLN 7 -21.072 8.815 10.687 766 HA PRO 8 HA PRO 8 -20.227 1.668 12.082 767 HB2 PRO 8 HB2 PRO 8 -20.679 -0.639 10.817 768 HB3 PRO 8 HB3 PRO 8 -21.425 -0.295 12.382 769 HG2 PRO 8 HG2 PRO 8 -22.631 -0.269 9.664 770 HG3 PRO 8 HG3 PRO 8 -23.368 -0.691 11.217 771 HD2 PRO 8 HD2 PRO 8 -23.574 1.787 9.860 772 HD3 PRO 8 HD3 PRO 8 -24.106 1.434 11.515 773 H LYS 9 H LYS 9 -18.727 0.412 10.436 774 HA LYS 9 HA LYS 9 -18.355 2.192 8.180 775 HB2 LYS 9 HB2 LYS 9 -16.208 1.192 7.937 776 HB3 LYS 9 HB3 LYS 9 -16.478 1.362 9.666 777 HG2 LYS 9 HG2 LYS 9 -17.157 -1.022 9.749 778 HG3 LYS 9 HG3 LYS 9 -16.746 -1.160 8.039 779 HD2 LYS 9 HD2 LYS 9 -14.754 -1.839 8.882 780 HD3 LYS 9 HD3 LYS 9 -14.460 -0.102 8.952 781 HE2 LYS 9 HE2 LYS 9 -13.819 -1.058 11.050 782 HE3 LYS 9 HE3 LYS 9 -15.285 -0.113 11.294 783 HZ1 LYS 9 HZ1 LYS 9 -15.482 -2.996 10.752 784 HZ2 LYS 9 HZ2 LYS 9 -16.555 -1.996 11.595 785 HZ3 LYS 9 HZ3 LYS 9 -15.095 -2.465 12.307 786 H THR 10 H THR 10 -17.757 1.141 6.017 787 HA THR 10 HA THR 10 -19.571 -1.114 5.520 788 HB THR 10 HB THR 10 -20.279 1.133 4.540 789 HG1 THR 10 HG1 THR 10 -20.836 -1.096 3.738 790 HG21 THR 10 HG21 THR 10 -18.017 1.829 3.797 791 HG22 THR 10 HG22 THR 10 -19.210 1.869 2.499 792 HG23 THR 10 HG23 THR 10 -18.050 0.542 2.593 793 H ARG 11 H ARG 11 -18.933 -2.680 4.035 794 HA ARG 11 HA ARG 11 -16.075 -2.627 3.332 795 HB2 ARG 11 HB2 ARG 11 -16.074 -5.102 3.605 796 HB3 ARG 11 HB3 ARG 11 -16.362 -4.235 5.104 797 HG2 ARG 11 HG2 ARG 11 -18.778 -4.688 4.861 798 HG3 ARG 11 HG3 ARG 11 -18.420 -5.636 3.415 799 HD2 ARG 11 HD2 ARG 11 -17.035 -7.146 4.732 800 HD3 ARG 11 HD3 ARG 11 -17.334 -6.184 6.176 801 HE ARG 11 HE ARG 11 -19.674 -7.278 4.836 802 HH11 ARG 11 HH11 ARG 11 -17.345 -7.557 7.440 803 HH12 ARG 11 HH12 ARG 11 -18.321 -8.652 8.368 804 HH21 ARG 11 HH21 ARG 11 -20.956 -8.735 6.054 805 HH22 ARG 11 HH22 ARG 11 -20.374 -9.321 7.580 806 H VAL 12 H VAL 12 -15.490 -3.728 1.381 807 HA VAL 12 HA VAL 12 -17.754 -4.137 -0.453 808 HB VAL 12 HB VAL 12 -16.645 -1.918 -0.809 809 HG11 VAL 12 HG11 VAL 12 -14.448 -1.964 -2.012 810 HG12 VAL 12 HG12 VAL 12 -14.295 -3.655 -1.539 811 HG13 VAL 12 HG13 VAL 12 -14.369 -2.398 -0.306 812 HG21 VAL 12 HG21 VAL 12 -16.393 -3.835 -3.126 813 HG22 VAL 12 HG22 VAL 12 -16.560 -2.084 -3.224 814 HG23 VAL 12 HG23 VAL 12 -17.888 -3.059 -2.599 815 H SER 13 H SER 13 -17.456 -5.671 -2.092 816 HA SER 13 HA SER 13 -15.257 -7.552 -1.604 817 HB2 SER 13 HB2 SER 13 -17.722 -8.160 -3.222 818 HB3 SER 13 HB3 SER 13 -16.656 -9.281 -2.373 819 HG SER 13 HG SER 13 -18.327 -7.355 -1.116 820 H VAL 14 H VAL 14 -13.700 -7.768 -3.095 821 HA VAL 14 HA VAL 14 -14.251 -6.936 -5.862 822 HB VAL 14 HB VAL 14 -12.002 -5.926 -6.006 823 HG11 VAL 14 HG11 VAL 14 -12.500 -3.854 -4.799 824 HG12 VAL 14 HG12 VAL 14 -13.762 -4.688 -3.890 825 HG13 VAL 14 HG13 VAL 14 -13.922 -4.477 -5.634 826 HG21 VAL 14 HG21 VAL 14 -11.942 -6.276 -3.010 827 HG22 VAL 14 HG22 VAL 14 -10.759 -5.390 -3.971 828 HG23 VAL 14 HG23 VAL 14 -10.934 -7.132 -4.177 829 H ARG 15 H ARG 15 -12.425 -7.705 -7.346 830 HA ARG 15 HA ARG 15 -11.574 -10.379 -6.471 831 HB2 ARG 15 HB2 ARG 15 -13.212 -10.409 -8.309 832 HB3 ARG 15 HB3 ARG 15 -12.136 -9.411 -9.278 833 HG2 ARG 15 HG2 ARG 15 -10.788 -11.138 -9.810 834 HG3 ARG 15 HG3 ARG 15 -10.967 -11.907 -8.232 835 HD2 ARG 15 HD2 ARG 15 -11.977 -13.336 -9.838 836 HD3 ARG 15 HD3 ARG 15 -13.279 -12.579 -8.924 837 HE ARG 15 HE ARG 15 -12.871 -10.989 -11.147 838 HH11 ARG 15 HH11 ARG 15 -13.741 -14.320 -10.539 839 HH12 ARG 15 HH12 ARG 15 -14.711 -14.465 -11.967 840 HH21 ARG 15 HH21 ARG 15 -14.147 -11.176 -13.045 841 HH22 ARG 15 HH22 ARG 15 -14.934 -12.684 -13.395 842 H ILE 16 H ILE 16 -9.459 -10.655 -6.207 843 HA ILE 16 HA ILE 16 -7.604 -9.038 -7.820 844 HB ILE 16 HB ILE 16 -7.006 -9.676 -4.941 845 HG12 ILE 16 HG12 ILE 16 -8.102 -7.015 -5.852 846 HG13 ILE 16 HG13 ILE 16 -9.150 -8.284 -5.227 847 HG21 ILE 16 HG21 ILE 16 -5.971 -7.530 -6.792 848 HG22 ILE 16 HG22 ILE 16 -5.163 -9.062 -6.458 849 HG23 ILE 16 HG23 ILE 16 -5.390 -7.885 -5.165 850 HD11 ILE 16 HD11 ILE 16 -6.945 -6.845 -3.785 851 HD12 ILE 16 HD12 ILE 16 -7.750 -8.283 -3.153 852 HD13 ILE 16 HD13 ILE 16 -8.675 -6.809 -3.444 853 H TYR 17 H TYR 17 -6.079 -10.211 -8.783 854 HA TYR 17 HA TYR 17 -4.746 -11.925 -9.400 855 HB2 TYR 17 HB2 TYR 17 -4.258 -11.569 -6.752 856 HB3 TYR 17 HB3 TYR 17 -4.735 -13.260 -6.766 857 HD1 TYR 17 HD1 TYR 17 -2.730 -11.226 -9.189 858 HD2 TYR 17 HD2 TYR 17 -2.834 -14.535 -6.517 859 HE1 TYR 17 HE1 TYR 17 -0.461 -11.859 -9.890 860 HE2 TYR 17 HE2 TYR 17 -0.565 -15.170 -7.210 861 HH TYR 17 HH TYR 17 1.485 -13.161 -8.896 862 H GLY 18 H GLY 18 -7.696 -12.225 -9.366 863 HA2 GLY 18 HA2 GLY 18 -8.795 -13.987 -10.544 864 HA3 GLY 18 HA3 GLY 18 -7.702 -15.131 -9.788 865 H GLN 19 H GLN 19 -8.032 -14.189 -7.090 866 HA GLN 19 HA GLN 19 -10.628 -15.425 -6.584 867 HB2 GLN 19 HB2 GLN 19 -8.231 -14.864 -4.863 868 HB3 GLN 19 HB3 GLN 19 -9.775 -15.298 -4.149 869 HG2 GLN 19 HG2 GLN 19 -8.680 -17.321 -4.271 870 HG3 GLN 19 HG3 GLN 19 -9.679 -17.336 -5.719 871 HE21 GLN 19 HE21 GLN 19 -8.721 -17.349 -7.702 872 HE22 GLN 19 HE22 GLN 19 -7.015 -17.482 -7.939 873 H ASP 20 H ASP 20 -11.959 -14.544 -4.765 874 HA ASP 20 HA ASP 20 -12.123 -11.624 -5.027 875 HB2 ASP 20 HB2 ASP 20 -14.459 -11.804 -4.474 876 HB3 ASP 20 HB3 ASP 20 -14.102 -12.967 -5.745 877 H TYR 21 H TYR 21 -12.244 -10.303 -3.259 878 HA TYR 21 HA TYR 21 -12.020 -11.531 -0.604 879 HB2 TYR 21 HB2 TYR 21 -10.161 -9.342 -1.558 880 HB3 TYR 21 HB3 TYR 21 -10.126 -10.149 0.007 881 HD1 TYR 21 HD1 TYR 21 -9.375 -12.518 0.156 882 HD2 TYR 21 HD2 TYR 21 -9.129 -10.310 -3.475 883 HE1 TYR 21 HE1 TYR 21 -7.812 -14.186 -0.750 884 HE2 TYR 21 HE2 TYR 21 -7.564 -11.970 -4.385 885 HH TYR 21 HH TYR 21 -6.160 -13.699 -3.792 886 H THR 22 H THR 22 -12.539 -10.081 1.129 887 HA THR 22 HA THR 22 -14.148 -7.765 0.267 888 HB THR 22 HB THR 22 -14.605 -9.223 2.860 889 HG1 THR 22 HG1 THR 22 -14.900 -10.294 0.434 890 HG21 THR 22 HG21 THR 22 -16.406 -7.621 1.037 891 HG22 THR 22 HG22 THR 22 -15.689 -7.055 2.548 892 HG23 THR 22 HG23 THR 22 -16.882 -8.355 2.570 893 H ILE 23 H ILE 23 -13.407 -5.842 0.960 894 HA ILE 23 HA ILE 23 -11.823 -5.776 3.432 895 HB ILE 23 HB ILE 23 -10.327 -4.074 2.478 896 HG12 ILE 23 HG12 ILE 23 -12.047 -3.546 0.578 897 HG13 ILE 23 HG13 ILE 23 -10.328 -3.369 0.277 898 HG21 ILE 23 HG21 ILE 23 -10.368 -6.792 1.213 899 HG22 ILE 23 HG22 ILE 23 -9.443 -6.234 2.605 900 HG23 ILE 23 HG23 ILE 23 -9.037 -5.658 0.992 901 HD11 ILE 23 HD11 ILE 23 -10.258 -5.248 -1.093 902 HD12 ILE 23 HD12 ILE 23 -11.782 -4.472 -1.511 903 HD13 ILE 23 HD13 ILE 23 -11.774 -5.888 -0.465 904 H VAL 24 H VAL 24 -11.413 -3.286 3.940 905 HA VAL 24 HA VAL 24 -14.072 -2.210 4.320 906 HB VAL 24 HB VAL 24 -11.379 -1.184 5.249 907 HG11 VAL 24 HG11 VAL 24 -14.165 -0.340 6.056 908 HG12 VAL 24 HG12 VAL 24 -13.019 0.617 5.118 909 HG13 VAL 24 HG13 VAL 24 -12.665 0.219 6.799 910 HG21 VAL 24 HG21 VAL 24 -11.880 -3.322 6.240 911 HG22 VAL 24 HG22 VAL 24 -13.508 -2.788 6.660 912 HG23 VAL 24 HG23 VAL 24 -12.111 -2.059 7.452 913 H GLY 25 H GLY 25 -14.979 -0.634 3.141 914 HA2 GLY 25 HA2 GLY 25 -13.213 0.946 1.372 915 HA3 GLY 25 HA3 GLY 25 -14.768 0.324 0.839 916 H ALA 26 H ALA 26 -13.704 1.993 3.790 917 HA ALA 26 HA ALA 26 -16.079 3.641 3.713 918 HB1 ALA 26 HB1 ALA 26 -13.808 3.587 5.694 919 HB2 ALA 26 HB2 ALA 26 -15.334 2.713 5.837 920 HB3 ALA 26 HB3 ALA 26 -15.319 4.478 5.880 921 H GLU 27 H GLU 27 -15.239 4.542 1.588 922 HA GLU 27 HA GLU 27 -14.179 7.157 2.134 923 HB2 GLU 27 HB2 GLU 27 -12.133 5.818 1.792 924 HB3 GLU 27 HB3 GLU 27 -12.719 5.324 0.212 925 HG2 GLU 27 HG2 GLU 27 -12.665 8.212 0.616 926 HG3 GLU 27 HG3 GLU 27 -11.084 7.439 0.700 927 H SER 28 H SER 28 -14.581 5.074 -0.754 928 HA SER 28 HA SER 28 -16.981 6.376 -1.562 929 HB2 SER 28 HB2 SER 28 -16.180 7.508 -3.537 930 HB3 SER 28 HB3 SER 28 -15.250 8.098 -2.160 931 HG SER 28 HG SER 28 -13.580 6.610 -2.772 932 HA PRO 29 HA PRO 29 -17.279 2.445 -3.548 933 HB2 PRO 29 HB2 PRO 29 -19.270 2.988 -5.326 934 HB3 PRO 29 HB3 PRO 29 -19.550 2.733 -3.600 935 HG2 PRO 29 HG2 PRO 29 -19.339 5.294 -5.131 936 HG3 PRO 29 HG3 PRO 29 -20.477 4.849 -3.845 937 HD2 PRO 29 HD2 PRO 29 -18.313 6.403 -3.388 938 HD3 PRO 29 HD3 PRO 29 -18.946 5.278 -2.170 939 H ALA 30 H ALA 30 -16.135 5.206 -5.067 940 HA ALA 30 HA ALA 30 -15.809 3.949 -7.679 941 HB1 ALA 30 HB1 ALA 30 -14.951 6.131 -8.392 942 HB2 ALA 30 HB2 ALA 30 -15.090 6.722 -6.738 943 HB3 ALA 30 HB3 ALA 30 -16.539 6.272 -7.638 944 H HIS 31 H HIS 31 -13.753 5.485 -5.191 945 HA HIS 31 HA HIS 31 -11.311 4.768 -6.433 946 HB2 HIS 31 HB2 HIS 31 -12.066 5.773 -3.723 947 HB3 HIS 31 HB3 HIS 31 -10.439 5.153 -3.985 948 HD1 HIS 31 HD1 HIS 31 -11.825 6.874 -6.918 949 HD2 HIS 31 HD2 HIS 31 -9.668 7.904 -3.519 950 HE1 HIS 31 HE1 HIS 31 -10.871 9.147 -7.389 951 HE2 HIS 31 HE2 HIS 31 -9.746 9.838 -5.237 952 H ILE 32 H ILE 32 -13.237 3.212 -3.915 953 HA ILE 32 HA ILE 32 -11.319 1.223 -3.271 954 HB ILE 32 HB ILE 32 -13.087 0.056 -2.106 955 HG12 ILE 32 HG12 ILE 32 -14.994 1.998 -3.449 956 HG13 ILE 32 HG13 ILE 32 -14.864 0.277 -3.797 957 HG21 ILE 32 HG21 ILE 32 -12.066 2.174 -1.201 958 HG22 ILE 32 HG22 ILE 32 -13.624 1.726 -0.512 959 HG23 ILE 32 HG23 ILE 32 -13.532 3.010 -1.717 960 HD11 ILE 32 HD11 ILE 32 -15.467 -0.085 -1.347 961 HD12 ILE 32 HD12 ILE 32 -16.738 0.484 -2.428 962 HD13 ILE 32 HD13 ILE 32 -15.934 1.618 -1.343 963 H ARG 33 H ARG 33 -13.108 1.607 -6.077 964 HA ARG 33 HA ARG 33 -13.262 -1.254 -6.613 965 HB2 ARG 33 HB2 ARG 33 -14.461 1.179 -7.806 966 HB3 ARG 33 HB3 ARG 33 -14.124 -0.155 -8.903 967 HG2 ARG 33 HG2 ARG 33 -15.457 -1.648 -7.521 968 HG3 ARG 33 HG3 ARG 33 -15.778 -0.330 -6.395 969 HD2 ARG 33 HD2 ARG 33 -17.029 0.865 -8.036 970 HD3 ARG 33 HD3 ARG 33 -16.524 -0.246 -9.310 971 HE ARG 33 HE ARG 33 -17.871 -1.686 -7.302 972 HH11 ARG 33 HH11 ARG 33 -18.493 0.671 -9.812 973 HH12 ARG 33 HH12 ARG 33 -20.119 0.137 -10.086 974 HH21 ARG 33 HH21 ARG 33 -20.008 -2.390 -7.651 975 HH22 ARG 33 HH22 ARG 33 -20.981 -1.612 -8.858 976 H LEU 34 H LEU 34 -11.290 1.500 -7.326 977 HA LEU 34 HA LEU 34 -10.007 0.118 -9.546 978 HB2 LEU 34 HB2 LEU 34 -8.746 2.144 -9.932 979 HB3 LEU 34 HB3 LEU 34 -10.454 2.503 -9.813 980 HG LEU 34 HG LEU 34 -9.785 3.050 -7.289 981 HD11 LEU 34 HD11 LEU 34 -7.613 4.148 -7.185 982 HD12 LEU 34 HD12 LEU 34 -7.261 3.630 -8.835 983 HD13 LEU 34 HD13 LEU 34 -7.433 2.431 -7.551 984 HD21 LEU 34 HD21 LEU 34 -9.385 4.846 -9.675 985 HD22 LEU 34 HD22 LEU 34 -9.512 5.405 -8.006 986 HD23 LEU 34 HD23 LEU 34 -10.878 4.595 -8.775 987 H VAL 35 H VAL 35 -9.539 0.650 -6.177 988 HA VAL 35 HA VAL 35 -6.738 0.390 -6.047 989 HB VAL 35 HB VAL 35 -7.046 -0.285 -3.690 990 HG11 VAL 35 HG11 VAL 35 -6.974 2.056 -4.204 991 HG12 VAL 35 HG12 VAL 35 -8.192 1.789 -2.956 992 HG13 VAL 35 HG13 VAL 35 -8.685 2.060 -4.628 993 HG21 VAL 35 HG21 VAL 35 -9.315 -0.327 -2.732 994 HG22 VAL 35 HG22 VAL 35 -9.043 -1.637 -3.879 995 HG23 VAL 35 HG23 VAL 35 -9.986 -0.227 -4.361 996 H ALA 36 H ALA 36 -9.280 -1.969 -6.364 997 HA ALA 36 HA ALA 36 -7.838 -4.273 -5.632 998 HB1 ALA 36 HB1 ALA 36 -10.311 -4.135 -5.905 999 HB2 ALA 36 HB2 ALA 36 -9.578 -5.515 -6.722 1000 HB3 ALA 36 HB3 ALA 36 -10.070 -4.099 -7.650 1001 H ALA 37 H ALA 37 -8.488 -2.841 -8.816 1002 HA ALA 37 HA ALA 37 -6.887 -4.678 -10.257 1003 HB1 ALA 37 HB1 ALA 37 -8.663 -3.456 -11.349 1004 HB2 ALA 37 HB2 ALA 37 -7.121 -3.091 -12.125 1005 HB3 ALA 37 HB3 ALA 37 -7.849 -1.927 -11.017 1006 H PHE 38 H PHE 38 -6.192 -1.802 -8.486 1007 HA PHE 38 HA PHE 38 -3.760 -1.043 -9.698 1008 HB2 PHE 38 HB2 PHE 38 -5.118 0.346 -8.104 1009 HB3 PHE 38 HB3 PHE 38 -4.567 -0.699 -6.801 1010 HD1 PHE 38 HD1 PHE 38 -2.195 -0.674 -6.114 1011 HD2 PHE 38 HD2 PHE 38 -3.725 2.032 -9.018 1012 HE1 PHE 38 HE1 PHE 38 -0.208 0.748 -5.825 1013 HE2 PHE 38 HE2 PHE 38 -1.736 3.457 -8.739 1014 HZ PHE 38 HZ PHE 38 0.022 2.817 -7.140 1015 H VAL 39 H VAL 39 -4.492 -3.094 -6.907 1016 HA VAL 39 HA VAL 39 -1.750 -3.806 -6.461 1017 HB VAL 39 HB VAL 39 -4.285 -5.030 -5.364 1018 HG11 VAL 39 HG11 VAL 39 -1.437 -5.342 -4.420 1019 HG12 VAL 39 HG12 VAL 39 -2.384 -6.576 -5.246 1020 HG13 VAL 39 HG13 VAL 39 -2.871 -6.018 -3.646 1021 HG21 VAL 39 HG21 VAL 39 -4.412 -3.111 -4.233 1022 HG22 VAL 39 HG22 VAL 39 -2.802 -2.610 -4.749 1023 HG23 VAL 39 HG23 VAL 39 -2.989 -3.661 -3.347 1024 H ASP 40 H ASP 40 -4.516 -5.263 -8.072 1025 HA ASP 40 HA ASP 40 -3.589 -7.849 -8.472 1026 HB2 ASP 40 HB2 ASP 40 -5.872 -7.092 -9.016 1027 HB3 ASP 40 HB3 ASP 40 -5.231 -6.155 -10.361 1028 H ASP 41 H ASP 41 -3.105 -4.974 -10.476 1029 HA ASP 41 HA ASP 41 -1.614 -6.229 -12.509 1030 HB2 ASP 41 HB2 ASP 41 -2.716 -3.981 -12.668 1031 HB3 ASP 41 HB3 ASP 41 -1.428 -3.335 -11.656 1032 H LYS 42 H LYS 42 -0.626 -4.600 -9.529 1033 HA LYS 42 HA LYS 42 2.146 -4.661 -10.025 1034 HB2 LYS 42 HB2 LYS 42 0.551 -4.480 -7.482 1035 HB3 LYS 42 HB3 LYS 42 2.308 -4.476 -7.483 1036 HG2 LYS 42 HG2 LYS 42 2.140 -2.522 -9.110 1037 HG3 LYS 42 HG3 LYS 42 0.440 -2.444 -8.647 1038 HD2 LYS 42 HD2 LYS 42 1.511 -0.916 -7.223 1039 HD3 LYS 42 HD3 LYS 42 1.283 -2.363 -6.237 1040 HE2 LYS 42 HE2 LYS 42 3.497 -1.549 -5.855 1041 HE3 LYS 42 HE3 LYS 42 3.616 -3.032 -6.799 1042 HZ1 LYS 42 HZ1 LYS 42 3.494 -0.567 -8.328 1043 HZ2 LYS 42 HZ2 LYS 42 4.455 -1.942 -8.564 1044 HZ3 LYS 42 HZ3 LYS 42 4.894 -0.779 -7.400 1045 H MET 43 H MET 43 -0.008 -7.001 -8.476 1046 HA MET 43 HA MET 43 2.050 -8.748 -7.608 1047 HB2 MET 43 HB2 MET 43 -0.871 -8.831 -7.755 1048 HB3 MET 43 HB3 MET 43 -0.118 -10.395 -8.030 1049 HG2 MET 43 HG2 MET 43 1.179 -10.039 -5.920 1050 HG3 MET 43 HG3 MET 43 0.179 -8.616 -5.627 1051 HE1 MET 43 HE1 MET 43 -2.671 -9.372 -6.543 1052 HE2 MET 43 HE2 MET 43 -2.319 -8.662 -4.969 1053 HE3 MET 43 HE3 MET 43 -3.349 -10.088 -5.081 1054 H HIS 44 H HIS 44 0.601 -8.147 -10.655 1055 HA HIS 44 HA HIS 44 1.542 -10.637 -11.817 1056 HB2 HIS 44 HB2 HIS 44 -0.005 -8.279 -12.856 1057 HB3 HIS 44 HB3 HIS 44 0.733 -9.416 -13.980 1058 HD1 HIS 44 HD1 HIS 44 -2.417 -8.801 -12.621 1059 HD2 HIS 44 HD2 HIS 44 -0.120 -12.252 -12.965 1060 HE1 HIS 44 HE1 HIS 44 -4.038 -10.711 -12.449 1061 HE2 HIS 44 HE2 HIS 44 -2.644 -12.786 -12.773 1062 H GLU 45 H GLU 45 2.470 -7.279 -11.603 1063 HA GLU 45 HA GLU 45 4.487 -7.407 -13.632 1064 HB2 GLU 45 HB2 GLU 45 4.867 -5.171 -13.207 1065 HB3 GLU 45 HB3 GLU 45 3.216 -5.332 -12.625 1066 HG2 GLU 45 HG2 GLU 45 4.119 -5.625 -10.316 1067 HG3 GLU 45 HG3 GLU 45 5.728 -5.294 -10.951 1068 H PHE 46 H PHE 46 4.376 -8.097 -10.220 1069 HA PHE 46 HA PHE 46 7.283 -8.199 -10.072 1070 HB2 PHE 46 HB2 PHE 46 5.086 -8.151 -8.081 1071 HB3 PHE 46 HB3 PHE 46 6.554 -9.009 -7.625 1072 HD1 PHE 46 HD2 PHE 46 8.761 -7.766 -7.818 1073 HD2 PHE 46 HD1 PHE 46 4.975 -5.825 -7.937 1074 HE1 PHE 46 HE2 PHE 46 9.840 -5.630 -7.242 1075 HE2 PHE 46 HE1 PHE 46 6.051 -3.688 -7.367 1076 HZ PHE 46 HZ PHE 46 8.481 -3.590 -7.017 1077 H SER 47 H SER 47 4.660 -10.300 -10.628 1078 HA SER 47 HA SER 47 5.614 -12.717 -9.605 1079 HB2 SER 47 HB2 SER 47 3.327 -12.346 -10.553 1080 HB3 SER 47 HB3 SER 47 4.035 -12.344 -12.164 1081 HG SER 47 HG SER 47 4.210 -14.443 -12.102 1082 H GLU 48 H GLU 48 6.204 -11.137 -12.686 1083 HA GLU 48 HA GLU 48 7.815 -13.170 -13.805 1084 HB2 GLU 48 HB2 GLU 48 8.440 -11.486 -15.471 1085 HB3 GLU 48 HB3 GLU 48 6.705 -11.484 -15.181 1086 HG2 GLU 48 HG2 GLU 48 6.845 -9.483 -13.901 1087 HG3 GLU 48 HG3 GLU 48 8.607 -9.554 -13.873 1088 H LYS 49 H LYS 49 8.465 -10.926 -11.345 1089 HA LYS 49 HA LYS 49 11.262 -10.580 -11.870 1090 HB2 LYS 49 HB2 LYS 49 9.418 -9.859 -9.640 1091 HB3 LYS 49 HB3 LYS 49 11.143 -9.863 -9.324 1092 HG2 LYS 49 HG2 LYS 49 9.765 -8.259 -11.467 1093 HG3 LYS 49 HG3 LYS 49 10.279 -7.640 -9.901 1094 HD2 LYS 49 HD2 LYS 49 12.033 -8.638 -12.148 1095 HD3 LYS 49 HD3 LYS 49 11.910 -6.999 -11.526 1096 HE2 LYS 49 HE2 LYS 49 12.728 -7.937 -9.308 1097 HE3 LYS 49 HE3 LYS 49 13.138 -9.403 -10.200 1098 HZ1 LYS 49 HZ1 LYS 49 14.532 -8.038 -11.661 1099 HZ2 LYS 49 HZ2 LYS 49 15.048 -7.993 -10.051 1100 HZ3 LYS 49 HZ3 LYS 49 14.201 -6.682 -10.704 1101 H GLN 50 H GLN 50 9.294 -12.823 -10.119 1102 HA GLN 50 HA GLN 50 9.726 -14.689 -8.899 1103 HB2 GLN 50 HB2 GLN 50 12.155 -14.743 -10.695 1104 HB3 GLN 50 HB3 GLN 50 11.560 -16.109 -9.758 1105 HG2 GLN 50 HG2 GLN 50 9.690 -16.373 -11.093 1106 HG3 GLN 50 HG3 GLN 50 9.771 -14.722 -11.704 1107 HE21 GLN 50 HE21 GLN 50 9.586 -17.252 -13.121 1108 HE22 GLN 50 HE22 GLN 50 10.937 -17.295 -14.199 1109 HA PRO 51 HA PRO 51 12.732 -12.712 -6.024 1110 HB2 PRO 51 HB2 PRO 51 10.707 -12.940 -3.976 1111 HB3 PRO 51 HB3 PRO 51 11.414 -11.476 -4.660 1112 HG2 PRO 51 HG2 PRO 51 8.812 -12.235 -5.043 1113 HG3 PRO 51 HG3 PRO 51 9.720 -11.214 -6.172 1114 HD2 PRO 51 HD2 PRO 51 9.117 -14.141 -6.330 1115 HD3 PRO 51 HD3 PRO 51 9.137 -12.923 -7.624 1116 H MET 52 H MET 52 10.375 -14.757 -4.349 1117 HA MET 52 HA MET 52 12.576 -16.544 -3.571 1118 HB2 MET 52 HB2 MET 52 9.894 -16.449 -2.214 1119 HB3 MET 52 HB3 MET 52 11.419 -17.048 -1.583 1120 HG2 MET 52 HG2 MET 52 10.629 -14.182 -2.036 1121 HG3 MET 52 HG3 MET 52 10.884 -14.999 -0.490 1122 HE1 MET 52 HE1 MET 52 13.718 -12.476 -0.494 1123 HE2 MET 52 HE2 MET 52 11.967 -12.635 -0.379 1124 HE3 MET 52 HE3 MET 52 12.706 -12.118 -1.895 1125 H LEU 53 H LEU 53 10.412 -16.384 -5.869 1126 HA LEU 53 HA LEU 53 9.248 -17.807 -7.196 1127 HB2 LEU 53 HB2 LEU 53 11.337 -19.582 -5.999 1128 HB3 LEU 53 HB3 LEU 53 10.091 -20.286 -7.009 1129 HG LEU 53 HG LEU 53 10.815 -18.537 -8.770 1130 HD11 LEU 53 HD11 LEU 53 13.129 -17.809 -8.618 1131 HD12 LEU 53 HD12 LEU 53 13.277 -18.561 -7.029 1132 HD13 LEU 53 HD13 LEU 53 12.194 -17.186 -7.255 1133 HD21 LEU 53 HD21 LEU 53 11.176 -20.913 -9.027 1134 HD22 LEU 53 HD22 LEU 53 12.600 -20.838 -7.986 1135 HD23 LEU 53 HD23 LEU 53 12.607 -20.031 -9.557 1136 H ASP 54 H ASP 54 7.760 -17.140 -5.129 1137 HA ASP 54 HA ASP 54 6.091 -19.448 -4.735 1138 HB2 ASP 54 HB2 ASP 54 7.887 -19.404 -2.851 1139 HB3 ASP 54 HB3 ASP 54 6.961 -18.045 -2.222 1140 H VAL 55 H VAL 55 3.984 -18.891 -4.323 1141 HA VAL 55 HA VAL 55 3.161 -16.315 -5.076 1142 HB VAL 55 HB VAL 55 1.565 -18.515 -3.759 1143 HG11 VAL 55 HG11 VAL 55 0.579 -16.031 -5.166 1144 HG12 VAL 55 HG12 VAL 55 0.485 -16.341 -3.433 1145 HG13 VAL 55 HG13 VAL 55 -0.424 -17.349 -4.558 1146 HG21 VAL 55 HG21 VAL 55 0.770 -18.942 -6.041 1147 HG22 VAL 55 HG22 VAL 55 2.520 -19.125 -5.921 1148 HG23 VAL 55 HG23 VAL 55 1.835 -17.672 -6.647 1149 HA PRO 56 HA PRO 56 1.866 -15.530 -0.429 1150 HB2 PRO 56 HB2 PRO 56 3.446 -16.898 1.390 1151 HB3 PRO 56 HB3 PRO 56 1.791 -17.329 0.955 1152 HG2 PRO 56 HG2 PRO 56 4.366 -18.460 -0.040 1153 HG3 PRO 56 HG3 PRO 56 2.846 -19.291 0.339 1154 HD2 PRO 56 HD2 PRO 56 3.576 -18.781 -2.185 1155 HD3 PRO 56 HD3 PRO 56 1.877 -18.692 -1.678 1156 H LYS 57 H LYS 57 5.147 -16.319 -1.374 1157 HA LYS 57 HA LYS 57 6.293 -14.211 0.239 1158 HB2 LYS 57 HB2 LYS 57 7.615 -15.922 -1.870 1159 HB3 LYS 57 HB3 LYS 57 8.434 -14.911 -0.695 1160 HG2 LYS 57 HG2 LYS 57 6.729 -17.299 -0.018 1161 HG3 LYS 57 HG3 LYS 57 8.485 -17.329 -0.159 1162 HD2 LYS 57 HD2 LYS 57 7.033 -15.517 1.758 1163 HD3 LYS 57 HD3 LYS 57 7.523 -17.154 2.180 1164 HE2 LYS 57 HE2 LYS 57 9.422 -15.023 1.210 1165 HE3 LYS 57 HE3 LYS 57 9.106 -15.369 2.903 1166 HZ1 LYS 57 HZ1 LYS 57 10.090 -17.454 2.739 1167 HZ2 LYS 57 HZ2 LYS 57 11.118 -16.454 1.841 1168 HZ3 LYS 57 HZ3 LYS 57 10.029 -17.478 1.048 1169 H LEU 58 H LEU 58 4.618 -14.258 -2.584 1170 HA LEU 58 HA LEU 58 6.169 -12.114 -3.843 1171 HB2 LEU 58 HB2 LEU 58 5.443 -13.955 -5.287 1172 HB3 LEU 58 HB3 LEU 58 3.773 -13.657 -4.840 1173 HG LEU 58 HG LEU 58 4.143 -11.301 -5.836 1174 HD11 LEU 58 HD11 LEU 58 6.550 -11.398 -6.003 1175 HD12 LEU 58 HD12 LEU 58 5.834 -11.232 -7.607 1176 HD13 LEU 58 HD13 LEU 58 6.443 -12.798 -7.070 1177 HD21 LEU 58 HD21 LEU 58 3.571 -12.105 -8.062 1178 HD22 LEU 58 HD22 LEU 58 2.710 -13.012 -6.819 1179 HD23 LEU 58 HD23 LEU 58 4.107 -13.728 -7.621 1180 H ALA 59 H ALA 59 2.921 -12.852 -2.661 1181 HA ALA 59 HA ALA 59 1.738 -10.371 -3.193 1182 HB1 ALA 59 HB1 ALA 59 1.104 -12.396 -1.058 1183 HB2 ALA 59 HB2 ALA 59 0.421 -12.318 -2.683 1184 HB3 ALA 59 HB3 ALA 59 0.064 -11.045 -1.514 1185 H VAL 60 H VAL 60 3.530 -11.507 -0.364 1186 HA VAL 60 HA VAL 60 3.042 -9.185 1.200 1187 HB VAL 60 HB VAL 60 3.725 -11.304 2.229 1188 HG11 VAL 60 HG11 VAL 60 6.235 -10.841 0.674 1189 HG12 VAL 60 HG12 VAL 60 5.261 -12.304 0.816 1190 HG13 VAL 60 HG13 VAL 60 6.259 -11.775 2.169 1191 HG21 VAL 60 HG21 VAL 60 4.081 -9.241 3.465 1192 HG22 VAL 60 HG22 VAL 60 5.672 -9.059 2.726 1193 HG23 VAL 60 HG23 VAL 60 5.358 -10.405 3.821 1194 H LEU 61 H LEU 61 5.363 -10.007 -1.254 1195 HA LEU 61 HA LEU 61 7.236 -7.938 -0.693 1196 HB2 LEU 61 HB2 LEU 61 7.775 -9.967 -2.010 1197 HB3 LEU 61 HB3 LEU 61 6.713 -9.396 -3.284 1198 HG LEU 61 HG LEU 61 8.255 -7.296 -3.281 1199 HD11 LEU 61 HD11 LEU 61 10.072 -9.359 -2.045 1200 HD12 LEU 61 HD12 LEU 61 9.513 -7.873 -1.281 1201 HD13 LEU 61 HD13 LEU 61 10.573 -7.794 -2.688 1202 HD21 LEU 61 HD21 LEU 61 8.043 -8.799 -5.157 1203 HD22 LEU 61 HD22 LEU 61 9.117 -9.966 -4.383 1204 HD23 LEU 61 HD23 LEU 61 9.743 -8.400 -4.906 1205 H THR 62 H THR 62 4.357 -8.213 -2.692 1206 HA THR 62 HA THR 62 4.734 -5.675 -3.963 1207 HB THR 62 HB THR 62 2.034 -6.252 -4.179 1208 HG1 THR 62 HG1 THR 62 3.509 -8.696 -4.300 1209 HG21 THR 62 HG21 THR 62 3.591 -5.592 -5.979 1210 HG22 THR 62 HG22 THR 62 2.568 -6.954 -6.426 1211 HG23 THR 62 HG23 THR 62 4.249 -7.230 -5.974 1212 H ALA 63 H ALA 63 3.014 -6.889 -1.166 1213 HA ALA 63 HA ALA 63 1.389 -4.715 -0.566 1214 HB1 ALA 63 HB1 ALA 63 1.348 -5.549 1.704 1215 HB2 ALA 63 HB2 ALA 63 2.800 -6.502 1.411 1216 HB3 ALA 63 HB3 ALA 63 1.298 -6.905 0.576 1217 H VAL 64 H VAL 64 4.736 -5.359 0.455 1218 HA VAL 64 HA VAL 64 4.965 -2.921 1.896 1219 HB VAL 64 HB VAL 64 6.371 -4.910 2.384 1220 HG11 VAL 64 HG11 VAL 64 7.747 -4.147 -0.181 1221 HG12 VAL 64 HG12 VAL 64 6.938 -5.669 0.189 1222 HG13 VAL 64 HG13 VAL 64 8.427 -5.237 1.028 1223 HG21 VAL 64 HG21 VAL 64 8.408 -3.651 2.870 1224 HG22 VAL 64 HG22 VAL 64 6.965 -2.706 3.234 1225 HG23 VAL 64 HG23 VAL 64 7.887 -2.378 1.767 1226 H GLN 65 H GLN 65 5.666 -3.846 -1.418 1227 HA GLN 65 HA GLN 65 7.157 -1.571 -2.133 1228 HB2 GLN 65 HB2 GLN 65 5.673 -3.673 -3.601 1229 HB3 GLN 65 HB3 GLN 65 5.908 -2.157 -4.462 1230 HG2 GLN 65 HG2 GLN 65 8.135 -3.748 -3.195 1231 HG3 GLN 65 HG3 GLN 65 7.683 -3.853 -4.897 1232 HE21 GLN 65 HE21 GLN 65 7.099 -0.964 -5.056 1233 HE22 GLN 65 HE22 GLN 65 8.643 -0.186 -5.077 1234 H ILE 66 H ILE 66 3.677 -2.245 -2.274 1235 HA ILE 66 HA ILE 66 2.852 0.189 -3.399 1236 HB ILE 66 HB ILE 66 1.384 -1.590 -1.436 1237 HG12 ILE 66 HG12 ILE 66 0.944 -1.398 -4.405 1238 HG13 ILE 66 HG13 ILE 66 2.153 -2.482 -3.729 1239 HG21 ILE 66 HG21 ILE 66 0.453 0.693 -1.496 1240 HG22 ILE 66 HG22 ILE 66 -0.657 -0.499 -2.171 1241 HG23 ILE 66 HG23 ILE 66 0.265 0.554 -3.244 1242 HD11 ILE 66 HD11 ILE 66 0.129 -3.693 -4.155 1243 HD12 ILE 66 HD12 ILE 66 -0.806 -2.541 -3.205 1244 HD13 ILE 66 HD13 ILE 66 0.379 -3.578 -2.414 1245 H ALA 67 H ALA 67 3.431 -0.767 -0.059 1246 HA ALA 67 HA ALA 67 2.538 1.579 1.188 1247 HB1 ALA 67 HB1 ALA 67 3.799 0.845 3.124 1248 HB2 ALA 67 HB2 ALA 67 4.705 -0.295 2.130 1249 HB3 ALA 67 HB3 ALA 67 2.976 -0.529 2.384 1250 H SER 68 H SER 68 5.847 0.609 0.215 1251 HA SER 68 HA SER 68 7.079 3.004 1.015 1252 HB2 SER 68 HB2 SER 68 8.829 2.234 -0.780 1253 HB3 SER 68 HB3 SER 68 8.593 1.290 0.689 1254 HG SER 68 HG SER 68 7.102 0.716 -1.637 1255 H GLU 69 H GLU 69 5.521 2.084 -1.995 1256 HA GLU 69 HA GLU 69 6.422 4.280 -3.528 1257 HB2 GLU 69 HB2 GLU 69 4.167 2.319 -3.812 1258 HB3 GLU 69 HB3 GLU 69 4.308 3.682 -4.917 1259 HG2 GLU 69 HG2 GLU 69 6.439 2.939 -5.686 1260 HG3 GLU 69 HG3 GLU 69 6.526 1.703 -4.433 1261 H TYR 70 H TYR 70 3.786 3.912 -1.255 1262 HA TYR 70 HA TYR 70 2.729 6.525 -2.045 1263 HB2 TYR 70 HB2 TYR 70 1.595 4.152 -0.795 1264 HB3 TYR 70 HB3 TYR 70 1.164 5.631 0.055 1265 HD1 TYR 70 HD1 TYR 70 -0.066 7.427 -1.128 1266 HD2 TYR 70 HD2 TYR 70 0.699 3.663 -2.959 1267 HE1 TYR 70 HE1 TYR 70 -1.784 7.904 -2.816 1268 HE2 TYR 70 HE2 TYR 70 -1.024 4.132 -4.655 1269 HH TYR 70 HH TYR 70 -2.881 5.497 -5.075 1270 H LEU 71 H LEU 71 4.780 5.135 0.281 1271 HA LEU 71 HA LEU 71 4.308 6.896 2.451 1272 HB2 LEU 71 HB2 LEU 71 6.187 4.810 1.848 1273 HB3 LEU 71 HB3 LEU 71 7.073 6.204 2.411 1274 HG LEU 71 HG LEU 71 6.672 4.772 4.277 1275 HD11 LEU 71 HD11 LEU 71 6.209 7.352 4.422 1276 HD12 LEU 71 HD12 LEU 71 5.911 6.287 5.795 1277 HD13 LEU 71 HD13 LEU 71 4.571 6.811 4.781 1278 HD21 LEU 71 HD21 LEU 71 3.756 4.850 3.520 1279 HD22 LEU 71 HD22 LEU 71 4.395 4.173 5.016 1280 HD23 LEU 71 HD23 LEU 71 4.833 3.455 3.468 1281 H LYS 72 H LYS 72 6.316 7.094 -0.412 1282 HA LYS 72 HA LYS 72 7.664 9.487 0.367 1283 HB2 LYS 72 HB2 LYS 72 8.337 9.607 -2.030 1284 HB3 LYS 72 HB3 LYS 72 8.698 8.063 -1.274 1285 HG2 LYS 72 HG2 LYS 72 7.066 6.944 -2.472 1286 HG3 LYS 72 HG3 LYS 72 6.166 8.421 -2.819 1287 HD2 LYS 72 HD2 LYS 72 8.937 8.008 -3.897 1288 HD3 LYS 72 HD3 LYS 72 7.529 7.334 -4.722 1289 HE2 LYS 72 HE2 LYS 72 6.571 9.516 -4.994 1290 HE3 LYS 72 HE3 LYS 72 7.826 10.240 -3.990 1291 HZ1 LYS 72 HZ1 LYS 72 9.449 9.790 -5.647 1292 HZ2 LYS 72 HZ2 LYS 72 8.147 10.541 -6.416 1293 HZ3 LYS 72 HZ3 LYS 72 8.367 8.871 -6.565 1294 H LEU 73 H LEU 73 4.574 8.784 -0.890 1295 HA LEU 73 HA LEU 73 4.100 11.278 -2.190 1296 HB2 LEU 73 HB2 LEU 73 2.884 9.123 -2.667 1297 HB3 LEU 73 HB3 LEU 73 2.069 9.300 -1.132 1298 HG LEU 73 HG LEU 73 0.817 9.969 -3.272 1299 HD11 LEU 73 HD11 LEU 73 -0.304 11.850 -2.129 1300 HD12 LEU 73 HD12 LEU 73 0.972 11.826 -0.913 1301 HD13 LEU 73 HD13 LEU 73 -0.087 10.428 -1.108 1302 HD21 LEU 73 HD21 LEU 73 2.728 11.333 -4.169 1303 HD22 LEU 73 HD22 LEU 73 2.343 12.539 -2.938 1304 HD23 LEU 73 HD23 LEU 73 1.155 12.129 -4.171 1305 H LYS 74 H LYS 74 3.244 9.905 0.982 1306 HA LYS 74 HA LYS 74 1.883 12.230 1.887 1307 HB2 LYS 74 HB2 LYS 74 1.790 11.227 4.031 1308 HB3 LYS 74 HB3 LYS 74 1.651 9.912 2.876 1309 HG2 LYS 74 HG2 LYS 74 3.622 8.983 3.485 1310 HG3 LYS 74 HG3 LYS 74 4.370 10.538 3.849 1311 HD2 LYS 74 HD2 LYS 74 4.105 9.324 5.905 1312 HD3 LYS 74 HD3 LYS 74 2.961 10.664 5.901 1313 HE2 LYS 74 HE2 LYS 74 1.211 9.057 5.107 1314 HE3 LYS 74 HE3 LYS 74 2.379 7.762 5.349 1315 HZ1 LYS 74 HZ1 LYS 74 2.361 8.073 7.640 1316 HZ2 LYS 74 HZ2 LYS 74 0.734 8.243 7.207 1317 HZ3 LYS 74 HZ3 LYS 74 1.667 9.611 7.537 1318 H GLU 75 H GLU 75 5.209 11.373 1.658 1319 HA GLU 75 HA GLU 75 6.192 13.223 3.591 1320 HB2 GLU 75 HB2 GLU 75 7.485 11.259 2.702 1321 HB3 GLU 75 HB3 GLU 75 7.646 12.119 1.176 1322 HG2 GLU 75 HG2 GLU 75 9.653 12.445 2.389 1323 HG3 GLU 75 HG3 GLU 75 8.767 13.965 2.427 1324 H GLU 76 H GLU 76 5.763 13.284 0.071 1325 HA GLU 76 HA GLU 76 6.743 15.898 -0.326 1326 HB2 GLU 76 HB2 GLU 76 6.551 14.538 -2.259 1327 HB3 GLU 76 HB3 GLU 76 4.879 14.128 -1.906 1328 HG2 GLU 76 HG2 GLU 76 4.072 16.045 -2.811 1329 HG3 GLU 76 HG3 GLU 76 5.505 16.980 -2.388 1330 H TYR 77 H TYR 77 3.556 14.597 0.352 1331 HA TYR 77 HA TYR 77 1.970 16.845 0.098 1332 HB2 TYR 77 HB2 TYR 77 1.082 14.603 0.428 1333 HB3 TYR 77 HB3 TYR 77 1.748 14.546 2.051 1334 HD1 TYR 77 HD1 TYR 77 -0.008 17.509 0.661 1335 HD2 TYR 77 HD2 TYR 77 -0.303 14.074 3.161 1336 HE1 TYR 77 HE1 TYR 77 -2.156 18.335 1.528 1337 HE2 TYR 77 HE2 TYR 77 -2.445 14.895 4.036 1338 HH TYR 77 HH TYR 77 -4.174 16.356 3.601 1339 H GLN 78 H GLN 78 3.955 15.860 2.853 1340 HA GLN 78 HA GLN 78 3.019 18.121 4.401 1341 HB2 GLN 78 HB2 GLN 78 4.344 17.254 6.216 1342 HB3 GLN 78 HB3 GLN 78 3.436 15.938 5.490 1343 HG2 GLN 78 HG2 GLN 78 5.556 15.421 4.174 1344 HG3 GLN 78 HG3 GLN 78 6.369 16.520 5.284 1345 HE21 GLN 78 HE21 GLN 78 4.605 13.520 5.006 1346 HE22 GLN 78 HE22 GLN 78 5.161 12.836 6.495 1347 H ARG 79 H ARG 79 5.975 17.150 2.722 1348 HA ARG 79 HA ARG 79 7.586 19.235 3.740 1349 HB2 ARG 79 HB2 ARG 79 7.857 17.348 1.434 1350 HB3 ARG 79 HB3 ARG 79 9.002 18.667 1.643 1351 HG2 ARG 79 HG2 ARG 79 8.928 17.577 4.148 1352 HG3 ARG 79 HG3 ARG 79 8.731 16.159 3.114 1353 HD2 ARG 79 HD2 ARG 79 10.877 18.212 2.648 1354 HD3 ARG 79 HD3 ARG 79 11.111 16.836 3.724 1355 HE ARG 79 HE ARG 79 10.753 16.731 0.811 1356 HH11 ARG 79 HH11 ARG 79 11.411 15.103 3.835 1357 HH12 ARG 79 HH12 ARG 79 12.020 13.666 3.080 1358 HH21 ARG 79 HH21 ARG 79 11.551 14.834 -0.195 1359 HH22 ARG 79 HH22 ARG 79 12.108 13.515 0.788 1360 H LEU 80 H LEU 80 5.592 19.034 0.806 1361 HA LEU 80 HA LEU 80 6.642 21.487 -0.230 1362 HB2 LEU 80 HB2 LEU 80 5.527 21.003 -2.099 1363 HB3 LEU 80 HB3 LEU 80 5.246 19.445 -1.353 1364 HG LEU 80 HG LEU 80 3.259 21.582 -0.792 1365 HD11 LEU 80 HD11 LEU 80 3.552 21.930 -3.148 1366 HD12 LEU 80 HD12 LEU 80 2.056 21.033 -2.890 1367 HD13 LEU 80 HD13 LEU 80 3.500 20.194 -3.457 1368 HD21 LEU 80 HD21 LEU 80 2.810 18.725 -1.577 1369 HD22 LEU 80 HD22 LEU 80 1.765 19.803 -0.652 1370 HD23 LEU 80 HD23 LEU 80 3.249 19.187 0.068 1371 H ARG 81 H ARG 81 4.035 20.683 1.932 1372 HA ARG 81 HA ARG 81 2.687 23.194 1.651 1373 HB2 ARG 81 HB2 ARG 81 2.492 21.055 3.768 1374 HB3 ARG 81 HB3 ARG 81 1.478 22.490 3.731 1375 HG2 ARG 81 HG2 ARG 81 0.766 21.777 1.413 1376 HG3 ARG 81 HG3 ARG 81 1.573 20.246 1.746 1377 HD2 ARG 81 HD2 ARG 81 -0.797 21.433 3.154 1378 HD3 ARG 81 HD3 ARG 81 -0.710 19.927 2.252 1379 HE ARG 81 HE ARG 81 1.100 19.639 4.289 1380 HH11 ARG 81 HH11 ARG 81 -2.329 20.295 4.071 1381 HH12 ARG 81 HH12 ARG 81 -2.711 19.502 5.564 1382 HH21 ARG 81 HH21 ARG 81 0.608 18.606 6.276 1383 HH22 ARG 81 HH22 ARG 81 -1.040 18.558 6.825 1384 H GLU 82 H GLU 82 4.874 21.815 4.102 1385 HA GLU 82 HA GLU 82 4.940 24.190 5.666 1386 HB2 GLU 82 HB2 GLU 82 6.828 23.175 6.838 1387 HB3 GLU 82 HB3 GLU 82 5.535 22.009 6.622 1388 HG2 GLU 82 HG2 GLU 82 6.709 20.891 4.900 1389 HG3 GLU 82 HG3 GLU 82 7.914 22.171 4.804 1390 H GLN 83 H GLN 83 6.501 23.203 2.782 1391 HA GLN 83 HA GLN 83 8.731 24.995 2.956 1392 HB2 GLN 83 HB2 GLN 83 8.506 22.856 1.553 1393 HB3 GLN 83 HB3 GLN 83 7.583 23.838 0.426 1394 HG2 GLN 83 HG2 GLN 83 9.489 25.314 0.126 1395 HG3 GLN 83 HG3 GLN 83 10.424 24.349 1.271 1396 HE21 GLN 83 HE21 GLN 83 10.924 22.150 0.695 1397 HE22 GLN 83 HE22 GLN 83 11.022 21.698 -0.974 1398 H LEU 84 H LEU 84 5.450 25.399 2.333 1399 HA LEU 84 HA LEU 84 5.905 27.850 0.784 1400 HB2 LEU 84 HB2 LEU 84 4.413 26.131 -0.186 1401 HB3 LEU 84 HB3 LEU 84 3.363 26.284 1.207 1402 HG LEU 84 HG LEU 84 3.857 28.836 -0.162 1403 HD11 LEU 84 HD11 LEU 84 2.354 28.360 -2.045 1404 HD12 LEU 84 HD12 LEU 84 2.392 26.648 -1.631 1405 HD13 LEU 84 HD13 LEU 84 3.870 27.467 -2.149 1406 HD21 LEU 84 HD21 LEU 84 2.177 28.472 1.629 1407 HD22 LEU 84 HD22 LEU 84 1.277 27.432 0.521 1408 HD23 LEU 84 HD23 LEU 84 1.502 29.139 0.144 1409 H LYS 85 H LYS 85 4.623 26.584 3.757 1410 HA LYS 85 HA LYS 85 3.575 29.209 4.509 1411 HB2 LYS 85 HB2 LYS 85 3.340 26.541 5.901 1412 HB3 LYS 85 HB3 LYS 85 2.531 28.025 6.386 1413 HG2 LYS 85 HG2 LYS 85 1.115 28.017 4.530 1414 HG3 LYS 85 HG3 LYS 85 2.133 26.881 3.647 1415 HD2 LYS 85 HD2 LYS 85 0.446 25.485 4.288 1416 HD3 LYS 85 HD3 LYS 85 1.525 25.290 5.666 1417 HE2 LYS 85 HE2 LYS 85 -0.588 27.403 5.703 1418 HE3 LYS 85 HE3 LYS 85 -1.010 25.728 6.046 1419 HZ1 LYS 85 HZ1 LYS 85 -0.546 26.853 8.081 1420 HZ2 LYS 85 HZ2 LYS 85 0.949 27.401 7.515 1421 HZ3 LYS 85 HZ3 LYS 85 0.706 25.750 7.797 1422 H LYS 86 H LYS 86 6.171 27.010 5.259 1423 HA LYS 86 HA LYS 86 7.034 28.788 7.442 1424 HB2 LYS 86 HB2 LYS 86 6.610 26.478 8.156 1425 HB3 LYS 86 HB3 LYS 86 7.717 25.887 6.925 1426 HG2 LYS 86 HG2 LYS 86 9.463 27.367 8.138 1427 HG3 LYS 86 HG3 LYS 86 8.314 27.320 9.478 1428 HD2 LYS 86 HD2 LYS 86 10.018 25.558 9.668 1429 HD3 LYS 86 HD3 LYS 86 8.397 24.887 9.491 1430 HE2 LYS 86 HE2 LYS 86 10.195 23.756 8.137 1431 HE3 LYS 86 HE3 LYS 86 8.790 24.299 7.222 1432 HZ1 LYS 86 HZ1 LYS 86 10.877 24.818 6.104 1433 HZ2 LYS 86 HZ2 LYS 86 11.377 25.754 7.416 1434 HZ3 LYS 86 HZ3 LYS 86 10.034 26.233 6.497 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 38.005 -1.513 -12.648 2 H2 GLY 1 H2 GLY 1 39.273 -1.079 -11.617 3 H3 GLY 1 H3 GLY 1 39.507 -1.078 -13.293 4 HA2 GLY 1 HA3 GLY 1 39.250 1.168 -12.477 5 HA3 GLY 1 HA2 GLY 1 37.937 0.720 -13.557 6 H SER 2 H SER 2 38.700 2.069 -10.619 7 HA SER 2 HA SER 2 36.149 1.357 -9.374 8 HB2 SER 2 HB2 SER 2 38.403 3.002 -8.199 9 HB3 SER 2 HB3 SER 2 37.065 2.239 -7.335 10 HG SER 2 HG SER 2 38.002 0.317 -7.526 11 H HIS 3 H HIS 3 34.908 2.574 -10.917 12 HA HIS 3 HA HIS 3 35.055 5.483 -10.458 13 HB2 HIS 3 HB2 HIS 3 34.294 3.978 -12.963 14 HB3 HIS 3 HB3 HIS 3 33.982 5.695 -12.738 15 HD1 HIS 3 HD1 HIS 3 36.148 7.240 -12.488 16 HD2 HIS 3 HD2 HIS 3 36.830 3.346 -13.783 17 HE1 HIS 3 HE1 HIS 3 38.473 7.238 -13.442 18 HE2 HIS 3 HE2 HIS 3 38.841 4.893 -14.285 19 H MET 4 H MET 4 33.196 6.545 -9.948 20 HA MET 4 HA MET 4 30.877 4.823 -9.421 21 HB2 MET 4 HB2 MET 4 31.854 7.371 -8.160 22 HB3 MET 4 HB3 MET 4 30.179 6.871 -7.987 23 HG2 MET 4 HG2 MET 4 30.972 4.726 -7.035 24 HG3 MET 4 HG3 MET 4 32.618 5.357 -7.101 25 HE1 MET 4 HE1 MET 4 31.768 5.439 -3.269 26 HE2 MET 4 HE2 MET 4 32.905 4.871 -4.492 27 HE3 MET 4 HE3 MET 4 31.261 4.232 -4.451 28 H THR 5 H THR 5 28.814 5.461 -10.015 29 HA THR 5 HA THR 5 28.703 7.546 -12.093 30 HB THR 5 HB THR 5 26.531 6.094 -12.662 31 HG1 THR 5 HG1 THR 5 26.548 4.312 -11.518 32 HG21 THR 5 HG21 THR 5 27.859 4.879 -14.330 33 HG22 THR 5 HG22 THR 5 29.333 5.297 -13.459 34 HG23 THR 5 HG23 THR 5 28.370 6.564 -14.216 35 H GLU 6 H GLU 6 25.925 7.632 -12.306 36 HA GLU 6 HA GLU 6 25.211 9.281 -10.093 37 HB2 GLU 6 HB2 GLU 6 23.426 8.149 -12.264 38 HB3 GLU 6 HB3 GLU 6 23.076 9.529 -11.232 39 HG2 GLU 6 HG2 GLU 6 24.565 10.904 -12.337 40 HG3 GLU 6 HG3 GLU 6 25.486 9.551 -12.991 41 H GLN 7 H GLN 7 23.427 8.874 -8.622 42 HA GLN 7 HA GLN 7 23.193 6.018 -8.013 43 HB2 GLN 7 HB2 GLN 7 24.065 7.556 -6.247 44 HB3 GLN 7 HB3 GLN 7 22.499 8.356 -6.235 45 HG2 GLN 7 HG2 GLN 7 21.425 6.533 -5.291 46 HG3 GLN 7 HG3 GLN 7 22.684 5.406 -5.791 47 HE21 GLN 7 HE21 GLN 7 21.644 7.643 -3.382 48 HE22 GLN 7 HE22 GLN 7 22.919 7.342 -2.252 49 HA PRO 8 HA PRO 8 18.950 6.624 -9.375 50 HB2 PRO 8 HB2 PRO 8 18.640 4.244 -10.527 51 HB3 PRO 8 HB3 PRO 8 19.664 5.476 -11.274 52 HG2 PRO 8 HG2 PRO 8 20.437 3.032 -9.760 53 HG3 PRO 8 HG3 PRO 8 21.244 3.806 -11.134 54 HD2 PRO 8 HD2 PRO 8 21.902 4.091 -8.399 55 HD3 PRO 8 HD3 PRO 8 22.538 5.048 -9.751 56 H LYS 9 H LYS 9 17.022 4.870 -9.190 57 HA LYS 9 HA LYS 9 16.698 4.401 -6.410 58 HB2 LYS 9 HB2 LYS 9 15.045 3.733 -8.826 59 HB3 LYS 9 HB3 LYS 9 14.586 3.174 -7.223 60 HG2 LYS 9 HG2 LYS 9 14.766 5.632 -6.524 61 HG3 LYS 9 HG3 LYS 9 14.756 5.982 -8.249 62 HD2 LYS 9 HD2 LYS 9 12.613 4.732 -8.436 63 HD3 LYS 9 HD3 LYS 9 12.613 4.549 -6.682 64 HE2 LYS 9 HE2 LYS 9 12.525 7.136 -8.224 65 HE3 LYS 9 HE3 LYS 9 11.203 6.406 -7.316 66 HZ1 LYS 9 HZ1 LYS 9 12.631 6.627 -5.301 67 HZ2 LYS 9 HZ2 LYS 9 12.137 8.097 -5.978 68 HZ3 LYS 9 HZ3 LYS 9 13.714 7.547 -6.230 69 H THR 10 H THR 10 18.272 3.011 -5.727 70 HA THR 10 HA THR 10 18.614 0.423 -6.925 71 HB THR 10 HB THR 10 20.478 1.761 -5.863 72 HG1 THR 10 HG1 THR 10 21.398 -0.173 -4.872 73 HG21 THR 10 HG21 THR 10 20.772 1.514 -3.417 74 HG22 THR 10 HG22 THR 10 19.148 0.836 -3.311 75 HG23 THR 10 HG23 THR 10 19.375 2.504 -3.838 76 H ARG 11 H ARG 11 18.872 -1.336 -4.904 77 HA ARG 11 HA ARG 11 16.178 -1.407 -3.739 78 HB2 ARG 11 HB2 ARG 11 16.174 -3.816 -3.988 79 HB3 ARG 11 HB3 ARG 11 16.461 -3.053 -5.543 80 HG2 ARG 11 HG2 ARG 11 18.909 -3.469 -5.186 81 HG3 ARG 11 HG3 ARG 11 18.461 -4.439 -3.783 82 HD2 ARG 11 HD2 ARG 11 17.034 -5.825 -5.269 83 HD3 ARG 11 HD3 ARG 11 17.654 -4.913 -6.646 84 HE ARG 11 HE ARG 11 19.795 -5.949 -5.121 85 HH11 ARG 11 HH11 ARG 11 17.335 -6.913 -7.418 86 HH12 ARG 11 HH12 ARG 11 18.220 -8.300 -7.969 87 HH21 ARG 11 HH21 ARG 11 20.967 -7.751 -5.870 88 HH22 ARG 11 HH22 ARG 11 20.286 -8.775 -7.096 89 H VAL 12 H VAL 12 15.889 -2.320 -1.722 90 HA VAL 12 HA VAL 12 18.344 -2.602 -0.113 91 HB VAL 12 HB VAL 12 17.232 -0.437 0.333 92 HG11 VAL 12 HG11 VAL 12 14.968 -0.713 -0.048 93 HG12 VAL 12 HG12 VAL 12 15.047 -0.651 1.712 94 HG13 VAL 12 HG13 VAL 12 14.886 -2.203 0.893 95 HG21 VAL 12 HG21 VAL 12 17.118 -2.416 2.609 96 HG22 VAL 12 HG22 VAL 12 17.089 -0.662 2.792 97 HG23 VAL 12 HG23 VAL 12 18.511 -1.455 2.113 98 H SER 13 H SER 13 18.303 -4.129 1.537 99 HA SER 13 HA SER 13 16.204 -6.137 1.291 100 HB2 SER 13 HB2 SER 13 18.865 -6.352 2.713 101 HB3 SER 13 HB3 SER 13 17.764 -7.674 2.327 102 HG SER 13 HG SER 13 19.003 -7.795 0.613 103 H VAL 14 H VAL 14 14.760 -6.499 2.869 104 HA VAL 14 HA VAL 14 15.282 -5.487 5.574 105 HB VAL 14 HB VAL 14 12.845 -4.725 5.641 106 HG11 VAL 14 HG11 VAL 14 14.762 -3.183 5.666 107 HG12 VAL 14 HG12 VAL 14 13.376 -2.507 4.811 108 HG13 VAL 14 HG13 VAL 14 14.743 -3.154 3.903 109 HG21 VAL 14 HG21 VAL 14 11.896 -3.990 3.485 110 HG22 VAL 14 HG22 VAL 14 12.081 -5.741 3.576 111 HG23 VAL 14 HG23 VAL 14 13.233 -4.780 2.650 112 H ARG 15 H ARG 15 13.571 -6.340 7.131 113 HA ARG 15 HA ARG 15 12.910 -9.098 6.353 114 HB2 ARG 15 HB2 ARG 15 14.487 -8.920 8.210 115 HB3 ARG 15 HB3 ARG 15 13.351 -7.912 9.094 116 HG2 ARG 15 HG2 ARG 15 11.929 -10.220 8.459 117 HG3 ARG 15 HG3 ARG 15 13.528 -10.778 8.949 118 HD2 ARG 15 HD2 ARG 15 12.285 -10.702 10.934 119 HD3 ARG 15 HD3 ARG 15 13.268 -9.239 10.962 120 HE ARG 15 HE ARG 15 10.659 -8.825 9.830 121 HH11 ARG 15 HH11 ARG 15 12.506 -8.957 12.788 122 HH12 ARG 15 HH12 ARG 15 11.364 -8.027 13.699 123 HH21 ARG 15 HH21 ARG 15 9.129 -7.617 11.015 124 HH22 ARG 15 HH22 ARG 15 9.429 -7.276 12.698 125 H ILE 16 H ILE 16 10.824 -9.618 6.127 126 HA ILE 16 HA ILE 16 8.808 -8.086 7.628 127 HB ILE 16 HB ILE 16 8.329 -9.015 4.800 128 HG12 ILE 16 HG12 ILE 16 8.999 -6.178 5.594 129 HG13 ILE 16 HG13 ILE 16 10.204 -7.295 4.966 130 HG21 ILE 16 HG21 ILE 16 6.416 -7.553 4.900 131 HG22 ILE 16 HG22 ILE 16 6.917 -6.945 6.479 132 HG23 ILE 16 HG23 ILE 16 6.399 -8.621 6.304 133 HD11 ILE 16 HD11 ILE 16 7.762 -6.267 3.546 134 HD12 ILE 16 HD12 ILE 16 8.821 -7.530 2.915 135 HD13 ILE 16 HD13 ILE 16 9.450 -5.905 3.189 136 H TYR 17 H TYR 17 7.609 -9.370 8.821 137 HA TYR 17 HA TYR 17 6.469 -11.154 9.629 138 HB2 TYR 17 HB2 TYR 17 5.655 -10.993 7.083 139 HB3 TYR 17 HB3 TYR 17 6.409 -12.581 7.018 140 HD1 TYR 17 HD1 TYR 17 4.228 -10.774 9.480 141 HD2 TYR 17 HD2 TYR 17 4.882 -14.293 7.177 142 HE1 TYR 17 HE1 TYR 17 2.193 -11.772 10.433 143 HE2 TYR 17 HE2 TYR 17 2.848 -15.298 8.126 144 HH TYR 17 HH TYR 17 0.591 -13.470 10.016 145 H GLY 18 H GLY 18 9.449 -11.196 9.315 146 HA2 GLY 18 HA2 GLY 18 10.875 -12.741 10.417 147 HA3 GLY 18 HA3 GLY 18 9.763 -14.030 9.990 148 H GLN 19 H GLN 19 9.820 -12.695 7.157 149 HA GLN 19 HA GLN 19 12.199 -14.195 6.295 150 HB2 GLN 19 HB2 GLN 19 9.560 -14.250 5.391 151 HB3 GLN 19 HB3 GLN 19 10.412 -13.320 4.167 152 HG2 GLN 19 HG2 GLN 19 10.700 -16.175 4.926 153 HG3 GLN 19 HG3 GLN 19 10.633 -15.428 3.331 154 HE21 GLN 19 HE21 GLN 19 12.531 -14.403 2.522 155 HE22 GLN 19 HE22 GLN 19 14.097 -14.836 3.118 156 H ASP 20 H ASP 20 13.648 -13.277 4.787 157 HA ASP 20 HA ASP 20 13.725 -10.366 4.896 158 HB2 ASP 20 HB2 ASP 20 16.030 -10.525 4.241 159 HB3 ASP 20 HB3 ASP 20 15.751 -11.716 5.502 160 H TYR 21 H TYR 21 13.550 -9.063 3.148 161 HA TYR 21 HA TYR 21 13.260 -10.318 0.507 162 HB2 TYR 21 HB2 TYR 21 11.375 -8.257 1.676 163 HB3 TYR 21 HB3 TYR 21 11.326 -8.854 0.024 164 HD1 TYR 21 HD1 TYR 21 10.885 -11.357 -0.314 165 HD2 TYR 21 HD2 TYR 21 10.208 -9.354 3.376 166 HE1 TYR 21 HE1 TYR 21 9.396 -13.178 0.393 167 HE2 TYR 21 HE2 TYR 21 8.717 -11.172 4.097 168 HH TYR 21 HH TYR 21 7.386 -12.939 3.165 169 H THR 22 H THR 22 13.320 -8.664 -1.245 170 HA THR 22 HA THR 22 14.889 -6.296 -0.518 171 HB THR 22 HB THR 22 15.579 -7.927 -2.952 172 HG1 THR 22 HG1 THR 22 16.305 -8.359 -0.265 173 HG21 THR 22 HG21 THR 22 16.395 -5.609 -2.809 174 HG22 THR 22 HG22 THR 22 17.722 -6.773 -2.757 175 HG23 THR 22 HG23 THR 22 17.175 -5.987 -1.274 176 H ILE 23 H ILE 23 14.029 -4.512 -1.390 177 HA ILE 23 HA ILE 23 12.567 -4.720 -3.919 178 HB ILE 23 HB ILE 23 10.723 -3.361 -3.168 179 HG12 ILE 23 HG12 ILE 23 12.130 -2.201 -1.346 180 HG13 ILE 23 HG13 ILE 23 10.424 -2.466 -1.030 181 HG21 ILE 23 HG21 ILE 23 10.238 -5.636 -3.022 182 HG22 ILE 23 HG22 ILE 23 9.684 -4.962 -1.491 183 HG23 ILE 23 HG23 ILE 23 11.207 -5.846 -1.567 184 HD11 ILE 23 HD11 ILE 23 12.372 -4.490 -0.047 185 HD12 ILE 23 HD12 ILE 23 10.836 -3.974 0.637 186 HD13 ILE 23 HD13 ILE 23 12.255 -2.943 0.786 187 H VAL 24 H VAL 24 12.061 -2.520 -4.812 188 HA VAL 24 HA VAL 24 14.443 -0.938 -4.774 189 HB VAL 24 HB VAL 24 11.808 -0.437 -6.170 190 HG11 VAL 24 HG11 VAL 24 14.500 0.850 -6.621 191 HG12 VAL 24 HG12 VAL 24 13.100 1.624 -5.879 192 HG13 VAL 24 HG13 VAL 24 13.043 1.134 -7.572 193 HG21 VAL 24 HG21 VAL 24 12.939 -1.275 -8.168 194 HG22 VAL 24 HG22 VAL 24 12.888 -2.502 -6.903 195 HG23 VAL 24 HG23 VAL 24 14.381 -1.616 -7.214 196 H GLY 25 H GLY 25 14.862 0.649 -3.365 197 HA2 GLY 25 HA2 GLY 25 12.862 2.556 -2.615 198 HA3 GLY 25 HA3 GLY 25 13.257 1.458 -1.300 199 H ALA 26 H ALA 26 14.419 4.018 -3.355 200 HA ALA 26 HA ALA 26 16.773 4.291 -1.592 201 HB1 ALA 26 HB1 ALA 26 17.269 3.874 -3.993 202 HB2 ALA 26 HB2 ALA 26 17.924 5.388 -3.377 203 HB3 ALA 26 HB3 ALA 26 16.470 5.399 -4.376 204 H GLU 27 H GLU 27 13.845 5.310 -1.705 205 HA GLU 27 HA GLU 27 13.769 8.070 -2.004 206 HB2 GLU 27 HB2 GLU 27 12.151 6.668 0.118 207 HB3 GLU 27 HB3 GLU 27 11.691 8.033 -0.883 208 HG2 GLU 27 HG2 GLU 27 11.768 5.121 -1.591 209 HG3 GLU 27 HG3 GLU 27 10.437 6.261 -1.712 210 H SER 28 H SER 28 14.115 6.223 1.011 211 HA SER 28 HA SER 28 16.013 8.107 2.047 212 HB2 SER 28 HB2 SER 28 14.253 9.421 2.805 213 HB3 SER 28 HB3 SER 28 13.180 8.039 3.021 214 HG SER 28 HG SER 28 14.969 9.175 4.770 215 HA PRO 29 HA PRO 29 17.301 4.153 3.635 216 HB2 PRO 29 HB2 PRO 29 19.209 5.157 5.354 217 HB3 PRO 29 HB3 PRO 29 19.467 4.842 3.638 218 HG2 PRO 29 HG2 PRO 29 18.857 7.418 5.019 219 HG3 PRO 29 HG3 PRO 29 19.958 7.100 3.667 220 HD2 PRO 29 HD2 PRO 29 17.536 8.208 3.291 221 HD3 PRO 29 HD3 PRO 29 18.245 7.088 2.110 222 H ALA 30 H ALA 30 16.168 6.811 5.527 223 HA ALA 30 HA ALA 30 15.954 5.229 7.952 224 HB1 ALA 30 HB1 ALA 30 15.016 7.307 8.920 225 HB2 ALA 30 HB2 ALA 30 15.178 8.078 7.344 226 HB3 ALA 30 HB3 ALA 30 16.614 7.532 8.213 227 H HIS 31 H HIS 31 13.860 6.733 5.530 228 HA HIS 31 HA HIS 31 11.414 6.003 6.752 229 HB2 HIS 31 HB2 HIS 31 11.933 7.710 4.811 230 HB3 HIS 31 HB3 HIS 31 11.613 6.318 3.782 231 HD1 HIS 31 HD1 HIS 31 9.798 8.839 3.784 232 HD2 HIS 31 HD2 HIS 31 9.063 5.403 5.996 233 HE1 HIS 31 HE1 HIS 31 7.324 8.832 4.217 234 HE2 HIS 31 HE2 HIS 31 6.961 6.895 5.778 235 H ILE 32 H ILE 32 13.397 4.435 4.245 236 HA ILE 32 HA ILE 32 11.598 2.378 3.616 237 HB ILE 32 HB ILE 32 13.494 1.126 2.714 238 HG12 ILE 32 HG12 ILE 32 15.225 3.316 3.908 239 HG13 ILE 32 HG13 ILE 32 15.142 1.659 4.494 240 HG21 ILE 32 HG21 ILE 32 13.752 4.051 2.048 241 HG22 ILE 32 HG22 ILE 32 12.436 3.021 1.490 242 HG23 ILE 32 HG23 ILE 32 14.093 2.675 0.999 243 HD11 ILE 32 HD11 ILE 32 17.087 1.753 3.220 244 HD12 ILE 32 HD12 ILE 32 16.320 2.690 1.940 245 HD13 ILE 32 HD13 ILE 32 15.910 0.991 2.155 246 H ARG 33 H ARG 33 13.537 2.805 6.420 247 HA ARG 33 HA ARG 33 13.706 0.051 7.146 248 HB2 ARG 33 HB2 ARG 33 14.505 2.593 8.331 249 HB3 ARG 33 HB3 ARG 33 13.856 1.475 9.524 250 HG2 ARG 33 HG2 ARG 33 16.241 1.219 9.379 251 HG3 ARG 33 HG3 ARG 33 15.451 -0.233 8.764 252 HD2 ARG 33 HD2 ARG 33 15.770 0.583 6.470 253 HD3 ARG 33 HD3 ARG 33 16.595 2.008 7.101 254 HE ARG 33 HE ARG 33 17.596 -0.757 7.337 255 HH11 ARG 33 HH11 ARG 33 18.158 2.698 7.074 256 HH12 ARG 33 HH12 ARG 33 19.888 2.535 7.062 257 HH21 ARG 33 HH21 ARG 33 19.868 -0.955 7.326 258 HH22 ARG 33 HH22 ARG 33 20.856 0.468 7.212 259 H LEU 34 H LEU 34 11.470 2.683 7.942 260 HA LEU 34 HA LEU 34 9.941 0.969 9.689 261 HB2 LEU 34 HB2 LEU 34 8.480 2.857 10.030 262 HB3 LEU 34 HB3 LEU 34 10.150 3.359 10.184 263 HG LEU 34 HG LEU 34 9.621 3.906 7.545 264 HD11 LEU 34 HD11 LEU 34 7.247 3.406 7.848 265 HD12 LEU 34 HD12 LEU 34 7.506 5.117 7.502 266 HD13 LEU 34 HD13 LEU 34 7.163 4.593 9.152 267 HD21 LEU 34 HD21 LEU 34 10.828 5.341 9.071 268 HD22 LEU 34 HD22 LEU 34 9.344 5.694 9.958 269 HD23 LEU 34 HD23 LEU 34 9.531 6.252 8.295 270 H VAL 35 H VAL 35 10.053 1.599 6.357 271 HA VAL 35 HA VAL 35 7.363 1.270 5.611 272 HB VAL 35 HB VAL 35 9.910 0.574 4.128 273 HG11 VAL 35 HG11 VAL 35 7.050 0.429 3.196 274 HG12 VAL 35 HG12 VAL 35 8.267 -0.846 3.176 275 HG13 VAL 35 HG13 VAL 35 8.421 0.536 2.092 276 HG21 VAL 35 HG21 VAL 35 7.972 2.788 3.526 277 HG22 VAL 35 HG22 VAL 35 9.636 2.602 2.980 278 HG23 VAL 35 HG23 VAL 35 9.300 2.991 4.667 279 H ALA 36 H ALA 36 9.968 -1.084 6.041 280 HA ALA 36 HA ALA 36 8.451 -3.376 5.390 281 HB1 ALA 36 HB1 ALA 36 10.277 -4.638 6.287 282 HB2 ALA 36 HB2 ALA 36 10.851 -3.249 7.206 283 HB3 ALA 36 HB3 ALA 36 10.944 -3.239 5.446 284 H ALA 37 H ALA 37 9.183 -1.759 8.438 285 HA ALA 37 HA ALA 37 7.973 -3.637 10.153 286 HB1 ALA 37 HB1 ALA 37 8.293 -0.684 10.655 287 HB2 ALA 37 HB2 ALA 37 9.586 -1.868 10.843 288 HB3 ALA 37 HB3 ALA 37 8.147 -1.966 11.858 289 H PHE 38 H PHE 38 6.706 -0.968 8.294 290 HA PHE 38 HA PHE 38 4.219 -0.700 9.599 291 HB2 PHE 38 HB2 PHE 38 5.132 0.987 8.038 292 HB3 PHE 38 HB3 PHE 38 4.917 -0.143 6.706 293 HD1 PHE 38 HD2 PHE 38 2.975 1.508 9.422 294 HD2 PHE 38 HD1 PHE 38 2.991 -0.031 5.454 295 HE1 PHE 38 HE2 PHE 38 0.688 2.344 9.094 296 HE2 PHE 38 HE1 PHE 38 0.701 0.805 5.116 297 HZ PHE 38 HZ PHE 38 -0.455 1.991 6.941 298 H VAL 39 H VAL 39 5.179 -2.536 6.705 299 HA VAL 39 HA VAL 39 2.624 -3.722 6.320 300 HB VAL 39 HB VAL 39 5.301 -4.761 5.364 301 HG11 VAL 39 HG11 VAL 39 3.513 -6.408 5.188 302 HG12 VAL 39 HG12 VAL 39 3.995 -5.838 3.593 303 HG13 VAL 39 HG13 VAL 39 2.504 -5.246 4.326 304 HG21 VAL 39 HG21 VAL 39 3.990 -2.349 4.711 305 HG22 VAL 39 HG22 VAL 39 3.801 -3.431 3.331 306 HG23 VAL 39 HG23 VAL 39 5.412 -3.059 3.948 307 H ASP 40 H ASP 40 5.516 -4.633 8.074 308 HA ASP 40 HA ASP 40 4.844 -7.292 8.678 309 HB2 ASP 40 HB2 ASP 40 7.039 -5.848 9.137 310 HB3 ASP 40 HB3 ASP 40 6.288 -5.643 10.715 311 H ASP 41 H ASP 41 4.275 -4.288 10.494 312 HA ASP 41 HA ASP 41 2.866 -5.478 12.629 313 HB2 ASP 41 HB2 ASP 41 3.775 -3.279 12.929 314 HB3 ASP 41 HB3 ASP 41 2.865 -2.651 11.557 315 H LYS 42 H LYS 42 1.771 -3.975 9.606 316 HA LYS 42 HA LYS 42 -0.981 -4.068 10.084 317 HB2 LYS 42 HB2 LYS 42 0.007 -2.824 8.219 318 HB3 LYS 42 HB3 LYS 42 0.486 -4.330 7.451 319 HG2 LYS 42 HG2 LYS 42 -1.458 -3.584 6.333 320 HG3 LYS 42 HG3 LYS 42 -1.951 -4.937 7.352 321 HD2 LYS 42 HD2 LYS 42 -2.165 -2.395 8.732 322 HD3 LYS 42 HD3 LYS 42 -3.132 -2.435 7.253 323 HE2 LYS 42 HE2 LYS 42 -4.344 -4.332 7.981 324 HE3 LYS 42 HE3 LYS 42 -3.212 -4.647 9.294 325 HZ1 LYS 42 HZ1 LYS 42 -4.761 -2.142 9.206 326 HZ2 LYS 42 HZ2 LYS 42 -4.041 -2.899 10.541 327 HZ3 LYS 42 HZ3 LYS 42 -5.435 -3.557 9.840 328 H MET 43 H MET 43 1.008 -6.426 8.265 329 HA MET 43 HA MET 43 -1.029 -8.328 7.964 330 HB2 MET 43 HB2 MET 43 1.202 -8.206 6.747 331 HB3 MET 43 HB3 MET 43 1.922 -8.933 8.176 332 HG2 MET 43 HG2 MET 43 0.629 -10.922 7.895 333 HG3 MET 43 HG3 MET 43 -0.305 -10.188 6.592 334 HE1 MET 43 HE1 MET 43 2.264 -8.690 4.940 335 HE2 MET 43 HE2 MET 43 0.722 -9.353 4.405 336 HE3 MET 43 HE3 MET 43 2.225 -9.936 3.692 337 H HIS 44 H HIS 44 1.302 -7.740 10.529 338 HA HIS 44 HA HIS 44 0.986 -10.104 11.995 339 HB2 HIS 44 HB2 HIS 44 2.780 -8.503 12.447 340 HB3 HIS 44 HB3 HIS 44 1.605 -7.310 12.982 341 HD1 HIS 44 HD1 HIS 44 1.288 -7.204 15.432 342 HD2 HIS 44 HD2 HIS 44 2.681 -10.930 14.205 343 HE1 HIS 44 HE1 HIS 44 1.637 -8.528 17.540 344 HE2 HIS 44 HE2 HIS 44 2.299 -10.830 16.758 345 H GLU 45 H GLU 45 -0.655 -6.955 12.452 346 HA GLU 45 HA GLU 45 -2.377 -7.980 14.479 347 HB2 GLU 45 HB2 GLU 45 -3.461 -5.863 14.458 348 HB3 GLU 45 HB3 GLU 45 -1.746 -5.564 14.216 349 HG2 GLU 45 HG2 GLU 45 -2.037 -4.956 11.989 350 HG3 GLU 45 HG3 GLU 45 -3.590 -5.783 11.867 351 H PHE 46 H PHE 46 -2.440 -8.079 11.060 352 HA PHE 46 HA PHE 46 -5.288 -8.451 10.873 353 HB2 PHE 46 HB2 PHE 46 -3.733 -7.444 9.073 354 HB3 PHE 46 HB3 PHE 46 -3.312 -9.112 8.701 355 HD1 PHE 46 HD1 PHE 46 -6.540 -7.406 9.502 356 HD2 PHE 46 HD2 PHE 46 -4.305 -9.762 6.749 357 HE1 PHE 46 HE1 PHE 46 -8.529 -7.612 8.078 358 HE2 PHE 46 HE2 PHE 46 -6.296 -9.974 5.324 359 HZ PHE 46 HZ PHE 46 -8.411 -8.898 5.984 360 H SER 47 H SER 47 -2.501 -10.409 11.349 361 HA SER 47 HA SER 47 -3.471 -12.901 10.470 362 HB2 SER 47 HB2 SER 47 -1.512 -12.358 12.717 363 HB3 SER 47 HB3 SER 47 -1.712 -13.883 11.860 364 HG SER 47 HG SER 47 -1.092 -11.513 10.456 365 H GLU 48 H GLU 48 -4.307 -10.986 13.165 366 HA GLU 48 HA GLU 48 -5.256 -13.117 14.845 367 HB2 GLU 48 HB2 GLU 48 -4.493 -11.056 15.866 368 HB3 GLU 48 HB3 GLU 48 -5.667 -10.123 14.946 369 HG2 GLU 48 HG2 GLU 48 -7.462 -11.424 16.120 370 HG3 GLU 48 HG3 GLU 48 -6.198 -12.079 17.157 371 H LYS 49 H LYS 49 -6.530 -11.183 12.284 372 HA LYS 49 HA LYS 49 -9.297 -11.593 12.931 373 HB2 LYS 49 HB2 LYS 49 -8.063 -10.694 10.328 374 HB3 LYS 49 HB3 LYS 49 -9.755 -10.554 10.776 375 HG2 LYS 49 HG2 LYS 49 -7.435 -9.130 12.062 376 HG3 LYS 49 HG3 LYS 49 -8.654 -8.422 11.004 377 HD2 LYS 49 HD2 LYS 49 -10.362 -9.210 12.735 378 HD3 LYS 49 HD3 LYS 49 -8.984 -9.462 13.805 379 HE2 LYS 49 HE2 LYS 49 -9.652 -7.319 14.357 380 HE3 LYS 49 HE3 LYS 49 -8.369 -7.025 13.183 381 HZ1 LYS 49 HZ1 LYS 49 -11.291 -6.947 12.682 382 HZ2 LYS 49 HZ2 LYS 49 -10.124 -6.832 11.470 383 HZ3 LYS 49 HZ3 LYS 49 -10.221 -5.635 12.660 384 H GLN 50 H GLN 50 -7.040 -12.951 10.581 385 HA GLN 50 HA GLN 50 -7.129 -14.743 9.188 386 HB2 GLN 50 HB2 GLN 50 -8.479 -15.714 11.684 387 HB3 GLN 50 HB3 GLN 50 -8.270 -16.780 10.302 388 HG2 GLN 50 HG2 GLN 50 -5.996 -16.845 10.516 389 HG3 GLN 50 HG3 GLN 50 -5.919 -15.292 11.347 390 HE21 GLN 50 HE21 GLN 50 -4.783 -15.929 13.088 391 HE22 GLN 50 HE22 GLN 50 -5.360 -17.060 14.265 392 HA PRO 51 HA PRO 51 -11.507 -13.757 7.833 393 HB2 PRO 51 HB2 PRO 51 -10.802 -12.772 5.376 394 HB3 PRO 51 HB3 PRO 51 -11.012 -11.777 6.820 395 HG2 PRO 51 HG2 PRO 51 -8.507 -12.758 5.543 396 HG3 PRO 51 HG3 PRO 51 -8.830 -11.219 6.357 397 HD2 PRO 51 HD2 PRO 51 -7.462 -13.281 7.515 398 HD3 PRO 51 HD3 PRO 51 -8.385 -12.075 8.431 399 H MET 52 H MET 52 -8.842 -14.902 5.760 400 HA MET 52 HA MET 52 -10.672 -16.915 4.660 401 HB2 MET 52 HB2 MET 52 -8.037 -15.908 3.585 402 HB3 MET 52 HB3 MET 52 -9.035 -17.137 2.823 403 HG2 MET 52 HG2 MET 52 -10.006 -14.349 3.370 404 HG3 MET 52 HG3 MET 52 -9.203 -14.816 1.873 405 HE1 MET 52 HE1 MET 52 -11.675 -17.054 0.062 406 HE2 MET 52 HE2 MET 52 -10.290 -17.593 1.013 407 HE3 MET 52 HE3 MET 52 -10.167 -16.139 0.023 408 H LEU 53 H LEU 53 -8.296 -16.578 6.933 409 HA LEU 53 HA LEU 53 -6.897 -17.941 8.070 410 HB2 LEU 53 HB2 LEU 53 -8.919 -19.977 7.139 411 HB3 LEU 53 HB3 LEU 53 -7.700 -20.283 8.364 412 HG LEU 53 HG LEU 53 -9.238 -17.910 8.993 413 HD11 LEU 53 HD11 LEU 53 -11.016 -18.993 7.772 414 HD12 LEU 53 HD12 LEU 53 -11.340 -19.056 9.505 415 HD13 LEU 53 HD13 LEU 53 -10.749 -20.490 8.667 416 HD21 LEU 53 HD21 LEU 53 -8.871 -20.548 10.411 417 HD22 LEU 53 HD22 LEU 53 -9.500 -19.061 11.125 418 HD23 LEU 53 HD23 LEU 53 -7.826 -19.134 10.573 419 H ASP 54 H ASP 54 -5.604 -17.327 5.966 420 HA ASP 54 HA ASP 54 -4.034 -19.623 5.320 421 HB2 ASP 54 HB2 ASP 54 -5.867 -19.878 3.689 422 HB3 ASP 54 HB3 ASP 54 -5.555 -18.254 3.089 423 H VAL 55 H VAL 55 -1.985 -19.018 4.559 424 HA VAL 55 HA VAL 55 -1.160 -16.419 5.300 425 HB VAL 55 HB VAL 55 0.565 -18.186 3.599 426 HG11 VAL 55 HG11 VAL 55 1.412 -15.979 4.173 427 HG12 VAL 55 HG12 VAL 55 2.343 -17.240 4.986 428 HG13 VAL 55 HG13 VAL 55 1.141 -16.311 5.885 429 HG21 VAL 55 HG21 VAL 55 0.010 -18.527 6.543 430 HG22 VAL 55 HG22 VAL 55 1.261 -19.369 5.630 431 HG23 VAL 55 HG23 VAL 55 -0.439 -19.654 5.264 432 HA PRO 56 HA PRO 56 -0.392 -15.566 0.530 433 HB2 PRO 56 HB2 PRO 56 -2.521 -17.306 -0.594 434 HB3 PRO 56 HB3 PRO 56 -0.924 -16.923 -1.243 435 HG2 PRO 56 HG2 PRO 56 -1.410 -19.303 -0.165 436 HG3 PRO 56 HG3 PRO 56 0.140 -18.483 0.098 437 HD2 PRO 56 HD2 PRO 56 -2.196 -18.757 1.940 438 HD3 PRO 56 HD3 PRO 56 -0.462 -18.827 2.298 439 H LYS 57 H LYS 57 -3.596 -16.472 1.708 440 HA LYS 57 HA LYS 57 -4.994 -14.411 0.331 441 HB2 LYS 57 HB2 LYS 57 -5.918 -15.763 2.858 442 HB3 LYS 57 HB3 LYS 57 -6.905 -15.062 1.585 443 HG2 LYS 57 HG2 LYS 57 -5.136 -17.460 1.181 444 HG3 LYS 57 HG3 LYS 57 -6.833 -17.563 1.647 445 HD2 LYS 57 HD2 LYS 57 -7.566 -17.015 -0.423 446 HD3 LYS 57 HD3 LYS 57 -6.241 -15.887 -0.706 447 HE2 LYS 57 HE2 LYS 57 -6.226 -17.899 -2.176 448 HE3 LYS 57 HE3 LYS 57 -4.749 -17.666 -1.249 449 HZ1 LYS 57 HZ1 LYS 57 -6.902 -19.434 -0.275 450 HZ2 LYS 57 HZ2 LYS 57 -5.267 -19.416 0.174 451 HZ3 LYS 57 HZ3 LYS 57 -5.727 -19.994 -1.354 452 H LEU 58 H LEU 58 -3.507 -14.694 3.500 453 HA LEU 58 HA LEU 58 -4.570 -12.311 4.596 454 HB2 LEU 58 HB2 LEU 58 -3.431 -14.253 5.807 455 HB3 LEU 58 HB3 LEU 58 -1.913 -13.536 5.309 456 HG LEU 58 HG LEU 58 -2.874 -11.391 6.499 457 HD11 LEU 58 HD11 LEU 58 -5.090 -12.431 6.879 458 HD12 LEU 58 HD12 LEU 58 -4.310 -11.864 8.353 459 HD13 LEU 58 HD13 LEU 58 -4.320 -13.587 7.967 460 HD21 LEU 58 HD21 LEU 58 -1.743 -12.043 8.519 461 HD22 LEU 58 HD22 LEU 58 -0.858 -12.671 7.129 462 HD23 LEU 58 HD23 LEU 58 -1.874 -13.749 8.086 463 H ALA 59 H ALA 59 -1.649 -13.068 2.798 464 HA ALA 59 HA ALA 59 -0.394 -10.561 3.055 465 HB1 ALA 59 HB1 ALA 59 -0.071 -12.612 0.872 466 HB2 ALA 59 HB2 ALA 59 0.810 -12.578 2.399 467 HB3 ALA 59 HB3 ALA 59 1.036 -11.284 1.221 468 H VAL 60 H VAL 60 -2.347 -11.892 0.360 469 HA VAL 60 HA VAL 60 -2.194 -9.547 -1.211 470 HB VAL 60 HB VAL 60 -4.083 -10.359 -2.516 471 HG11 VAL 60 HG11 VAL 60 -2.223 -12.623 -1.825 472 HG12 VAL 60 HG12 VAL 60 -1.884 -11.312 -2.955 473 HG13 VAL 60 HG13 VAL 60 -3.177 -12.456 -3.296 474 HG21 VAL 60 HG21 VAL 60 -5.017 -12.666 -1.857 475 HG22 VAL 60 HG22 VAL 60 -5.651 -11.227 -1.063 476 HG23 VAL 60 HG23 VAL 60 -4.479 -12.243 -0.233 477 H LEU 61 H LEU 61 -4.400 -10.510 1.338 478 HA LEU 61 HA LEU 61 -6.241 -8.392 0.845 479 HB2 LEU 61 HB2 LEU 61 -6.646 -10.652 2.017 480 HB3 LEU 61 HB3 LEU 61 -5.987 -9.872 3.437 481 HG LEU 61 HG LEU 61 -7.793 -8.290 3.499 482 HD11 LEU 61 HD11 LEU 61 -8.320 -7.703 1.323 483 HD12 LEU 61 HD12 LEU 61 -9.703 -8.688 1.791 484 HD13 LEU 61 HD13 LEU 61 -8.431 -9.381 0.788 485 HD21 LEU 61 HD21 LEU 61 -8.167 -10.565 4.425 486 HD22 LEU 61 HD22 LEU 61 -8.964 -11.002 2.915 487 HD23 LEU 61 HD23 LEU 61 -9.645 -9.740 3.938 488 H THR 62 H THR 62 -3.300 -8.701 2.627 489 HA THR 62 HA THR 62 -3.747 -6.391 4.274 490 HB THR 62 HB THR 62 -1.232 -7.975 3.696 491 HG1 THR 62 HG1 THR 62 -2.671 -9.122 4.957 492 HG21 THR 62 HG21 THR 62 -1.659 -5.702 5.619 493 HG22 THR 62 HG22 THR 62 -0.553 -5.733 4.248 494 HG23 THR 62 HG23 THR 62 -0.265 -6.780 5.640 495 H ALA 63 H ALA 63 -2.236 -7.089 1.191 496 HA ALA 63 HA ALA 63 -0.890 -4.642 0.809 497 HB1 ALA 63 HB1 ALA 63 -2.019 -6.481 -1.298 498 HB2 ALA 63 HB2 ALA 63 -0.462 -6.691 -0.498 499 HB3 ALA 63 HB3 ALA 63 -0.744 -5.280 -1.516 500 H VAL 64 H VAL 64 -4.105 -5.723 -0.268 501 HA VAL 64 HA VAL 64 -4.761 -3.338 -1.606 502 HB VAL 64 HB VAL 64 -5.929 -5.502 -1.953 503 HG11 VAL 64 HG11 VAL 64 -7.190 -4.842 0.697 504 HG12 VAL 64 HG12 VAL 64 -6.206 -6.246 0.301 505 HG13 VAL 64 HG13 VAL 64 -7.800 -6.058 -0.423 506 HG21 VAL 64 HG21 VAL 64 -6.898 -3.452 -2.807 507 HG22 VAL 64 HG22 VAL 64 -7.695 -3.153 -1.261 508 HG23 VAL 64 HG23 VAL 64 -8.171 -4.537 -2.246 509 H GLN 65 H GLN 65 -5.026 -4.250 1.776 510 HA GLN 65 HA GLN 65 -6.783 -2.211 2.617 511 HB2 GLN 65 HB2 GLN 65 -4.718 -3.908 3.954 512 HB3 GLN 65 HB3 GLN 65 -5.324 -2.504 4.823 513 HG2 GLN 65 HG2 GLN 65 -7.565 -3.345 4.763 514 HG3 GLN 65 HG3 GLN 65 -7.092 -4.656 3.678 515 HE21 GLN 65 HE21 GLN 65 -5.935 -6.388 4.479 516 HE22 GLN 65 HE22 GLN 65 -5.833 -6.724 6.173 517 H ILE 66 H ILE 66 -3.252 -2.391 2.645 518 HA ILE 66 HA ILE 66 -2.675 0.188 3.500 519 HB ILE 66 HB ILE 66 -1.147 -1.660 1.662 520 HG12 ILE 66 HG12 ILE 66 -0.486 -0.977 4.515 521 HG13 ILE 66 HG13 ILE 66 -1.670 -2.222 4.136 522 HG21 ILE 66 HG21 ILE 66 -0.425 0.644 1.269 523 HG22 ILE 66 HG22 ILE 66 0.831 -0.299 2.071 524 HG23 ILE 66 HG23 ILE 66 -0.136 0.847 2.997 525 HD11 ILE 66 HD11 ILE 66 0.025 -3.451 2.881 526 HD12 ILE 66 HD12 ILE 66 0.512 -3.185 4.556 527 HD13 ILE 66 HD13 ILE 66 1.210 -2.203 3.269 528 H ALA 67 H ALA 67 -3.128 -1.057 0.208 529 HA ALA 67 HA ALA 67 -2.552 1.297 -1.192 530 HB1 ALA 67 HB1 ALA 67 -4.495 -0.853 -2.019 531 HB2 ALA 67 HB2 ALA 67 -2.745 -0.962 -2.196 532 HB3 ALA 67 HB3 ALA 67 -3.642 0.277 -3.073 533 H SER 68 H SER 68 -5.662 0.076 0.028 534 HA SER 68 HA SER 68 -7.304 2.067 -1.059 535 HB2 SER 68 HB2 SER 68 -7.732 0.654 1.583 536 HB3 SER 68 HB3 SER 68 -8.967 1.385 0.562 537 HG SER 68 HG SER 68 -7.347 -0.859 -0.098 538 H GLU 69 H GLU 69 -5.662 1.921 2.073 539 HA GLU 69 HA GLU 69 -6.728 4.308 3.113 540 HB2 GLU 69 HB2 GLU 69 -4.366 2.607 3.796 541 HB3 GLU 69 HB3 GLU 69 -4.604 4.152 4.601 542 HG2 GLU 69 HG2 GLU 69 -6.571 1.876 4.546 543 HG3 GLU 69 HG3 GLU 69 -5.532 2.319 5.902 544 H TYR 70 H TYR 70 -3.934 3.760 1.045 545 HA TYR 70 HA TYR 70 -3.087 6.523 1.463 546 HB2 TYR 70 HB2 TYR 70 -1.787 4.154 0.157 547 HB3 TYR 70 HB3 TYR 70 -1.171 5.786 -0.082 548 HD1 TYR 70 HD1 TYR 70 -1.079 7.143 2.309 549 HD2 TYR 70 HD2 TYR 70 -0.684 2.943 1.768 550 HE1 TYR 70 HE1 TYR 70 0.130 6.988 4.444 551 HE2 TYR 70 HE2 TYR 70 0.525 2.775 3.902 552 HH TYR 70 HH TYR 70 0.635 5.346 6.151 553 H LEU 71 H LEU 71 -4.676 4.593 -0.971 554 HA LEU 71 HA LEU 71 -4.147 6.270 -3.170 555 HB2 LEU 71 HB2 LEU 71 -6.032 4.101 -2.584 556 HB3 LEU 71 HB3 LEU 71 -6.644 5.280 -3.727 557 HG LEU 71 HG LEU 71 -3.955 3.951 -4.097 558 HD11 LEU 71 HD11 LEU 71 -5.568 2.150 -4.025 559 HD12 LEU 71 HD12 LEU 71 -5.056 2.430 -5.688 560 HD13 LEU 71 HD13 LEU 71 -6.627 3.013 -5.145 561 HD21 LEU 71 HD21 LEU 71 -4.497 6.057 -5.347 562 HD22 LEU 71 HD22 LEU 71 -5.810 5.179 -6.131 563 HD23 LEU 71 HD23 LEU 71 -4.140 4.662 -6.361 564 H LYS 72 H LYS 72 -6.512 6.460 -0.601 565 HA LYS 72 HA LYS 72 -8.032 8.556 -1.812 566 HB2 LYS 72 HB2 LYS 72 -9.063 8.799 0.426 567 HB3 LYS 72 HB3 LYS 72 -9.093 7.145 -0.165 568 HG2 LYS 72 HG2 LYS 72 -7.549 6.415 1.384 569 HG3 LYS 72 HG3 LYS 72 -6.869 8.025 1.618 570 HD2 LYS 72 HD2 LYS 72 -8.534 8.662 3.074 571 HD3 LYS 72 HD3 LYS 72 -9.708 7.536 2.394 572 HE2 LYS 72 HE2 LYS 72 -9.154 6.697 4.530 573 HE3 LYS 72 HE3 LYS 72 -8.320 5.675 3.364 574 HZ1 LYS 72 HZ1 LYS 72 -6.882 6.225 5.205 575 HZ2 LYS 72 HZ2 LYS 72 -7.104 7.883 4.932 576 HZ3 LYS 72 HZ3 LYS 72 -6.289 6.941 3.783 577 H LEU 73 H LEU 73 -5.060 8.422 -0.139 578 HA LEU 73 HA LEU 73 -5.152 11.096 0.913 579 HB2 LEU 73 HB2 LEU 73 -3.855 9.210 1.933 580 HB3 LEU 73 HB3 LEU 73 -2.785 9.252 0.551 581 HG LEU 73 HG LEU 73 -2.013 10.359 2.737 582 HD11 LEU 73 HD11 LEU 73 -1.881 11.847 0.122 583 HD12 LEU 73 HD12 LEU 73 -0.769 10.607 0.699 584 HD13 LEU 73 HD13 LEU 73 -0.853 12.167 1.518 585 HD21 LEU 73 HD21 LEU 73 -4.162 11.614 3.062 586 HD22 LEU 73 HD22 LEU 73 -3.668 12.660 1.726 587 HD23 LEU 73 HD23 LEU 73 -2.695 12.582 3.192 588 H LYS 74 H LYS 74 -3.644 9.454 -1.841 589 HA LYS 74 HA LYS 74 -2.283 11.769 -2.762 590 HB2 LYS 74 HB2 LYS 74 -1.606 10.512 -4.613 591 HB3 LYS 74 HB3 LYS 74 -1.757 9.326 -3.329 592 HG2 LYS 74 HG2 LYS 74 -2.861 8.155 -4.893 593 HG3 LYS 74 HG3 LYS 74 -4.222 9.169 -4.418 594 HD2 LYS 74 HD2 LYS 74 -4.198 9.314 -6.750 595 HD3 LYS 74 HD3 LYS 74 -3.394 10.794 -6.226 596 HE2 LYS 74 HE2 LYS 74 -1.212 9.447 -6.495 597 HE3 LYS 74 HE3 LYS 74 -2.195 8.313 -7.416 598 HZ1 LYS 74 HZ1 LYS 74 -0.968 10.219 -8.622 599 HZ2 LYS 74 HZ2 LYS 74 -2.258 11.177 -8.091 600 HZ3 LYS 74 HZ3 LYS 74 -2.549 9.835 -9.080 601 H GLU 75 H GLU 75 -5.517 10.536 -3.247 602 HA GLU 75 HA GLU 75 -6.057 12.140 -5.541 603 HB2 GLU 75 HB2 GLU 75 -8.242 11.320 -5.490 604 HB3 GLU 75 HB3 GLU 75 -7.289 10.004 -4.823 605 HG2 GLU 75 HG2 GLU 75 -7.981 10.591 -2.588 606 HG3 GLU 75 HG3 GLU 75 -8.843 12.002 -3.197 607 H GLU 76 H GLU 76 -6.481 12.605 -2.051 608 HA GLU 76 HA GLU 76 -7.956 15.042 -2.400 609 HB2 GLU 76 HB2 GLU 76 -7.856 15.316 -0.035 610 HB3 GLU 76 HB3 GLU 76 -8.091 13.601 -0.333 611 HG2 GLU 76 HG2 GLU 76 -5.899 13.080 0.279 612 HG3 GLU 76 HG3 GLU 76 -5.371 14.757 0.137 613 H TYR 77 H TYR 77 -4.626 14.128 -2.222 614 HA TYR 77 HA TYR 77 -3.467 16.600 -1.600 615 HB2 TYR 77 HB2 TYR 77 -2.177 14.547 -1.545 616 HB3 TYR 77 HB3 TYR 77 -2.436 14.296 -3.264 617 HD1 TYR 77 HD2 TYR 77 -1.472 17.490 -1.605 618 HD2 TYR 77 HD1 TYR 77 -0.225 14.242 -4.056 619 HE1 TYR 77 HE2 TYR 77 0.623 18.670 -2.090 620 HE2 TYR 77 HE1 TYR 77 1.879 15.417 -4.545 621 HH TYR 77 HH TYR 77 2.810 17.616 -4.530 622 H GLN 78 H GLN 78 -4.081 15.091 -4.764 623 HA GLN 78 HA GLN 78 -3.292 17.374 -6.253 624 HB2 GLN 78 HB2 GLN 78 -4.989 14.985 -6.996 625 HB3 GLN 78 HB3 GLN 78 -4.468 16.211 -8.147 626 HG2 GLN 78 HG2 GLN 78 -2.188 15.634 -7.867 627 HG3 GLN 78 HG3 GLN 78 -2.548 14.620 -6.471 628 HE21 GLN 78 HE21 GLN 78 -2.674 14.882 -9.936 629 HE22 GLN 78 HE22 GLN 78 -2.965 13.208 -10.254 630 H ARG 79 H ARG 79 -6.327 16.271 -4.919 631 HA ARG 79 HA ARG 79 -8.084 17.962 -6.296 632 HB2 ARG 79 HB2 ARG 79 -8.749 15.989 -4.959 633 HB3 ARG 79 HB3 ARG 79 -8.339 16.867 -3.491 634 HG2 ARG 79 HG2 ARG 79 -10.074 18.511 -3.989 635 HG3 ARG 79 HG3 ARG 79 -10.489 17.628 -5.459 636 HD2 ARG 79 HD2 ARG 79 -11.077 15.664 -4.114 637 HD3 ARG 79 HD3 ARG 79 -10.651 16.543 -2.647 638 HE ARG 79 HE ARG 79 -12.610 17.942 -4.165 639 HH11 ARG 79 HH11 ARG 79 -12.181 15.261 -1.956 640 HH12 ARG 79 HH12 ARG 79 -13.813 15.318 -1.373 641 HH21 ARG 79 HH21 ARG 79 -14.747 18.038 -3.375 642 HH22 ARG 79 HH22 ARG 79 -15.273 16.899 -2.175 643 H LEU 80 H LEU 80 -6.496 18.449 -3.118 644 HA LEU 80 HA LEU 80 -7.687 21.051 -2.839 645 HB2 LEU 80 HB2 LEU 80 -7.077 20.906 -0.704 646 HB3 LEU 80 HB3 LEU 80 -6.626 19.254 -1.068 647 HG LEU 80 HG LEU 80 -4.555 21.334 -1.526 648 HD11 LEU 80 HD11 LEU 80 -5.394 22.120 0.570 649 HD12 LEU 80 HD12 LEU 80 -3.903 21.232 0.875 650 HD13 LEU 80 HD13 LEU 80 -5.460 20.481 1.218 651 HD21 LEU 80 HD21 LEU 80 -3.085 19.592 -0.692 652 HD22 LEU 80 HD22 LEU 80 -4.124 18.964 -1.971 653 HD23 LEU 80 HD23 LEU 80 -4.476 18.588 -0.285 654 H ARG 81 H ARG 81 -4.766 19.815 -4.205 655 HA ARG 81 HA ARG 81 -3.309 22.276 -4.098 656 HB2 ARG 81 HB2 ARG 81 -2.907 19.632 -5.429 657 HB3 ARG 81 HB3 ARG 81 -1.952 21.011 -5.952 658 HG2 ARG 81 HG2 ARG 81 -2.087 20.521 -3.042 659 HG3 ARG 81 HG3 ARG 81 -1.178 19.351 -4.000 660 HD2 ARG 81 HD2 ARG 81 0.419 20.935 -3.381 661 HD3 ARG 81 HD3 ARG 81 -0.011 21.409 -5.020 662 HE ARG 81 HE ARG 81 -1.084 22.731 -2.605 663 HH11 ARG 81 HH11 ARG 81 0.091 22.879 -5.907 664 HH12 ARG 81 HH12 ARG 81 -0.030 24.609 -5.994 665 HH21 ARG 81 HH21 ARG 81 -1.232 24.988 -2.723 666 HH22 ARG 81 HH22 ARG 81 -0.772 25.810 -4.181 667 H GLU 82 H GLU 82 -5.172 20.593 -6.631 668 HA GLU 82 HA GLU 82 -4.604 22.447 -8.669 669 HB2 GLU 82 HB2 GLU 82 -6.441 21.476 -9.896 670 HB3 GLU 82 HB3 GLU 82 -5.524 20.208 -9.103 671 HG2 GLU 82 HG2 GLU 82 -7.214 19.975 -7.409 672 HG3 GLU 82 HG3 GLU 82 -8.102 21.353 -8.059 673 H GLN 83 H GLN 83 -6.855 22.512 -6.058 674 HA GLN 83 HA GLN 83 -8.624 24.479 -7.041 675 HB2 GLN 83 HB2 GLN 83 -9.104 23.000 -5.107 676 HB3 GLN 83 HB3 GLN 83 -7.888 23.860 -4.173 677 HG2 GLN 83 HG2 GLN 83 -10.033 24.675 -3.546 678 HG3 GLN 83 HG3 GLN 83 -9.213 25.936 -4.466 679 HE21 GLN 83 HE21 GLN 83 -9.991 26.514 -6.471 680 HE22 GLN 83 HE22 GLN 83 -11.548 26.020 -7.044 681 H LEU 84 H LEU 84 -5.449 24.637 -5.666 682 HA LEU 84 HA LEU 84 -5.684 27.528 -5.281 683 HB2 LEU 84 HB2 LEU 84 -4.152 25.420 -4.030 684 HB3 LEU 84 HB3 LEU 84 -3.101 26.714 -4.564 685 HG LEU 84 HG LEU 84 -3.795 26.967 -2.218 686 HD11 LEU 84 HD11 LEU 84 -4.704 29.319 -2.416 687 HD12 LEU 84 HD12 LEU 84 -4.693 29.079 -4.162 688 HD13 LEU 84 HD13 LEU 84 -3.187 28.988 -3.252 689 HD21 LEU 84 HD21 LEU 84 -6.582 27.212 -3.347 690 HD22 LEU 84 HD22 LEU 84 -6.118 27.618 -1.698 691 HD23 LEU 84 HD23 LEU 84 -5.980 25.956 -2.269 692 H LYS 85 H LYS 85 -4.996 25.590 -7.779 693 HA LYS 85 HA LYS 85 -2.915 27.403 -8.808 694 HB2 LYS 85 HB2 LYS 85 -1.932 25.682 -9.977 695 HB3 LYS 85 HB3 LYS 85 -2.533 24.807 -8.577 696 HG2 LYS 85 HG2 LYS 85 -4.555 24.210 -9.930 697 HG3 LYS 85 HG3 LYS 85 -3.746 24.913 -11.328 698 HD2 LYS 85 HD2 LYS 85 -1.938 23.309 -11.137 699 HD3 LYS 85 HD3 LYS 85 -2.636 22.659 -9.654 700 HE2 LYS 85 HE2 LYS 85 -4.643 21.996 -10.927 701 HE3 LYS 85 HE3 LYS 85 -3.868 22.565 -12.404 702 HZ1 LYS 85 HZ1 LYS 85 -3.701 20.119 -11.955 703 HZ2 LYS 85 HZ2 LYS 85 -2.676 20.486 -10.663 704 HZ3 LYS 85 HZ3 LYS 85 -2.226 20.897 -12.238 705 H LYS 86 H LYS 86 -6.121 26.659 -8.967 706 HA LYS 86 HA LYS 86 -6.386 27.520 -11.762 707 HB2 LYS 86 HB2 LYS 86 -7.379 25.286 -10.878 708 HB3 LYS 86 HB3 LYS 86 -8.590 26.304 -10.117 709 HG2 LYS 86 HG2 LYS 86 -9.176 27.216 -12.327 710 HG3 LYS 86 HG3 LYS 86 -8.004 26.118 -13.062 711 HD2 LYS 86 HD2 LYS 86 -9.239 24.209 -12.080 712 HD3 LYS 86 HD3 LYS 86 -10.448 25.338 -11.470 713 HE2 LYS 86 HE2 LYS 86 -11.256 24.364 -13.513 714 HE3 LYS 86 HE3 LYS 86 -10.874 26.058 -13.810 715 HZ1 LYS 86 HZ1 LYS 86 -10.115 24.450 -15.551 716 HZ2 LYS 86 HZ2 LYS 86 -8.993 23.855 -14.437 717 HZ3 LYS 86 HZ3 LYS 86 -8.910 25.465 -14.945 718 H1 GLY 1 H1 GLY 1 -37.055 -3.438 13.335 719 H2 GLY 1 H2 GLY 1 -38.444 -3.033 14.212 720 H3 GLY 1 H3 GLY 1 -37.071 -2.048 14.298 721 HA2 GLY 1 HA3 GLY 1 -38.732 -2.494 11.881 722 HA3 GLY 1 HA2 GLY 1 -38.759 -1.051 12.884 723 H SER 2 H SER 2 -37.958 -1.659 9.997 724 HA SER 2 HA SER 2 -35.184 -1.243 9.745 725 HB2 SER 2 HB2 SER 2 -37.080 -0.261 7.653 726 HB3 SER 2 HB3 SER 2 -35.578 -1.169 7.470 727 HG SER 2 HG SER 2 -37.907 -2.177 7.288 728 H HIS 3 H HIS 3 -34.273 0.466 10.739 729 HA HIS 3 HA HIS 3 -35.436 3.125 10.263 730 HB2 HIS 3 HB2 HIS 3 -34.022 1.951 12.627 731 HB3 HIS 3 HB3 HIS 3 -33.862 3.677 12.313 732 HD1 HIS 3 HD1 HIS 3 -35.761 5.156 13.013 733 HD2 HIS 3 HD2 HIS 3 -36.744 1.120 13.147 734 HE1 HIS 3 HE1 HIS 3 -38.001 5.041 14.152 735 HE2 HIS 3 HE2 HIS 3 -38.460 2.581 14.418 736 H MET 4 H MET 4 -33.721 4.894 10.288 737 HA MET 4 HA MET 4 -31.587 4.051 8.494 738 HB2 MET 4 HB2 MET 4 -33.208 6.389 8.716 739 HB3 MET 4 HB3 MET 4 -31.522 6.860 8.900 740 HG2 MET 4 HG2 MET 4 -32.740 5.348 6.599 741 HG3 MET 4 HG3 MET 4 -32.140 7.005 6.588 742 HE1 MET 4 HE1 MET 4 -31.301 4.529 4.550 743 HE2 MET 4 HE2 MET 4 -29.606 4.969 4.337 744 HE3 MET 4 HE3 MET 4 -30.847 6.223 4.360 745 H THR 5 H THR 5 -29.424 4.496 8.842 746 HA THR 5 HA THR 5 -28.676 5.327 11.561 747 HB THR 5 HB THR 5 -26.743 3.566 11.163 748 HG1 THR 5 HG1 THR 5 -27.511 1.756 9.995 749 HG21 THR 5 HG21 THR 5 -28.367 3.529 13.021 750 HG22 THR 5 HG22 THR 5 -28.023 1.908 12.415 751 HG23 THR 5 HG23 THR 5 -29.530 2.713 11.975 752 H GLU 6 H GLU 6 -26.114 5.554 11.543 753 HA GLU 6 HA GLU 6 -25.543 7.570 9.579 754 HB2 GLU 6 HB2 GLU 6 -23.500 6.417 11.450 755 HB3 GLU 6 HB3 GLU 6 -23.646 8.066 10.859 756 HG2 GLU 6 HG2 GLU 6 -24.419 8.424 12.941 757 HG3 GLU 6 HG3 GLU 6 -25.941 7.899 12.222 758 H GLN 7 H GLN 7 -23.383 7.507 8.392 759 HA GLN 7 HA GLN 7 -23.042 4.811 7.260 760 HB2 GLN 7 HB2 GLN 7 -23.963 6.528 5.707 761 HB3 GLN 7 HB3 GLN 7 -22.479 7.452 5.904 762 HG2 GLN 7 HG2 GLN 7 -21.269 5.356 5.100 763 HG3 GLN 7 HG3 GLN 7 -22.854 4.780 4.588 764 HE21 GLN 7 HE21 GLN 7 -20.359 7.145 4.084 765 HE22 GLN 7 HE22 GLN 7 -20.905 7.696 2.540 766 HA PRO 8 HA PRO 8 -18.858 5.518 8.855 767 HB2 PRO 8 HB2 PRO 8 -18.572 3.123 10.027 768 HB3 PRO 8 HB3 PRO 8 -19.574 4.377 10.761 769 HG2 PRO 8 HG2 PRO 8 -20.377 1.903 9.347 770 HG3 PRO 8 HG3 PRO 8 -21.221 2.794 10.623 771 HD2 PRO 8 HD2 PRO 8 -21.684 2.911 7.805 772 HD3 PRO 8 HD3 PRO 8 -22.473 3.870 9.073 773 H LYS 9 H LYS 9 -16.940 3.693 8.726 774 HA LYS 9 HA LYS 9 -16.572 3.292 5.940 775 HB2 LYS 9 HB2 LYS 9 -14.882 3.465 8.107 776 HB3 LYS 9 HB3 LYS 9 -14.772 1.766 7.671 777 HG2 LYS 9 HG2 LYS 9 -14.337 2.542 5.307 778 HG3 LYS 9 HG3 LYS 9 -14.158 4.167 5.972 779 HD2 LYS 9 HD2 LYS 9 -12.279 3.512 7.282 780 HD3 LYS 9 HD3 LYS 9 -12.556 1.806 6.958 781 HE2 LYS 9 HE2 LYS 9 -11.013 2.045 5.354 782 HE3 LYS 9 HE3 LYS 9 -12.291 2.832 4.436 783 HZ1 LYS 9 HZ1 LYS 9 -11.142 4.650 4.458 784 HZ2 LYS 9 HZ2 LYS 9 -9.879 3.923 5.292 785 HZ3 LYS 9 HZ3 LYS 9 -11.105 4.711 6.153 786 H THR 10 H THR 10 -18.239 1.985 5.270 787 HA THR 10 HA THR 10 -18.829 -0.558 6.369 788 HB THR 10 HB THR 10 -20.420 0.834 5.008 789 HG1 THR 10 HG1 THR 10 -20.571 -1.425 3.540 790 HG21 THR 10 HG21 THR 10 -20.298 0.582 2.536 791 HG22 THR 10 HG22 THR 10 -18.695 -0.127 2.724 792 HG23 THR 10 HG23 THR 10 -18.984 1.544 3.210 793 H ARG 11 H ARG 11 -18.766 -2.554 4.946 794 HA ARG 11 HA ARG 11 -16.022 -2.892 4.004 795 HB2 ARG 11 HB2 ARG 11 -16.354 -5.266 4.285 796 HB3 ARG 11 HB3 ARG 11 -16.879 -4.436 5.741 797 HG2 ARG 11 HG2 ARG 11 -19.238 -4.608 4.828 798 HG3 ARG 11 HG3 ARG 11 -18.578 -5.700 3.609 799 HD2 ARG 11 HD2 ARG 11 -17.988 -7.305 5.204 800 HD3 ARG 11 HD3 ARG 11 -18.108 -6.155 6.536 801 HE ARG 11 HE ARG 11 -20.625 -6.196 5.680 802 HH11 ARG 11 HH11 ARG 11 -18.398 -8.812 6.335 803 HH12 ARG 11 HH12 ARG 11 -19.647 -9.947 6.730 804 HH21 ARG 11 HH21 ARG 11 -22.271 -7.672 6.213 805 HH22 ARG 11 HH22 ARG 11 -21.861 -9.296 6.661 806 H VAL 12 H VAL 12 -15.530 -3.869 2.032 807 HA VAL 12 HA VAL 12 -17.709 -4.034 0.064 808 HB VAL 12 HB VAL 12 -16.770 -1.847 -0.284 809 HG11 VAL 12 HG11 VAL 12 -14.398 -1.483 -0.777 810 HG12 VAL 12 HG12 VAL 12 -14.073 -3.185 -0.451 811 HG13 VAL 12 HG13 VAL 12 -14.637 -2.132 0.847 812 HG21 VAL 12 HG21 VAL 12 -15.949 -3.900 -2.310 813 HG22 VAL 12 HG22 VAL 12 -15.703 -2.175 -2.584 814 HG23 VAL 12 HG23 VAL 12 -17.332 -2.805 -2.337 815 H SER 13 H SER 13 -17.496 -5.658 -1.409 816 HA SER 13 HA SER 13 -15.127 -7.374 -1.122 817 HB2 SER 13 HB2 SER 13 -17.881 -8.118 -2.138 818 HB3 SER 13 HB3 SER 13 -16.537 -9.223 -1.858 819 HG SER 13 HG SER 13 -18.380 -8.529 -0.143 820 H VAL 14 H VAL 14 -13.805 -7.635 -2.823 821 HA VAL 14 HA VAL 14 -14.795 -7.048 -5.509 822 HB VAL 14 HB VAL 14 -12.382 -5.933 -5.801 823 HG11 VAL 14 HG11 VAL 14 -14.789 -4.449 -4.756 824 HG12 VAL 14 HG12 VAL 14 -14.545 -4.955 -6.428 825 HG13 VAL 14 HG13 VAL 14 -13.467 -3.764 -5.703 826 HG21 VAL 14 HG21 VAL 14 -12.037 -4.371 -3.858 827 HG22 VAL 14 HG22 VAL 14 -11.625 -6.059 -3.552 828 HG23 VAL 14 HG23 VAL 14 -13.140 -5.395 -2.939 829 H ARG 15 H ARG 15 -12.971 -7.551 -7.148 830 HA ARG 15 HA ARG 15 -12.039 -10.237 -6.505 831 HB2 ARG 15 HB2 ARG 15 -13.372 -10.055 -8.500 832 HB3 ARG 15 HB3 ARG 15 -12.367 -8.756 -9.116 833 HG2 ARG 15 HG2 ARG 15 -11.095 -11.392 -8.596 834 HG3 ARG 15 HG3 ARG 15 -12.142 -11.220 -10.003 835 HD2 ARG 15 HD2 ARG 15 -9.697 -9.573 -9.359 836 HD3 ARG 15 HD3 ARG 15 -9.846 -10.780 -10.633 837 HE ARG 15 HE ARG 15 -11.816 -8.812 -11.004 838 HH11 ARG 15 HH11 ARG 15 -8.330 -9.173 -11.171 839 HH12 ARG 15 HH12 ARG 15 -8.142 -7.975 -12.410 840 HH21 ARG 15 HH21 ARG 15 -11.567 -7.219 -12.621 841 HH22 ARG 15 HH22 ARG 15 -9.985 -6.854 -13.231 842 H ILE 16 H ILE 16 -9.968 -10.788 -6.306 843 HA ILE 16 HA ILE 16 -7.859 -9.054 -7.373 844 HB ILE 16 HB ILE 16 -7.776 -10.166 -4.557 845 HG12 ILE 16 HG12 ILE 16 -7.936 -7.253 -5.340 846 HG13 ILE 16 HG13 ILE 16 -9.358 -8.199 -4.917 847 HG21 ILE 16 HG21 ILE 16 -5.615 -10.016 -5.767 848 HG22 ILE 16 HG22 ILE 16 -5.692 -8.993 -4.335 849 HG23 ILE 16 HG23 ILE 16 -5.875 -8.281 -5.938 850 HD11 ILE 16 HD11 ILE 16 -8.688 -6.954 -3.009 851 HD12 ILE 16 HD12 ILE 16 -7.024 -7.519 -3.148 852 HD13 ILE 16 HD13 ILE 16 -8.306 -8.649 -2.705 853 H TYR 17 H TYR 17 -6.733 -10.317 -8.693 854 HA TYR 17 HA TYR 17 -5.668 -12.089 -9.605 855 HB2 TYR 17 HB2 TYR 17 -4.604 -11.869 -7.183 856 HB3 TYR 17 HB3 TYR 17 -5.343 -13.452 -6.974 857 HD1 TYR 17 HD1 TYR 17 -3.490 -11.770 -9.760 858 HD2 TYR 17 HD2 TYR 17 -3.799 -15.155 -7.198 859 HE1 TYR 17 HE1 TYR 17 -1.563 -12.793 -10.892 860 HE2 TYR 17 HE2 TYR 17 -1.869 -16.188 -8.325 861 HH TYR 17 HH TYR 17 -0.599 -16.087 -10.286 862 H GLY 18 H GLY 18 -8.424 -12.272 -9.629 863 HA2 GLY 18 HA2 GLY 18 -9.939 -13.843 -10.378 864 HA3 GLY 18 HA3 GLY 18 -8.733 -15.083 -10.097 865 H GLN 19 H GLN 19 -9.043 -13.371 -7.267 866 HA GLN 19 HA GLN 19 -11.088 -15.252 -6.288 867 HB2 GLN 19 HB2 GLN 19 -8.644 -14.195 -4.861 868 HB3 GLN 19 HB3 GLN 19 -9.895 -15.176 -4.107 869 HG2 GLN 19 HG2 GLN 19 -9.255 -17.079 -5.186 870 HG3 GLN 19 HG3 GLN 19 -8.582 -16.208 -6.561 871 HE21 GLN 19 HE21 GLN 19 -6.501 -15.395 -6.439 872 HE22 GLN 19 HE22 GLN 19 -5.387 -15.889 -5.212 873 H ASP 20 H ASP 20 -12.342 -14.475 -4.410 874 HA ASP 20 HA ASP 20 -12.751 -11.576 -4.606 875 HB2 ASP 20 HB2 ASP 20 -15.036 -11.903 -3.981 876 HB3 ASP 20 HB3 ASP 20 -14.668 -13.089 -5.226 877 H TYR 21 H TYR 21 -12.558 -10.292 -2.880 878 HA TYR 21 HA TYR 21 -12.282 -11.523 -0.227 879 HB2 TYR 21 HB2 TYR 21 -10.409 -9.448 -1.377 880 HB3 TYR 21 HB3 TYR 21 -10.375 -10.049 0.274 881 HD1 TYR 21 HD1 TYR 21 -9.737 -12.447 0.686 882 HD2 TYR 21 HD2 TYR 21 -9.350 -10.614 -3.131 883 HE1 TYR 21 HE1 TYR 21 -8.177 -14.220 -0.002 884 HE2 TYR 21 HE2 TYR 21 -7.792 -12.383 -3.834 885 HH TYR 21 HH TYR 21 -7.493 -15.186 -2.594 886 H THR 22 H THR 22 -12.803 -10.153 1.512 887 HA THR 22 HA THR 22 -14.338 -7.766 0.745 888 HB THR 22 HB THR 22 -14.660 -9.406 3.266 889 HG1 THR 22 HG1 THR 22 -16.245 -9.416 0.884 890 HG21 THR 22 HG21 THR 22 -16.801 -8.203 3.451 891 HG22 THR 22 HG22 THR 22 -16.385 -7.260 2.019 892 HG23 THR 22 HG23 THR 22 -15.422 -7.103 3.489 893 H ILE 23 H ILE 23 -13.487 -5.886 1.283 894 HA ILE 23 HA ILE 23 -11.703 -5.743 3.627 895 HB ILE 23 HB ILE 23 -10.835 -3.619 2.287 896 HG12 ILE 23 HG12 ILE 23 -12.375 -4.252 0.325 897 HG13 ILE 23 HG13 ILE 23 -10.714 -3.821 -0.043 898 HG21 ILE 23 HG21 ILE 23 -9.861 -6.442 1.996 899 HG22 ILE 23 HG22 ILE 23 -9.388 -5.245 3.199 900 HG23 ILE 23 HG23 ILE 23 -8.936 -5.021 1.511 901 HD11 ILE 23 HD11 ILE 23 -10.136 -6.100 -0.440 902 HD12 ILE 23 HD12 ILE 23 -11.618 -5.754 -1.324 903 HD13 ILE 23 HD13 ILE 23 -11.688 -6.661 0.184 904 H VAL 24 H VAL 24 -11.401 -3.143 4.006 905 HA VAL 24 HA VAL 24 -14.155 -2.185 4.410 906 HB VAL 24 HB VAL 24 -11.764 -1.288 6.010 907 HG11 VAL 24 HG11 VAL 24 -13.414 -0.571 7.617 908 HG12 VAL 24 HG12 VAL 24 -14.708 -1.308 6.671 909 HG13 VAL 24 HG13 VAL 24 -13.835 0.084 6.035 910 HG21 VAL 24 HG21 VAL 24 -13.631 -3.573 6.654 911 HG22 VAL 24 HG22 VAL 24 -12.428 -2.891 7.750 912 HG23 VAL 24 HG23 VAL 24 -11.912 -3.705 6.272 913 H GLY 25 H GLY 25 -14.703 -0.502 3.150 914 HA2 GLY 25 HA2 GLY 25 -12.979 1.768 2.852 915 HA3 GLY 25 HA3 GLY 25 -13.087 0.827 1.372 916 H ALA 26 H ALA 26 -14.213 3.518 2.641 917 HA ALA 26 HA ALA 26 -16.742 3.313 1.174 918 HB1 ALA 26 HB1 ALA 26 -17.212 2.902 3.574 919 HB2 ALA 26 HB2 ALA 26 -18.037 4.312 2.917 920 HB3 ALA 26 HB3 ALA 26 -16.606 4.519 3.928 921 H GLU 27 H GLU 27 -14.054 4.632 0.862 922 HA GLU 27 HA GLU 27 -14.368 7.419 1.168 923 HB2 GLU 27 HB2 GLU 27 -12.567 5.680 -0.505 924 HB3 GLU 27 HB3 GLU 27 -12.520 7.428 -0.652 925 HG2 GLU 27 HG2 GLU 27 -10.783 6.689 0.823 926 HG3 GLU 27 HG3 GLU 27 -11.977 7.606 1.729 927 H SER 28 H SER 28 -14.674 5.298 -1.642 928 HA SER 28 HA SER 28 -16.919 6.689 -2.684 929 HB2 SER 28 HB2 SER 28 -15.543 7.133 -4.921 930 HB3 SER 28 HB3 SER 28 -15.605 8.338 -3.634 931 HG SER 28 HG SER 28 -13.561 8.027 -3.235 932 HA PRO 29 HA PRO 29 -17.522 2.538 -4.070 933 HB2 PRO 29 HB2 PRO 29 -19.225 3.159 -6.180 934 HB3 PRO 29 HB3 PRO 29 -19.715 2.907 -4.503 935 HG2 PRO 29 HG2 PRO 29 -19.200 5.457 -5.968 936 HG3 PRO 29 HG3 PRO 29 -20.457 5.085 -4.772 937 HD2 PRO 29 HD2 PRO 29 -18.302 6.517 -4.117 938 HD3 PRO 29 HD3 PRO 29 -18.988 5.335 -2.983 939 H ALA 30 H ALA 30 -16.683 5.065 -6.401 940 HA ALA 30 HA ALA 30 -15.916 3.200 -8.440 941 HB1 ALA 30 HB1 ALA 30 -15.140 5.148 -9.661 942 HB2 ALA 30 HB2 ALA 30 -15.313 6.144 -8.215 943 HB3 ALA 30 HB3 ALA 30 -16.740 5.445 -8.981 944 H HIS 31 H HIS 31 -14.174 5.219 -6.093 945 HA HIS 31 HA HIS 31 -11.591 4.567 -7.020 946 HB2 HIS 31 HB2 HIS 31 -12.418 6.442 -5.348 947 HB3 HIS 31 HB3 HIS 31 -12.011 5.229 -4.137 948 HD1 HIS 31 HD1 HIS 31 -10.326 7.600 -3.871 949 HD2 HIS 31 HD2 HIS 31 -9.418 4.645 -6.653 950 HE1 HIS 31 HE1 HIS 31 -7.888 7.878 -4.385 951 HE2 HIS 31 HE2 HIS 31 -7.448 6.273 -6.272 952 H ILE 32 H ILE 32 -13.539 3.204 -4.376 953 HA ILE 32 HA ILE 32 -11.589 1.379 -3.481 954 HB ILE 32 HB ILE 32 -13.381 0.181 -2.351 955 HG12 ILE 32 HG12 ILE 32 -15.284 2.014 -3.835 956 HG13 ILE 32 HG13 ILE 32 -15.062 0.302 -4.171 957 HG21 ILE 32 HG21 ILE 32 -12.464 2.353 -1.492 958 HG22 ILE 32 HG22 ILE 32 -14.062 1.923 -0.885 959 HG23 ILE 32 HG23 ILE 32 -13.898 3.140 -2.151 960 HD11 ILE 32 HD11 ILE 32 -15.780 -0.113 -1.781 961 HD12 ILE 32 HD12 ILE 32 -17.016 0.472 -2.891 962 HD13 ILE 32 HD13 ILE 32 -16.273 1.582 -1.742 963 H ARG 33 H ARG 33 -13.518 1.323 -6.304 964 HA ARG 33 HA ARG 33 -13.427 -1.553 -6.600 965 HB2 ARG 33 HB2 ARG 33 -14.820 0.629 -7.900 966 HB3 ARG 33 HB3 ARG 33 -14.094 -0.456 -9.078 967 HG2 ARG 33 HG2 ARG 33 -16.337 -1.169 -8.627 968 HG3 ARG 33 HG3 ARG 33 -15.210 -2.353 -7.966 969 HD2 ARG 33 HD2 ARG 33 -15.557 -1.586 -5.755 970 HD3 ARG 33 HD3 ARG 33 -16.405 -0.146 -6.314 971 HE ARG 33 HE ARG 33 -17.463 -2.893 -6.397 972 HH11 ARG 33 HH11 ARG 33 -17.959 0.574 -6.483 973 HH12 ARG 33 HH12 ARG 33 -19.687 0.454 -6.390 974 HH21 ARG 33 HH21 ARG 33 -19.734 -3.057 -6.290 975 HH22 ARG 33 HH22 ARG 33 -20.697 -1.614 -6.280 976 H LEU 34 H LEU 34 -11.484 1.173 -7.544 977 HA LEU 34 HA LEU 34 -10.061 -0.458 -9.504 978 HB2 LEU 34 HB2 LEU 34 -8.883 1.528 -10.162 979 HB3 LEU 34 HB3 LEU 34 -10.601 1.853 -10.120 980 HG LEU 34 HG LEU 34 -9.937 2.751 -7.675 981 HD11 LEU 34 HD11 LEU 34 -7.821 3.994 -7.834 982 HD12 LEU 34 HD12 LEU 34 -7.486 3.206 -9.375 983 HD13 LEU 34 HD13 LEU 34 -7.569 2.250 -7.897 984 HD21 LEU 34 HD21 LEU 34 -9.837 4.995 -8.711 985 HD22 LEU 34 HD22 LEU 34 -11.158 4.006 -9.332 986 HD23 LEU 34 HD23 LEU 34 -9.695 4.226 -10.289 987 H VAL 35 H VAL 35 -9.872 0.341 -6.228 988 HA VAL 35 HA VAL 35 -7.101 0.382 -5.785 989 HB VAL 35 HB VAL 35 -9.271 -0.693 -3.961 990 HG11 VAL 35 HG11 VAL 35 -6.978 -1.484 -3.412 991 HG12 VAL 35 HG12 VAL 35 -7.705 -0.483 -2.156 992 HG13 VAL 35 HG13 VAL 35 -6.485 0.198 -3.232 993 HG21 VAL 35 HG21 VAL 35 -9.249 1.470 -2.907 994 HG22 VAL 35 HG22 VAL 35 -9.520 1.688 -4.637 995 HG23 VAL 35 HG23 VAL 35 -7.931 2.010 -3.947 996 H ALA 36 H ALA 36 -9.416 -2.286 -5.870 997 HA ALA 36 HA ALA 36 -7.609 -4.360 -5.299 998 HB1 ALA 36 HB1 ALA 36 -9.320 -5.852 -6.088 999 HB2 ALA 36 HB2 ALA 36 -10.118 -4.544 -6.961 1000 HB3 ALA 36 HB3 ALA 36 -10.085 -4.536 -5.198 1001 H ALA 37 H ALA 37 -8.708 -2.949 -8.355 1002 HA ALA 37 HA ALA 37 -7.393 -4.716 -10.090 1003 HB1 ALA 37 HB1 ALA 37 -7.732 -3.022 -11.800 1004 HB2 ALA 37 HB2 ALA 37 -8.092 -1.821 -10.559 1005 HB3 ALA 37 HB3 ALA 37 -9.176 -3.191 -10.801 1006 H PHE 38 H PHE 38 -6.313 -1.820 -8.428 1007 HA PHE 38 HA PHE 38 -3.908 -1.395 -9.824 1008 HB2 PHE 38 HB2 PHE 38 -4.965 0.233 -8.247 1009 HB3 PHE 38 HB3 PHE 38 -4.480 -0.804 -6.909 1010 HD1 PHE 38 HD2 PHE 38 -3.179 1.266 -9.688 1011 HD2 PHE 38 HD1 PHE 38 -2.324 -0.664 -5.989 1012 HE1 PHE 38 HE2 PHE 38 -1.006 2.419 -9.591 1013 HE2 PHE 38 HE1 PHE 38 -0.154 0.487 -5.887 1014 HZ PHE 38 HZ PHE 38 0.508 2.029 -7.686 1015 H VAL 39 H VAL 39 -4.635 -3.264 -6.896 1016 HA VAL 39 HA VAL 39 -1.949 -4.191 -6.549 1017 HB VAL 39 HB VAL 39 -4.500 -5.368 -5.425 1018 HG11 VAL 39 HG11 VAL 39 -3.063 -6.289 -3.679 1019 HG12 VAL 39 HG12 VAL 39 -1.643 -5.611 -4.477 1020 HG13 VAL 39 HG13 VAL 39 -2.581 -6.878 -5.270 1021 HG21 VAL 39 HG21 VAL 39 -4.574 -3.231 -4.583 1022 HG22 VAL 39 HG22 VAL 39 -2.819 -3.050 -4.587 1023 HG23 VAL 39 HG23 VAL 39 -3.600 -4.043 -3.357 1024 H ASP 40 H ASP 40 -4.859 -5.431 -8.049 1025 HA ASP 40 HA ASP 40 -4.145 -8.060 -8.563 1026 HB2 ASP 40 HB2 ASP 40 -6.390 -7.017 -8.936 1027 HB3 ASP 40 HB3 ASP 40 -5.744 -6.241 -10.379 1028 H ASP 41 H ASP 41 -3.714 -5.226 -10.700 1029 HA ASP 41 HA ASP 41 -2.222 -6.699 -12.621 1030 HB2 ASP 41 HB2 ASP 41 -3.463 -4.602 -13.148 1031 HB3 ASP 41 HB3 ASP 41 -2.223 -3.707 -12.272 1032 H LYS 42 H LYS 42 -1.382 -4.934 -9.745 1033 HA LYS 42 HA LYS 42 1.356 -4.529 -10.230 1034 HB2 LYS 42 HB2 LYS 42 0.058 -3.455 -8.403 1035 HB3 LYS 42 HB3 LYS 42 -0.018 -5.002 -7.574 1036 HG2 LYS 42 HG2 LYS 42 1.707 -3.916 -6.491 1037 HG3 LYS 42 HG3 LYS 42 2.553 -4.930 -7.656 1038 HD2 LYS 42 HD2 LYS 42 1.834 -2.203 -8.552 1039 HD3 LYS 42 HD3 LYS 42 3.086 -2.327 -7.316 1040 HE2 LYS 42 HE2 LYS 42 4.487 -3.585 -8.698 1041 HE3 LYS 42 HE3 LYS 42 3.184 -4.001 -9.803 1042 HZ1 LYS 42 HZ1 LYS 42 4.426 -2.404 -10.917 1043 HZ2 LYS 42 HZ2 LYS 42 4.615 -1.433 -9.541 1044 HZ3 LYS 42 HZ3 LYS 42 3.108 -1.526 -10.305 1045 H MET 43 H MET 43 -0.287 -7.173 -8.461 1046 HA MET 43 HA MET 43 2.135 -8.645 -8.122 1047 HB2 MET 43 HB2 MET 43 0.773 -10.418 -7.234 1048 HB3 MET 43 HB3 MET 43 0.191 -8.885 -6.607 1049 HG2 MET 43 HG2 MET 43 -1.611 -8.928 -8.297 1050 HG3 MET 43 HG3 MET 43 -1.054 -10.520 -8.802 1051 HE1 MET 43 HE1 MET 43 -0.188 -11.617 -5.779 1052 HE2 MET 43 HE2 MET 43 -0.881 -12.573 -7.089 1053 HE3 MET 43 HE3 MET 43 -1.629 -12.590 -5.492 1054 H HIS 44 H HIS 44 -0.303 -8.500 -10.581 1055 HA HIS 44 HA HIS 44 0.420 -10.910 -11.921 1056 HB2 HIS 44 HB2 HIS 44 -1.678 -10.280 -12.590 1057 HB3 HIS 44 HB3 HIS 44 -1.316 -8.571 -12.492 1058 HD1 HIS 44 HD1 HIS 44 -1.078 -7.385 -14.681 1059 HD2 HIS 44 HD2 HIS 44 -0.554 -11.506 -15.033 1060 HE1 HIS 44 HE1 HIS 44 -0.873 -7.843 -17.144 1061 HE2 HIS 44 HE2 HIS 44 -0.474 -10.324 -17.331 1062 H GLU 45 H GLU 45 1.820 -7.811 -11.713 1063 HA GLU 45 HA GLU 45 3.330 -8.100 -14.180 1064 HB2 GLU 45 HB2 GLU 45 3.060 -5.861 -14.039 1065 HB3 GLU 45 HB3 GLU 45 2.744 -5.912 -12.312 1066 HG2 GLU 45 HG2 GLU 45 5.063 -5.860 -11.793 1067 HG3 GLU 45 HG3 GLU 45 5.510 -6.147 -13.473 1068 H PHE 46 H PHE 46 3.778 -8.367 -10.703 1069 HA PHE 46 HA PHE 46 6.621 -8.745 -10.998 1070 HB2 PHE 46 HB2 PHE 46 4.775 -8.393 -8.732 1071 HB3 PHE 46 HB3 PHE 46 6.185 -9.401 -8.417 1072 HD1 PHE 46 HD2 PHE 46 8.471 -8.478 -8.931 1073 HD2 PHE 46 HD1 PHE 46 4.975 -6.051 -8.824 1074 HE1 PHE 46 HE2 PHE 46 9.880 -6.471 -8.716 1075 HE2 PHE 46 HE1 PHE 46 6.380 -4.040 -8.617 1076 HZ PHE 46 HZ PHE 46 8.829 -4.249 -8.562 1077 H SER 47 H SER 47 3.884 -10.758 -11.132 1078 HA SER 47 HA SER 47 4.965 -13.151 -10.123 1079 HB2 SER 47 HB2 SER 47 3.240 -14.241 -11.644 1080 HB3 SER 47 HB3 SER 47 2.604 -13.061 -10.495 1081 HG SER 47 HG SER 47 2.554 -13.032 -13.205 1082 H GLU 48 H GLU 48 5.327 -11.479 -13.144 1083 HA GLU 48 HA GLU 48 6.459 -13.602 -14.643 1084 HB2 GLU 48 HB2 GLU 48 5.482 -11.481 -15.588 1085 HB3 GLU 48 HB3 GLU 48 6.915 -10.636 -15.024 1086 HG2 GLU 48 HG2 GLU 48 7.991 -12.705 -16.450 1087 HG3 GLU 48 HG3 GLU 48 6.530 -12.337 -17.363 1088 H LYS 49 H LYS 49 7.683 -11.426 -12.262 1089 HA LYS 49 HA LYS 49 10.467 -11.929 -12.949 1090 HB2 LYS 49 HB2 LYS 49 9.572 -10.542 -10.432 1091 HB3 LYS 49 HB3 LYS 49 11.064 -10.328 -11.332 1092 HG2 LYS 49 HG2 LYS 49 8.326 -9.367 -12.143 1093 HG3 LYS 49 HG3 LYS 49 9.662 -8.380 -11.565 1094 HD2 LYS 49 HD2 LYS 49 10.939 -8.838 -13.534 1095 HD3 LYS 49 HD3 LYS 49 9.779 -10.056 -14.068 1096 HE2 LYS 49 HE2 LYS 49 8.063 -8.289 -14.277 1097 HE3 LYS 49 HE3 LYS 49 9.269 -7.088 -13.820 1098 HZ1 LYS 49 HZ1 LYS 49 8.980 -7.191 -16.209 1099 HZ2 LYS 49 HZ2 LYS 49 9.381 -8.839 -16.218 1100 HZ3 LYS 49 HZ3 LYS 49 10.542 -7.683 -15.785 1101 H GLN 50 H GLN 50 8.314 -12.411 -10.186 1102 HA GLN 50 HA GLN 50 8.358 -13.802 -8.394 1103 HB2 GLN 50 HB2 GLN 50 7.925 -15.172 -10.671 1104 HB3 GLN 50 HB3 GLN 50 9.314 -16.051 -10.048 1105 HG2 GLN 50 HG2 GLN 50 8.144 -16.476 -7.975 1106 HG3 GLN 50 HG3 GLN 50 6.764 -15.537 -8.536 1107 HE21 GLN 50 HE21 GLN 50 5.502 -16.368 -10.257 1108 HE22 GLN 50 HE22 GLN 50 5.476 -18.064 -10.597 1109 HA PRO 51 HA PRO 51 12.949 -13.804 -7.772 1110 HB2 PRO 51 HB2 PRO 51 13.023 -12.186 -5.624 1111 HB3 PRO 51 HB3 PRO 51 12.957 -11.559 -7.275 1112 HG2 PRO 51 HG2 PRO 51 10.761 -11.842 -5.265 1113 HG3 PRO 51 HG3 PRO 51 11.088 -10.511 -6.388 1114 HD2 PRO 51 HD2 PRO 51 9.204 -12.455 -6.831 1115 HD3 PRO 51 HD3 PRO 51 10.015 -11.552 -8.125 1116 H MET 52 H MET 52 10.239 -14.404 -5.659 1117 HA MET 52 HA MET 52 11.965 -16.009 -3.898 1118 HB2 MET 52 HB2 MET 52 9.292 -14.718 -3.424 1119 HB3 MET 52 HB3 MET 52 9.932 -15.956 -2.352 1120 HG2 MET 52 HG2 MET 52 11.192 -13.293 -2.972 1121 HG3 MET 52 HG3 MET 52 10.402 -13.762 -1.467 1122 HE1 MET 52 HE1 MET 52 13.383 -12.517 -1.917 1123 HE2 MET 52 HE2 MET 52 14.320 -13.432 -0.735 1124 HE3 MET 52 HE3 MET 52 12.733 -12.796 -0.303 1125 H LEU 53 H LEU 53 9.906 -16.374 -6.454 1126 HA LEU 53 HA LEU 53 8.708 -18.076 -7.366 1127 HB2 LEU 53 HB2 LEU 53 10.627 -19.773 -5.791 1128 HB3 LEU 53 HB3 LEU 53 9.728 -20.259 -7.216 1129 HG LEU 53 HG LEU 53 11.835 -18.096 -7.187 1130 HD11 LEU 53 HD11 LEU 53 13.297 -19.673 -8.218 1131 HD12 LEU 53 HD12 LEU 53 12.027 -20.895 -8.262 1132 HD13 LEU 53 HD13 LEU 53 12.697 -20.376 -6.716 1133 HD21 LEU 53 HD21 LEU 53 10.274 -19.411 -9.401 1134 HD22 LEU 53 HD22 LEU 53 11.722 -18.440 -9.664 1135 HD23 LEU 53 HD23 LEU 53 10.284 -17.707 -8.955 1136 H ASP 54 H ASP 54 7.335 -17.100 -5.203 1137 HA ASP 54 HA ASP 54 5.741 -19.395 -4.516 1138 HB2 ASP 54 HB2 ASP 54 7.549 -19.322 -2.744 1139 HB3 ASP 54 HB3 ASP 54 6.893 -17.770 -2.241 1140 H VAL 55 H VAL 55 3.645 -18.839 -3.997 1141 HA VAL 55 HA VAL 55 2.712 -16.395 -5.012 1142 HB VAL 55 HB VAL 55 1.214 -18.360 -3.280 1143 HG11 VAL 55 HG11 VAL 55 0.205 -16.202 -5.134 1144 HG12 VAL 55 HG12 VAL 55 0.089 -16.205 -3.374 1145 HG13 VAL 55 HG13 VAL 55 -0.797 -17.403 -4.316 1146 HG21 VAL 55 HG21 VAL 55 2.192 -19.354 -5.315 1147 HG22 VAL 55 HG22 VAL 55 1.357 -18.143 -6.286 1148 HG23 VAL 55 HG23 VAL 55 0.428 -19.325 -5.361 1149 HA PRO 56 HA PRO 56 1.592 -15.000 -0.483 1150 HB2 PRO 56 HB2 PRO 56 3.148 -16.165 1.484 1151 HB3 PRO 56 HB3 PRO 56 1.484 -16.622 1.108 1152 HG2 PRO 56 HG2 PRO 56 4.048 -17.897 0.263 1153 HG3 PRO 56 HG3 PRO 56 2.518 -18.656 0.736 1154 HD2 PRO 56 HD2 PRO 56 3.260 -18.461 -1.838 1155 HD3 PRO 56 HD3 PRO 56 1.562 -18.319 -1.345 1156 H LYS 57 H LYS 57 4.862 -16.013 -1.284 1157 HA LYS 57 HA LYS 57 6.142 -13.857 0.099 1158 HB2 LYS 57 HB2 LYS 57 7.339 -15.474 -2.145 1159 HB3 LYS 57 HB3 LYS 57 8.177 -14.653 -0.834 1160 HG2 LYS 57 HG2 LYS 57 6.316 -16.973 -0.412 1161 HG3 LYS 57 HG3 LYS 57 8.054 -17.145 -0.642 1162 HD2 LYS 57 HD2 LYS 57 8.547 -16.105 1.386 1163 HD3 LYS 57 HD3 LYS 57 6.957 -15.348 1.491 1164 HE2 LYS 57 HE2 LYS 57 7.455 -17.352 3.020 1165 HE3 LYS 57 HE3 LYS 57 5.920 -17.327 2.153 1166 HZ1 LYS 57 HZ1 LYS 57 6.719 -18.895 0.594 1167 HZ2 LYS 57 HZ2 LYS 57 7.153 -19.489 2.120 1168 HZ3 LYS 57 HZ3 LYS 57 8.315 -18.746 1.143 1169 H LEU 58 H LEU 58 4.749 -14.334 -3.028 1170 HA LEU 58 HA LEU 58 6.027 -12.089 -4.286 1171 HB2 LEU 58 HB2 LEU 58 5.157 -14.054 -5.538 1172 HB3 LEU 58 HB3 LEU 58 3.530 -13.592 -5.084 1173 HG LEU 58 HG LEU 58 4.127 -11.339 -6.274 1174 HD11 LEU 58 HD11 LEU 58 5.669 -11.646 -8.143 1175 HD12 LEU 58 HD12 LEU 58 6.079 -13.251 -7.538 1176 HD13 LEU 58 HD13 LEU 58 6.484 -11.821 -6.590 1177 HD21 LEU 58 HD21 LEU 58 3.240 -12.216 -8.347 1178 HD22 LEU 58 HD22 LEU 58 2.401 -12.946 -6.979 1179 HD23 LEU 58 HD23 LEU 58 3.631 -13.862 -7.848 1180 H ALA 59 H ALA 59 2.938 -12.777 -2.769 1181 HA ALA 59 HA ALA 59 1.635 -10.361 -3.309 1182 HB1 ALA 59 HB1 ALA 59 1.294 -12.231 -0.974 1183 HB2 ALA 59 HB2 ALA 59 0.469 -12.335 -2.529 1184 HB3 ALA 59 HB3 ALA 59 0.160 -10.970 -1.453 1185 H VAL 60 H VAL 60 3.469 -11.353 -0.411 1186 HA VAL 60 HA VAL 60 3.180 -8.901 0.952 1187 HB VAL 60 HB VAL 60 3.881 -11.058 2.012 1188 HG11 VAL 60 HG11 VAL 60 6.640 -10.400 1.004 1189 HG12 VAL 60 HG12 VAL 60 5.592 -11.606 0.260 1190 HG13 VAL 60 HG13 VAL 60 6.130 -11.818 1.925 1191 HG21 VAL 60 HG21 VAL 60 4.085 -8.946 3.204 1192 HG22 VAL 60 HG22 VAL 60 5.688 -8.696 2.515 1193 HG23 VAL 60 HG23 VAL 60 5.406 -10.034 3.631 1194 H LEU 61 H LEU 61 5.336 -9.961 -1.546 1195 HA LEU 61 HA LEU 61 7.366 -8.023 -1.259 1196 HB2 LEU 61 HB2 LEU 61 7.526 -10.093 -2.641 1197 HB3 LEU 61 HB3 LEU 61 6.414 -9.373 -3.786 1198 HG LEU 61 HG LEU 61 8.181 -7.465 -3.927 1199 HD11 LEU 61 HD11 LEU 61 9.844 -9.753 -2.880 1200 HD12 LEU 61 HD12 LEU 61 9.556 -8.214 -2.067 1201 HD13 LEU 61 HD13 LEU 61 10.472 -8.256 -3.573 1202 HD21 LEU 61 HD21 LEU 61 9.326 -8.668 -5.719 1203 HD22 LEU 61 HD22 LEU 61 7.584 -8.955 -5.760 1204 HD23 LEU 61 HD23 LEU 61 8.668 -10.191 -5.118 1205 H THR 62 H THR 62 4.519 -8.147 -3.406 1206 HA THR 62 HA THR 62 4.879 -5.545 -4.429 1207 HB THR 62 HB THR 62 2.309 -5.831 -4.918 1208 HG1 THR 62 HG1 THR 62 2.526 -7.817 -3.364 1209 HG21 THR 62 HG21 THR 62 4.298 -6.071 -6.500 1210 HG22 THR 62 HG22 THR 62 2.830 -6.940 -6.932 1211 HG23 THR 62 HG23 THR 62 4.182 -7.808 -6.203 1212 H ALA 63 H ALA 63 3.319 -6.744 -1.557 1213 HA ALA 63 HA ALA 63 1.653 -4.574 -0.948 1214 HB1 ALA 63 HB1 ALA 63 1.631 -5.432 1.311 1215 HB2 ALA 63 HB2 ALA 63 3.083 -6.384 0.998 1216 HB3 ALA 63 HB3 ALA 63 1.575 -6.781 0.175 1217 H VAL 64 H VAL 64 5.004 -5.240 0.046 1218 HA VAL 64 HA VAL 64 5.255 -2.821 1.519 1219 HB VAL 64 HB VAL 64 6.628 -4.869 1.919 1220 HG11 VAL 64 HG11 VAL 64 8.071 -3.971 -0.563 1221 HG12 VAL 64 HG12 VAL 64 7.194 -5.483 -0.335 1222 HG13 VAL 64 HG13 VAL 64 8.671 -5.175 0.575 1223 HG21 VAL 64 HG21 VAL 64 8.666 -3.672 2.495 1224 HG22 VAL 64 HG22 VAL 64 7.239 -2.714 2.886 1225 HG23 VAL 64 HG23 VAL 64 8.189 -2.337 1.449 1226 H GLN 65 H GLN 65 5.710 -3.646 -1.822 1227 HA GLN 65 HA GLN 65 7.295 -1.377 -2.514 1228 HB2 GLN 65 HB2 GLN 65 5.545 -3.166 -4.215 1229 HB3 GLN 65 HB3 GLN 65 6.645 -1.948 -4.854 1230 HG2 GLN 65 HG2 GLN 65 8.548 -3.121 -4.112 1231 HG3 GLN 65 HG3 GLN 65 7.593 -4.158 -3.053 1232 HE21 GLN 65 HE21 GLN 65 9.461 -5.005 -4.996 1233 HE22 GLN 65 HE22 GLN 65 8.608 -5.932 -6.176 1234 H ILE 66 H ILE 66 3.831 -2.129 -2.794 1235 HA ILE 66 HA ILE 66 2.970 0.308 -3.857 1236 HB ILE 66 HB ILE 66 1.557 -1.628 -2.009 1237 HG12 ILE 66 HG12 ILE 66 1.144 -1.176 -4.965 1238 HG13 ILE 66 HG13 ILE 66 2.276 -2.366 -4.332 1239 HG21 ILE 66 HG21 ILE 66 0.599 0.670 -1.889 1240 HG22 ILE 66 HG22 ILE 66 -0.515 -0.546 -2.508 1241 HG23 ILE 66 HG23 ILE 66 0.275 0.571 -3.620 1242 HD11 ILE 66 HD11 ILE 66 0.354 -3.417 -3.125 1243 HD12 ILE 66 HD12 ILE 66 0.266 -3.499 -4.883 1244 HD13 ILE 66 HD13 ILE 66 -0.712 -2.323 -4.007 1245 H ALA 67 H ALA 67 3.466 -0.733 -0.525 1246 HA ALA 67 HA ALA 67 2.487 1.512 0.805 1247 HB1 ALA 67 HB1 ALA 67 3.733 0.760 2.712 1248 HB2 ALA 67 HB2 ALA 67 4.796 -0.209 1.693 1249 HB3 ALA 67 HB3 ALA 67 3.099 -0.653 1.868 1250 H SER 68 H SER 68 5.821 0.783 -0.220 1251 HA SER 68 HA SER 68 7.051 3.093 0.723 1252 HB2 SER 68 HB2 SER 68 7.774 1.575 -1.790 1253 HB3 SER 68 HB3 SER 68 8.845 2.594 -0.829 1254 HG SER 68 HG SER 68 7.700 0.096 -0.139 1255 H GLU 69 H GLU 69 5.449 2.506 -2.365 1256 HA GLU 69 HA GLU 69 6.168 4.839 -3.721 1257 HB2 GLU 69 HB2 GLU 69 4.548 2.672 -4.289 1258 HB3 GLU 69 HB3 GLU 69 3.406 4.003 -4.235 1259 HG2 GLU 69 HG2 GLU 69 5.901 3.967 -5.914 1260 HG3 GLU 69 HG3 GLU 69 4.299 3.510 -6.486 1261 H TYR 70 H TYR 70 3.317 4.275 -1.654 1262 HA TYR 70 HA TYR 70 2.546 7.058 -1.960 1263 HB2 TYR 70 HB2 TYR 70 1.246 4.723 -0.581 1264 HB3 TYR 70 HB3 TYR 70 0.596 6.359 -0.531 1265 HD1 TYR 70 HD1 TYR 70 0.043 7.483 -2.755 1266 HD2 TYR 70 HD2 TYR 70 0.758 3.308 -2.387 1267 HE1 TYR 70 HE1 TYR 70 -1.115 7.102 -4.887 1268 HE2 TYR 70 HE2 TYR 70 -0.399 2.917 -4.522 1269 HH TYR 70 HH TYR 70 -1.193 5.446 -6.662 1270 H LEU 71 H LEU 71 4.152 5.092 0.427 1271 HA LEU 71 HA LEU 71 3.580 6.694 2.671 1272 HB2 LEU 71 HB2 LEU 71 5.538 4.594 2.035 1273 HB3 LEU 71 HB3 LEU 71 6.050 5.724 3.274 1274 HG LEU 71 HG LEU 71 3.367 4.359 3.435 1275 HD11 LEU 71 HD11 LEU 71 5.065 2.579 3.277 1276 HD12 LEU 71 HD12 LEU 71 4.315 2.659 4.867 1277 HD13 LEU 71 HD13 LEU 71 5.932 3.312 4.631 1278 HD21 LEU 71 HD21 LEU 71 3.993 6.387 4.847 1279 HD22 LEU 71 HD22 LEU 71 5.112 5.308 5.681 1280 HD23 LEU 71 HD23 LEU 71 3.385 4.964 5.688 1281 H LYS 72 H LYS 72 6.008 7.000 0.152 1282 HA LYS 72 HA LYS 72 7.371 9.151 1.501 1283 HB2 LYS 72 HB2 LYS 72 8.613 9.413 -0.609 1284 HB3 LYS 72 HB3 LYS 72 8.607 7.745 -0.056 1285 HG2 LYS 72 HG2 LYS 72 7.311 7.021 -1.786 1286 HG3 LYS 72 HG3 LYS 72 6.508 8.581 -1.981 1287 HD2 LYS 72 HD2 LYS 72 8.460 9.511 -3.042 1288 HD3 LYS 72 HD3 LYS 72 9.387 8.044 -2.715 1289 HE2 LYS 72 HE2 LYS 72 8.618 8.144 -5.040 1290 HE3 LYS 72 HE3 LYS 72 7.928 6.772 -4.176 1291 HZ1 LYS 72 HZ1 LYS 72 6.163 7.698 -5.364 1292 HZ2 LYS 72 HZ2 LYS 72 6.595 9.290 -4.969 1293 HZ3 LYS 72 HZ3 LYS 72 5.943 8.272 -3.786 1294 H LEU 73 H LEU 73 4.664 8.785 -0.579 1295 HA LEU 73 HA LEU 73 4.571 11.434 -1.606 1296 HB2 LEU 73 HB2 LEU 73 3.443 9.335 -2.547 1297 HB3 LEU 73 HB3 LEU 73 2.242 9.534 -1.294 1298 HG LEU 73 HG LEU 73 1.628 10.363 -3.610 1299 HD11 LEU 73 HD11 LEU 73 0.481 12.355 -2.781 1300 HD12 LEU 73 HD12 LEU 73 1.467 12.313 -1.320 1301 HD13 LEU 73 HD13 LEU 73 0.343 10.998 -1.663 1302 HD21 LEU 73 HD21 LEU 73 3.879 11.461 -3.981 1303 HD22 LEU 73 HD22 LEU 73 3.309 12.758 -2.927 1304 HD23 LEU 73 HD23 LEU 73 2.457 12.403 -4.425 1305 H LYS 74 H LYS 74 2.918 9.749 1.060 1306 HA LYS 74 HA LYS 74 1.442 12.010 1.892 1307 HB2 LYS 74 HB2 LYS 74 0.923 10.778 3.902 1308 HB3 LYS 74 HB3 LYS 74 0.823 9.703 2.520 1309 HG2 LYS 74 HG2 LYS 74 1.937 8.340 3.936 1310 HG3 LYS 74 HG3 LYS 74 3.324 9.170 3.233 1311 HD2 LYS 74 HD2 LYS 74 3.756 9.267 5.518 1312 HD3 LYS 74 HD3 LYS 74 3.026 10.837 5.186 1313 HE2 LYS 74 HE2 LYS 74 0.847 9.940 5.947 1314 HE3 LYS 74 HE3 LYS 74 1.646 8.423 6.352 1315 HZ1 LYS 74 HZ1 LYS 74 1.361 9.871 8.280 1316 HZ2 LYS 74 HZ2 LYS 74 2.309 11.067 7.541 1317 HZ3 LYS 74 HZ3 LYS 74 2.998 9.577 7.961 1318 H GLU 75 H GLU 75 4.694 10.956 2.502 1319 HA GLU 75 HA GLU 75 5.221 12.549 4.778 1320 HB2 GLU 75 HB2 GLU 75 6.621 10.629 3.857 1321 HB3 GLU 75 HB3 GLU 75 7.227 11.770 2.664 1322 HG2 GLU 75 HG2 GLU 75 8.854 11.922 4.247 1323 HG3 GLU 75 HG3 GLU 75 7.776 13.209 4.782 1324 H GLU 76 H GLU 76 5.804 13.032 1.319 1325 HA GLU 76 HA GLU 76 6.842 15.640 1.487 1326 HB2 GLU 76 HB2 GLU 76 7.055 14.158 -0.493 1327 HB3 GLU 76 HB3 GLU 76 5.335 14.346 -0.799 1328 HG2 GLU 76 HG2 GLU 76 6.398 15.803 -2.284 1329 HG3 GLU 76 HG3 GLU 76 5.778 16.826 -0.990 1330 H TYR 77 H TYR 77 3.610 14.355 1.280 1331 HA TYR 77 HA TYR 77 2.123 16.616 0.685 1332 HB2 TYR 77 HB2 TYR 77 1.180 14.364 0.757 1333 HB3 TYR 77 HB3 TYR 77 1.441 14.285 2.494 1334 HD1 TYR 77 HD1 TYR 77 -0.377 16.274 -0.081 1335 HD2 TYR 77 HD2 TYR 77 -0.292 14.869 3.932 1336 HE1 TYR 77 HE1 TYR 77 -2.630 17.178 0.273 1337 HE2 TYR 77 HE2 TYR 77 -2.551 15.772 4.300 1338 HH TYR 77 HH TYR 77 -4.646 16.333 2.322 1339 H GLN 78 H GLN 78 3.467 15.539 3.742 1340 HA GLN 78 HA GLN 78 2.171 17.626 5.266 1341 HB2 GLN 78 HB2 GLN 78 4.464 15.875 6.147 1342 HB3 GLN 78 HB3 GLN 78 3.327 16.732 7.169 1343 HG2 GLN 78 HG2 GLN 78 1.705 15.159 6.934 1344 HG3 GLN 78 HG3 GLN 78 2.198 14.733 5.300 1345 HE21 GLN 78 HE21 GLN 78 5.009 14.378 6.140 1346 HE22 GLN 78 HE22 GLN 78 5.067 12.861 6.963 1347 H ARG 79 H ARG 79 5.331 16.939 3.942 1348 HA ARG 79 HA ARG 79 6.836 18.943 5.144 1349 HB2 ARG 79 HB2 ARG 79 7.870 17.120 3.986 1350 HB3 ARG 79 HB3 ARG 79 7.119 17.583 2.468 1351 HG2 ARG 79 HG2 ARG 79 8.456 19.658 2.479 1352 HG3 ARG 79 HG3 ARG 79 9.249 19.105 3.958 1353 HD2 ARG 79 HD2 ARG 79 10.182 17.212 2.836 1354 HD3 ARG 79 HD3 ARG 79 9.223 17.526 1.392 1355 HE ARG 79 HE ARG 79 11.179 19.536 2.238 1356 HH11 ARG 79 HH11 ARG 79 10.168 17.063 -0.034 1357 HH12 ARG 79 HH12 ARG 79 11.380 17.473 -1.208 1358 HH21 ARG 79 HH21 ARG 79 12.748 20.103 0.679 1359 HH22 ARG 79 HH22 ARG 79 12.840 19.217 -0.809 1360 H LEU 80 H LEU 80 5.360 19.059 1.875 1361 HA LEU 80 HA LEU 80 6.139 21.772 1.495 1362 HB2 LEU 80 HB2 LEU 80 5.441 21.525 -0.617 1363 HB3 LEU 80 HB3 LEU 80 5.425 19.825 -0.199 1364 HG LEU 80 HG LEU 80 2.925 21.416 0.203 1365 HD11 LEU 80 HD11 LEU 80 3.570 22.059 -2.032 1366 HD12 LEU 80 HD12 LEU 80 2.245 20.901 -2.114 1367 HD13 LEU 80 HD13 LEU 80 3.893 20.377 -2.461 1368 HD21 LEU 80 HD21 LEU 80 3.361 18.595 -0.757 1369 HD22 LEU 80 HD22 LEU 80 1.859 19.322 -0.182 1370 HD23 LEU 80 HD23 LEU 80 3.189 19.043 0.939 1371 H ARG 81 H ARG 81 3.395 20.326 3.011 1372 HA ARG 81 HA ARG 81 1.775 22.711 2.737 1373 HB2 ARG 81 HB2 ARG 81 1.345 20.033 4.007 1374 HB3 ARG 81 HB3 ARG 81 0.285 21.380 4.403 1375 HG2 ARG 81 HG2 ARG 81 -0.012 21.633 1.863 1376 HG3 ARG 81 HG3 ARG 81 0.676 20.014 1.770 1377 HD2 ARG 81 HD2 ARG 81 -1.865 20.206 1.851 1378 HD3 ARG 81 HD3 ARG 81 -1.104 19.059 2.950 1379 HE ARG 81 HE ARG 81 -1.836 20.307 4.724 1380 HH11 ARG 81 HH11 ARG 81 -2.164 22.222 1.809 1381 HH12 ARG 81 HH12 ARG 81 -3.061 23.484 2.588 1382 HH21 ARG 81 HH21 ARG 81 -3.036 21.962 5.740 1383 HH22 ARG 81 HH22 ARG 81 -3.563 23.330 4.816 1384 H GLU 82 H GLU 82 3.770 21.178 5.201 1385 HA GLU 82 HA GLU 82 2.872 22.845 7.314 1386 HB2 GLU 82 HB2 GLU 82 4.491 21.838 8.653 1387 HB3 GLU 82 HB3 GLU 82 4.083 20.594 7.484 1388 HG2 GLU 82 HG2 GLU 82 6.089 21.053 6.231 1389 HG3 GLU 82 HG3 GLU 82 6.477 22.407 7.292 1390 H GLN 83 H GLN 83 5.397 23.133 4.909 1391 HA GLN 83 HA GLN 83 6.734 25.329 6.122 1392 HB2 GLN 83 HB2 GLN 83 7.780 23.863 4.422 1393 HB3 GLN 83 HB3 GLN 83 6.673 24.498 3.213 1394 HG2 GLN 83 HG2 GLN 83 8.815 25.560 2.984 1395 HG3 GLN 83 HG3 GLN 83 7.628 26.737 3.543 1396 HE21 GLN 83 HE21 GLN 83 9.202 28.082 4.380 1397 HE22 GLN 83 HE22 GLN 83 10.084 27.706 5.822 1398 H LEU 84 H LEU 84 3.822 25.014 4.376 1399 HA LEU 84 HA LEU 84 3.751 27.808 3.574 1400 HB2 LEU 84 HB2 LEU 84 2.359 25.372 2.803 1401 HB3 LEU 84 HB3 LEU 84 1.239 26.683 3.096 1402 HG LEU 84 HG LEU 84 1.859 26.528 0.728 1403 HD11 LEU 84 HD11 LEU 84 3.084 29.020 1.879 1404 HD12 LEU 84 HD12 LEU 84 1.345 28.731 1.843 1405 HD13 LEU 84 HD13 LEU 84 2.257 28.820 0.336 1406 HD21 LEU 84 HD21 LEU 84 4.156 27.147 0.031 1407 HD22 LEU 84 HD22 LEU 84 4.078 25.608 0.887 1408 HD23 LEU 84 HD23 LEU 84 4.663 27.050 1.716 1409 H LYS 85 H LYS 85 2.955 25.967 6.275 1410 HA LYS 85 HA LYS 85 0.908 27.906 7.108 1411 HB2 LYS 85 HB2 LYS 85 0.012 26.301 8.556 1412 HB3 LYS 85 HB3 LYS 85 0.462 25.360 7.139 1413 HG2 LYS 85 HG2 LYS 85 2.569 24.731 8.292 1414 HG3 LYS 85 HG3 LYS 85 1.995 25.573 9.726 1415 HD2 LYS 85 HD2 LYS 85 0.118 24.065 9.915 1416 HD3 LYS 85 HD3 LYS 85 0.554 23.279 8.396 1417 HE2 LYS 85 HE2 LYS 85 2.258 22.110 9.333 1418 HE3 LYS 85 HE3 LYS 85 2.647 23.392 10.478 1419 HZ1 LYS 85 HZ1 LYS 85 0.233 21.693 10.727 1420 HZ2 LYS 85 HZ2 LYS 85 0.890 22.736 11.885 1421 HZ3 LYS 85 HZ3 LYS 85 1.706 21.318 11.467 1422 H LYS 86 H LYS 86 4.133 27.171 7.463 1423 HA LYS 86 HA LYS 86 4.342 28.068 10.228 1424 HB2 LYS 86 HB2 LYS 86 5.694 26.141 9.190 1425 HB3 LYS 86 HB3 LYS 86 6.621 27.390 8.374 1426 HG2 LYS 86 HG2 LYS 86 7.363 28.297 10.454 1427 HG3 LYS 86 HG3 LYS 86 6.301 27.217 11.357 1428 HD2 LYS 86 HD2 LYS 86 7.554 25.283 10.486 1429 HD3 LYS 86 HD3 LYS 86 8.627 26.384 9.619 1430 HE2 LYS 86 HE2 LYS 86 9.673 25.656 11.676 1431 HE3 LYS 86 HE3 LYS 86 9.306 27.377 11.768 1432 HZ1 LYS 86 HZ1 LYS 86 8.754 26.036 13.793 1433 HZ2 LYS 86 HZ2 LYS 86 7.534 25.290 12.897 1434 HZ3 LYS 86 HZ3 LYS 86 7.475 26.956 13.176 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 35.747 -2.702 -17.183 2 H2 GLY 1 H2 GLY 1 37.138 -2.007 -17.846 3 H3 GLY 1 H3 GLY 1 36.406 -3.324 -18.611 4 HA2 GLY 1 HA3 GLY 1 35.911 -1.258 -19.766 5 HA3 GLY 1 HA2 GLY 1 34.464 -2.020 -19.126 6 H SER 2 H SER 2 35.437 0.869 -19.698 7 HA SER 2 HA SER 2 34.576 1.955 -17.100 8 HB2 SER 2 HB2 SER 2 36.406 3.317 -19.092 9 HB3 SER 2 HB3 SER 2 35.983 3.889 -17.479 10 HG SER 2 HG SER 2 37.346 1.458 -18.027 11 H HIS 3 H HIS 3 32.885 3.317 -17.115 12 HA HIS 3 HA HIS 3 32.012 4.646 -19.533 13 HB2 HIS 3 HB2 HIS 3 30.775 2.173 -18.606 14 HB3 HIS 3 HB3 HIS 3 29.623 3.502 -18.651 15 HD1 HIS 3 HD1 HIS 3 28.748 4.194 -20.907 16 HD2 HIS 3 HD2 HIS 3 31.954 1.561 -21.166 17 HE1 HIS 3 HE1 HIS 3 28.907 3.557 -23.336 18 HE2 HIS 3 HE2 HIS 3 30.934 2.071 -23.486 19 H MET 4 H MET 4 29.814 5.815 -18.951 20 HA MET 4 HA MET 4 30.368 7.523 -16.772 21 HB2 MET 4 HB2 MET 4 28.037 7.159 -18.616 22 HB3 MET 4 HB3 MET 4 27.868 8.192 -17.205 23 HG2 MET 4 HG2 MET 4 29.728 9.557 -17.970 24 HG3 MET 4 HG3 MET 4 29.925 8.511 -19.376 25 HE1 MET 4 HE1 MET 4 29.748 10.889 -20.851 26 HE2 MET 4 HE2 MET 4 29.544 11.689 -19.292 27 HE3 MET 4 HE3 MET 4 28.408 12.006 -20.602 28 H THR 5 H THR 5 30.179 7.019 -14.701 29 HA THR 5 HA THR 5 28.294 4.942 -13.895 30 HB THR 5 HB THR 5 30.209 6.268 -12.011 31 HG1 THR 5 HG1 THR 5 30.967 5.194 -14.291 32 HG21 THR 5 HG21 THR 5 30.244 4.055 -10.991 33 HG22 THR 5 HG22 THR 5 29.236 3.420 -12.292 34 HG23 THR 5 HG23 THR 5 28.581 4.612 -11.169 35 H GLU 6 H GLU 6 26.339 6.000 -13.942 36 HA GLU 6 HA GLU 6 25.980 8.481 -12.486 37 HB2 GLU 6 HB2 GLU 6 23.925 6.760 -13.883 38 HB3 GLU 6 HB3 GLU 6 23.705 8.415 -13.332 39 HG2 GLU 6 HG2 GLU 6 25.321 9.201 -14.951 40 HG3 GLU 6 HG3 GLU 6 25.641 7.545 -15.467 41 H GLN 7 H GLN 7 23.741 8.455 -11.209 42 HA GLN 7 HA GLN 7 23.954 6.267 -9.253 43 HB2 GLN 7 HB2 GLN 7 23.166 9.158 -8.969 44 HB3 GLN 7 HB3 GLN 7 22.731 7.967 -7.750 45 HG2 GLN 7 HG2 GLN 7 25.543 8.527 -8.655 46 HG3 GLN 7 HG3 GLN 7 24.789 9.237 -7.229 47 HE21 GLN 7 HE21 GLN 7 27.118 7.469 -7.514 48 HE22 GLN 7 HE22 GLN 7 26.791 6.107 -6.502 49 HA PRO 8 HA PRO 8 19.815 5.544 -10.935 50 HB2 PRO 8 HB2 PRO 8 19.876 2.882 -10.838 51 HB3 PRO 8 HB3 PRO 8 20.793 3.761 -12.065 52 HG2 PRO 8 HG2 PRO 8 21.747 2.484 -9.540 53 HG3 PRO 8 HG3 PRO 8 22.529 2.549 -11.130 54 HD2 PRO 8 HD2 PRO 8 23.098 4.216 -8.965 55 HD3 PRO 8 HD3 PRO 8 23.536 4.533 -10.656 56 H LYS 9 H LYS 9 18.074 3.886 -10.043 57 HA LYS 9 HA LYS 9 17.651 4.586 -7.289 58 HB2 LYS 9 HB2 LYS 9 16.038 2.912 -9.220 59 HB3 LYS 9 HB3 LYS 9 15.513 3.328 -7.594 60 HG2 LYS 9 HG2 LYS 9 15.107 5.508 -8.127 61 HG3 LYS 9 HG3 LYS 9 16.313 5.534 -9.414 62 HD2 LYS 9 HD2 LYS 9 14.138 5.665 -10.407 63 HD3 LYS 9 HD3 LYS 9 14.814 4.075 -10.759 64 HE2 LYS 9 HE2 LYS 9 13.500 3.127 -8.915 65 HE3 LYS 9 HE3 LYS 9 12.812 4.719 -8.599 66 HZ1 LYS 9 HZ1 LYS 9 11.881 4.693 -10.841 67 HZ2 LYS 9 HZ2 LYS 9 11.306 3.406 -9.912 68 HZ3 LYS 9 HZ3 LYS 9 12.491 3.134 -11.087 69 H THR 10 H THR 10 18.967 3.519 -5.917 70 HA THR 10 HA THR 10 19.808 0.845 -6.281 71 HB THR 10 HB THR 10 21.062 2.571 -4.975 72 HG1 THR 10 HG1 THR 10 21.760 1.043 -3.399 73 HG21 THR 10 HG21 THR 10 20.473 2.929 -2.630 74 HG22 THR 10 HG22 THR 10 19.008 1.969 -2.840 75 HG23 THR 10 HG23 THR 10 19.190 3.501 -3.697 76 H ARG 11 H ARG 11 19.452 -0.903 -4.720 77 HA ARG 11 HA ARG 11 16.631 -1.002 -3.901 78 HB2 ARG 11 HB2 ARG 11 18.487 -3.191 -4.838 79 HB3 ARG 11 HB3 ARG 11 16.914 -3.500 -4.119 80 HG2 ARG 11 HG2 ARG 11 15.811 -2.334 -5.919 81 HG3 ARG 11 HG3 ARG 11 17.367 -1.875 -6.611 82 HD2 ARG 11 HD2 ARG 11 16.327 -4.685 -6.284 83 HD3 ARG 11 HD3 ARG 11 16.400 -3.777 -7.793 84 HE ARG 11 HE ARG 11 18.881 -3.754 -7.430 85 HH11 ARG 11 HH11 ARG 11 16.857 -6.327 -6.184 86 HH12 ARG 11 HH12 ARG 11 18.153 -7.472 -6.089 87 HH21 ARG 11 HH21 ARG 11 20.584 -5.282 -7.333 88 HH22 ARG 11 HH22 ARG 11 20.268 -6.875 -6.726 89 H VAL 12 H VAL 12 16.145 -2.300 -2.023 90 HA VAL 12 HA VAL 12 18.371 -2.573 -0.127 91 HB VAL 12 HB VAL 12 17.145 -0.428 0.290 92 HG11 VAL 12 HG11 VAL 12 14.925 -0.894 -0.326 93 HG12 VAL 12 HG12 VAL 12 14.890 -0.684 1.427 94 HG13 VAL 12 HG13 VAL 12 14.841 -2.304 0.730 95 HG21 VAL 12 HG21 VAL 12 16.836 -0.785 2.716 96 HG22 VAL 12 HG22 VAL 12 18.343 -1.469 2.104 97 HG23 VAL 12 HG23 VAL 12 16.973 -2.524 2.452 98 H SER 13 H SER 13 18.157 -4.266 1.338 99 HA SER 13 HA SER 13 15.985 -6.144 0.740 100 HB2 SER 13 HB2 SER 13 18.631 -6.690 2.110 101 HB3 SER 13 HB3 SER 13 17.445 -7.891 1.596 102 HG SER 13 HG SER 13 18.870 -7.855 -0.039 103 H VAL 14 H VAL 14 14.407 -6.286 2.193 104 HA VAL 14 HA VAL 14 15.030 -5.688 5.007 105 HB VAL 14 HB VAL 14 12.671 -4.842 5.221 106 HG11 VAL 14 HG11 VAL 14 14.583 -3.330 5.177 107 HG12 VAL 14 HG12 VAL 14 13.189 -2.608 4.376 108 HG13 VAL 14 HG13 VAL 14 14.509 -3.273 3.415 109 HG21 VAL 14 HG21 VAL 14 12.783 -4.629 2.214 110 HG22 VAL 14 HG22 VAL 14 11.463 -4.136 3.271 111 HG23 VAL 14 HG23 VAL 14 11.853 -5.846 3.091 112 H ARG 15 H ARG 15 13.505 -6.692 6.553 113 HA ARG 15 HA ARG 15 12.614 -9.299 5.519 114 HB2 ARG 15 HB2 ARG 15 14.509 -8.898 7.385 115 HB3 ARG 15 HB3 ARG 15 13.090 -8.954 8.422 116 HG2 ARG 15 HG2 ARG 15 12.536 -11.146 7.675 117 HG3 ARG 15 HG3 ARG 15 13.766 -11.082 6.413 118 HD2 ARG 15 HD2 ARG 15 14.690 -12.389 8.137 119 HD3 ARG 15 HD3 ARG 15 15.463 -10.811 8.269 120 HE ARG 15 HE ARG 15 13.556 -10.460 10.020 121 HH11 ARG 15 HH11 ARG 15 15.457 -13.342 9.458 122 HH12 ARG 15 HH12 ARG 15 15.317 -13.913 11.086 123 HH21 ARG 15 HH21 ARG 15 13.359 -11.206 12.173 124 HH22 ARG 15 HH22 ARG 15 14.097 -12.709 12.626 125 H ILE 16 H ILE 16 10.532 -9.817 5.663 126 HA ILE 16 HA ILE 16 8.832 -8.372 7.590 127 HB ILE 16 HB ILE 16 7.910 -9.134 4.818 128 HG12 ILE 16 HG12 ILE 16 8.528 -6.321 5.684 129 HG13 ILE 16 HG13 ILE 16 9.754 -7.334 4.928 130 HG21 ILE 16 HG21 ILE 16 6.020 -7.688 5.317 131 HG22 ILE 16 HG22 ILE 16 6.713 -7.301 6.891 132 HG23 ILE 16 HG23 ILE 16 6.179 -8.946 6.544 133 HD11 ILE 16 HD11 ILE 16 8.791 -5.985 3.236 134 HD12 ILE 16 HD12 ILE 16 7.155 -6.408 3.742 135 HD13 ILE 16 HD13 ILE 16 8.191 -7.627 3.001 136 H TYR 17 H TYR 17 7.765 -9.720 8.875 137 HA TYR 17 HA TYR 17 6.891 -11.590 9.787 138 HB2 TYR 17 HB2 TYR 17 5.652 -11.282 7.371 139 HB3 TYR 17 HB3 TYR 17 6.240 -12.939 7.262 140 HD1 TYR 17 HD1 TYR 17 3.986 -10.654 9.037 141 HD2 TYR 17 HD2 TYR 17 5.348 -14.669 8.714 142 HE1 TYR 17 HE1 TYR 17 2.077 -11.405 10.396 143 HE2 TYR 17 HE2 TYR 17 3.446 -15.429 10.071 144 HH TYR 17 HH TYR 17 0.770 -13.437 10.786 145 H GLY 18 H GLY 18 9.741 -11.609 8.961 146 HA2 GLY 18 HA2 GLY 18 11.255 -13.292 9.712 147 HA3 GLY 18 HA3 GLY 18 10.092 -14.510 9.226 148 H GLN 19 H GLN 19 9.728 -13.139 6.560 149 HA GLN 19 HA GLN 19 12.106 -14.352 5.345 150 HB2 GLN 19 HB2 GLN 19 9.455 -13.578 4.115 151 HB3 GLN 19 HB3 GLN 19 10.798 -14.281 3.230 152 HG2 GLN 19 HG2 GLN 19 9.453 -16.104 3.626 153 HG3 GLN 19 HG3 GLN 19 10.624 -16.207 4.939 154 HE21 GLN 19 HE21 GLN 19 7.875 -14.020 4.685 155 HE22 GLN 19 HE22 GLN 19 7.032 -14.634 6.064 156 H ASP 20 H ASP 20 13.453 -13.271 3.959 157 HA ASP 20 HA ASP 20 13.254 -10.357 4.076 158 HB2 ASP 20 HB2 ASP 20 15.624 -10.308 3.542 159 HB3 ASP 20 HB3 ASP 20 15.345 -11.399 4.894 160 H TYR 21 H TYR 21 13.161 -9.079 2.313 161 HA TYR 21 HA TYR 21 13.176 -10.369 -0.329 162 HB2 TYR 21 HB2 TYR 21 11.143 -8.275 0.454 163 HB3 TYR 21 HB3 TYR 21 11.184 -9.238 -1.017 164 HD1 TYR 21 HD2 TYR 21 10.875 -11.790 -0.742 165 HD2 TYR 21 HD1 TYR 21 9.857 -8.953 2.262 166 HE1 TYR 21 HE2 TYR 21 9.383 -13.444 0.301 167 HE2 TYR 21 HE1 TYR 21 8.363 -10.601 3.314 168 HH TYR 21 HH TYR 21 7.105 -12.618 2.684 169 H THR 22 H THR 22 13.648 -8.927 -2.077 170 HA THR 22 HA THR 22 15.164 -6.562 -1.218 171 HB THR 22 HB THR 22 15.424 -7.656 -3.976 172 HG1 THR 22 HG1 THR 22 16.116 -9.011 -1.621 173 HG21 THR 22 HG21 THR 22 17.739 -6.971 -3.678 174 HG22 THR 22 HG22 THR 22 17.432 -6.609 -1.979 175 HG23 THR 22 HG23 THR 22 16.655 -5.651 -3.239 176 H ILE 23 H ILE 23 14.204 -4.667 -1.550 177 HA ILE 23 HA ILE 23 12.426 -4.393 -3.885 178 HB ILE 23 HB ILE 23 11.083 -2.760 -2.562 179 HG12 ILE 23 HG12 ILE 23 12.557 -3.924 -0.186 180 HG13 ILE 23 HG13 ILE 23 12.842 -2.317 -0.845 181 HG21 ILE 23 HG21 ILE 23 9.760 -4.417 -1.436 182 HG22 ILE 23 HG22 ILE 23 11.128 -5.525 -1.367 183 HG23 ILE 23 HG23 ILE 23 10.402 -5.116 -2.921 184 HD11 ILE 23 HD11 ILE 23 11.439 -1.900 0.923 185 HD12 ILE 23 HD12 ILE 23 10.488 -3.358 0.650 186 HD13 ILE 23 HD13 ILE 23 10.312 -1.974 -0.432 187 H VAL 24 H VAL 24 11.981 -1.846 -4.112 188 HA VAL 24 HA VAL 24 14.596 -0.730 -4.614 189 HB VAL 24 HB VAL 24 12.710 -0.591 -6.278 190 HG11 VAL 24 HG11 VAL 24 11.076 1.220 -6.009 191 HG12 VAL 24 HG12 VAL 24 11.655 1.481 -4.366 192 HG13 VAL 24 HG13 VAL 24 10.879 -0.043 -4.794 193 HG21 VAL 24 HG21 VAL 24 14.686 0.790 -6.496 194 HG22 VAL 24 HG22 VAL 24 13.991 1.995 -5.411 195 HG23 VAL 24 HG23 VAL 24 13.254 1.697 -6.984 196 H GLY 25 H GLY 25 15.526 0.989 -3.602 197 HA2 GLY 25 HA2 GLY 25 14.010 2.163 -1.351 198 HA3 GLY 25 HA3 GLY 25 15.708 1.728 -1.218 199 H ALA 26 H ALA 26 13.790 3.466 -3.653 200 HA ALA 26 HA ALA 26 15.883 5.509 -3.737 201 HB1 ALA 26 HB1 ALA 26 13.618 4.931 -5.636 202 HB2 ALA 26 HB2 ALA 26 15.322 4.546 -5.868 203 HB3 ALA 26 HB3 ALA 26 14.794 6.228 -5.833 204 H GLU 27 H GLU 27 15.228 6.477 -1.735 205 HA GLU 27 HA GLU 27 13.583 8.731 -2.098 206 HB2 GLU 27 HB2 GLU 27 11.798 6.989 -1.799 207 HB3 GLU 27 HB3 GLU 27 12.421 6.689 -0.185 208 HG2 GLU 27 HG2 GLU 27 11.954 9.493 -0.550 209 HG3 GLU 27 HG3 GLU 27 10.510 8.572 -0.966 210 H SER 28 H SER 28 14.375 6.583 0.643 211 HA SER 28 HA SER 28 16.425 8.290 1.620 212 HB2 SER 28 HB2 SER 28 13.725 8.354 2.967 213 HB3 SER 28 HB3 SER 28 15.207 8.709 3.852 214 HG SER 28 HG SER 28 14.699 10.026 1.419 215 HA PRO 29 HA PRO 29 17.539 4.144 2.844 216 HB2 PRO 29 HB2 PRO 29 19.497 5.015 4.654 217 HB3 PRO 29 HB3 PRO 29 19.740 4.595 2.959 218 HG2 PRO 29 HG2 PRO 29 19.399 7.263 4.223 219 HG3 PRO 29 HG3 PRO 29 20.383 6.797 2.824 220 HD2 PRO 29 HD2 PRO 29 18.076 8.128 2.538 221 HD3 PRO 29 HD3 PRO 29 18.578 6.889 1.371 222 H ALA 30 H ALA 30 16.999 6.665 5.300 223 HA ALA 30 HA ALA 30 16.633 4.713 7.394 224 HB1 ALA 30 HB1 ALA 30 16.086 6.632 8.806 225 HB2 ALA 30 HB2 ALA 30 16.069 7.677 7.386 226 HB3 ALA 30 HB3 ALA 30 17.572 6.907 7.895 227 H HIS 31 H HIS 31 14.587 6.656 5.332 228 HA HIS 31 HA HIS 31 12.128 6.224 6.668 229 HB2 HIS 31 HB2 HIS 31 12.873 7.906 4.747 230 HB3 HIS 31 HB3 HIS 31 12.217 6.645 3.712 231 HD1 HIS 31 HD1 HIS 31 10.045 7.483 2.939 232 HD2 HIS 31 HD2 HIS 31 10.634 8.231 6.988 233 HE1 HIS 31 HE1 HIS 31 7.915 8.540 3.755 234 HE2 HIS 31 HE2 HIS 31 8.447 9.299 6.091 235 H ILE 32 H ILE 32 13.782 4.498 4.080 236 HA ILE 32 HA ILE 32 11.629 2.716 3.510 237 HB ILE 32 HB ILE 32 13.180 1.480 2.129 238 HG12 ILE 32 HG12 ILE 32 15.346 3.212 3.363 239 HG13 ILE 32 HG13 ILE 32 15.137 1.486 3.608 240 HG21 ILE 32 HG21 ILE 32 13.737 3.204 0.564 241 HG22 ILE 32 HG22 ILE 32 13.737 4.426 1.835 242 HG23 ILE 32 HG23 ILE 32 12.228 3.649 1.359 243 HD11 ILE 32 HD11 ILE 32 16.066 2.938 1.166 244 HD12 ILE 32 HD12 ILE 32 15.464 1.282 1.083 245 HD13 ILE 32 HD13 ILE 32 16.871 1.659 2.075 246 H ARG 33 H ARG 33 13.614 2.831 6.189 247 HA ARG 33 HA ARG 33 13.881 -0.030 6.529 248 HB2 ARG 33 HB2 ARG 33 14.349 2.172 8.551 249 HB3 ARG 33 HB3 ARG 33 14.876 0.502 8.690 250 HG2 ARG 33 HG2 ARG 33 15.797 2.356 6.510 251 HG3 ARG 33 HG3 ARG 33 16.646 2.146 8.044 252 HD2 ARG 33 HD2 ARG 33 16.018 -0.386 6.752 253 HD3 ARG 33 HD3 ARG 33 17.023 0.656 5.747 254 HE ARG 33 HE ARG 33 17.802 0.194 8.530 255 HH11 ARG 33 HH11 ARG 33 18.378 -0.342 5.120 256 HH12 ARG 33 HH12 ARG 33 20.004 -0.896 5.347 257 HH21 ARG 33 HH21 ARG 33 19.929 -0.546 8.841 258 HH22 ARG 33 HH22 ARG 33 20.891 -1.004 7.472 259 H LEU 34 H LEU 34 11.750 2.529 7.604 260 HA LEU 34 HA LEU 34 10.411 0.836 9.520 261 HB2 LEU 34 HB2 LEU 34 9.074 2.712 10.059 262 HB3 LEU 34 HB3 LEU 34 10.702 3.306 9.812 263 HG LEU 34 HG LEU 34 9.597 3.647 7.328 264 HD11 LEU 34 HD11 LEU 34 7.444 4.768 7.707 265 HD12 LEU 34 HD12 LEU 34 7.478 4.239 9.387 266 HD13 LEU 34 HD13 LEU 34 7.375 3.048 8.092 267 HD21 LEU 34 HD21 LEU 34 10.987 5.249 8.510 268 HD22 LEU 34 HD22 LEU 34 9.673 5.578 9.641 269 HD23 LEU 34 HD23 LEU 34 9.507 6.024 7.945 270 H VAL 35 H VAL 35 10.173 1.421 6.179 271 HA VAL 35 HA VAL 35 7.447 1.127 5.655 272 HB VAL 35 HB VAL 35 9.745 0.070 3.987 273 HG11 VAL 35 HG11 VAL 35 6.932 0.770 3.152 274 HG12 VAL 35 HG12 VAL 35 7.545 -0.867 3.378 275 HG13 VAL 35 HG13 VAL 35 8.220 0.159 2.113 276 HG21 VAL 35 HG21 VAL 35 8.300 2.691 3.694 277 HG22 VAL 35 HG22 VAL 35 9.742 2.152 2.840 278 HG23 VAL 35 HG23 VAL 35 9.820 2.514 4.566 279 H ALA 36 H ALA 36 9.968 -1.344 5.903 280 HA ALA 36 HA ALA 36 8.343 -3.580 5.446 281 HB1 ALA 36 HB1 ALA 36 10.830 -3.534 5.405 282 HB2 ALA 36 HB2 ALA 36 10.146 -4.888 6.304 283 HB3 ALA 36 HB3 ALA 36 10.810 -3.501 7.167 284 H ALA 37 H ALA 37 9.280 -1.995 8.471 285 HA ALA 37 HA ALA 37 8.065 -3.823 10.231 286 HB1 ALA 37 HB1 ALA 37 8.627 -0.888 10.652 287 HB2 ALA 37 HB2 ALA 37 9.751 -2.214 10.959 288 HB3 ALA 37 HB3 ALA 37 8.276 -2.066 11.916 289 H PHE 38 H PHE 38 6.832 -1.020 8.531 290 HA PHE 38 HA PHE 38 4.412 -0.715 9.918 291 HB2 PHE 38 HB2 PHE 38 5.072 1.076 8.535 292 HB3 PHE 38 HB3 PHE 38 5.321 0.026 7.145 293 HD1 PHE 38 HD2 PHE 38 2.532 0.969 9.451 294 HD2 PHE 38 HD1 PHE 38 3.802 0.185 5.464 295 HE1 PHE 38 HE2 PHE 38 0.272 1.501 8.629 296 HE2 PHE 38 HE1 PHE 38 1.553 0.717 4.636 297 HZ PHE 38 HZ PHE 38 -0.219 1.370 6.216 298 H VAL 39 H VAL 39 5.126 -2.457 6.893 299 HA VAL 39 HA VAL 39 2.502 -3.509 6.598 300 HB VAL 39 HB VAL 39 5.072 -4.592 5.424 301 HG11 VAL 39 HG11 VAL 39 3.188 -6.137 5.265 302 HG12 VAL 39 HG12 VAL 39 3.628 -5.500 3.680 303 HG13 VAL 39 HG13 VAL 39 2.209 -4.873 4.519 304 HG21 VAL 39 HG21 VAL 39 3.582 -2.156 4.895 305 HG22 VAL 39 HG22 VAL 39 3.755 -3.167 3.465 306 HG23 VAL 39 HG23 VAL 39 5.188 -2.639 4.349 307 H ASP 40 H ASP 40 5.448 -4.670 8.112 308 HA ASP 40 HA ASP 40 4.735 -7.329 8.587 309 HB2 ASP 40 HB2 ASP 40 7.007 -6.495 8.931 310 HB3 ASP 40 HB3 ASP 40 6.455 -5.473 10.253 311 H ASP 41 H ASP 41 4.131 -4.403 10.444 312 HA ASP 41 HA ASP 41 2.837 -5.690 12.626 313 HB2 ASP 41 HB2 ASP 41 3.797 -3.536 13.002 314 HB3 ASP 41 HB3 ASP 41 2.888 -2.827 11.672 315 H LYS 42 H LYS 42 1.671 -4.064 9.710 316 HA LYS 42 HA LYS 42 -1.060 -4.111 10.278 317 HB2 LYS 42 HB2 LYS 42 0.122 -2.930 8.361 318 HB3 LYS 42 HB3 LYS 42 0.116 -4.474 7.522 319 HG2 LYS 42 HG2 LYS 42 -1.829 -3.781 6.670 320 HG3 LYS 42 HG3 LYS 42 -2.501 -4.231 8.238 321 HD2 LYS 42 HD2 LYS 42 -1.412 -1.627 8.490 322 HD3 LYS 42 HD3 LYS 42 -2.375 -1.656 7.011 323 HE2 LYS 42 HE2 LYS 42 -4.274 -2.559 8.276 324 HE3 LYS 42 HE3 LYS 42 -3.308 -2.513 9.749 325 HZ1 LYS 42 HZ1 LYS 42 -3.078 -0.065 9.338 326 HZ2 LYS 42 HZ2 LYS 42 -4.633 -0.584 9.745 327 HZ3 LYS 42 HZ3 LYS 42 -4.264 -0.212 8.132 328 H MET 43 H MET 43 1.006 -6.582 8.839 329 HA MET 43 HA MET 43 -1.098 -8.375 8.187 330 HB2 MET 43 HB2 MET 43 1.418 -8.249 7.388 331 HB3 MET 43 HB3 MET 43 1.669 -9.345 8.740 332 HG2 MET 43 HG2 MET 43 -0.127 -10.797 7.747 333 HG3 MET 43 HG3 MET 43 -0.055 -9.768 6.318 334 HE1 MET 43 HE1 MET 43 3.276 -9.191 6.716 335 HE2 MET 43 HE2 MET 43 2.425 -9.244 5.173 336 HE3 MET 43 HE3 MET 43 3.828 -10.275 5.441 337 H HIS 44 H HIS 44 0.732 -7.741 11.069 338 HA HIS 44 HA HIS 44 0.404 -10.164 12.421 339 HB2 HIS 44 HB2 HIS 44 1.058 -7.400 13.183 340 HB3 HIS 44 HB3 HIS 44 0.289 -8.336 14.454 341 HD1 HIS 44 HD1 HIS 44 1.558 -10.604 15.137 342 HD2 HIS 44 HD2 HIS 44 3.725 -7.892 12.842 343 HE1 HIS 44 HE1 HIS 44 3.971 -11.279 15.388 344 HE2 HIS 44 HE2 HIS 44 5.262 -9.635 13.980 345 H GLU 45 H GLU 45 -1.657 -7.245 12.605 346 HA GLU 45 HA GLU 45 -3.543 -8.434 14.344 347 HB2 GLU 45 HB2 GLU 45 -4.926 -6.498 13.941 348 HB3 GLU 45 HB3 GLU 45 -3.251 -5.992 14.105 349 HG2 GLU 45 HG2 GLU 45 -3.041 -5.610 11.767 350 HG3 GLU 45 HG3 GLU 45 -4.576 -6.413 11.434 351 H PHE 46 H PHE 46 -3.261 -8.409 10.852 352 HA PHE 46 HA PHE 46 -5.943 -9.315 10.426 353 HB2 PHE 46 HB2 PHE 46 -3.559 -8.901 8.677 354 HB3 PHE 46 HB3 PHE 46 -4.899 -9.871 8.076 355 HD1 PHE 46 HD1 PHE 46 -7.288 -8.719 8.638 356 HD2 PHE 46 HD2 PHE 46 -3.588 -6.691 8.079 357 HE1 PHE 46 HE1 PHE 46 -8.505 -6.666 8.036 358 HE2 PHE 46 HE2 PHE 46 -4.800 -4.638 7.480 359 HZ PHE 46 HZ PHE 46 -7.260 -4.626 7.457 360 H SER 47 H SER 47 -2.920 -10.873 11.109 361 HA SER 47 HA SER 47 -3.492 -13.441 10.093 362 HB2 SER 47 HB2 SER 47 -1.842 -12.777 12.546 363 HB3 SER 47 HB3 SER 47 -1.748 -14.254 11.589 364 HG SER 47 HG SER 47 -1.292 -11.708 10.431 365 H GLU 48 H GLU 48 -4.529 -11.752 12.917 366 HA GLU 48 HA GLU 48 -5.513 -14.056 14.322 367 HB2 GLU 48 HB2 GLU 48 -4.753 -12.083 15.524 368 HB3 GLU 48 HB3 GLU 48 -5.950 -11.092 14.709 369 HG2 GLU 48 HG2 GLU 48 -7.695 -12.581 15.796 370 HG3 GLU 48 HG3 GLU 48 -6.380 -13.190 16.801 371 H LYS 49 H LYS 49 -6.691 -11.993 11.848 372 HA LYS 49 HA LYS 49 -9.488 -12.336 12.424 373 HB2 LYS 49 HB2 LYS 49 -8.182 -11.356 9.882 374 HB3 LYS 49 HB3 LYS 49 -9.870 -11.162 10.331 375 HG2 LYS 49 HG2 LYS 49 -7.562 -9.969 11.853 376 HG3 LYS 49 HG3 LYS 49 -8.501 -9.119 10.624 377 HD2 LYS 49 HD2 LYS 49 -9.737 -8.446 12.380 378 HD3 LYS 49 HD3 LYS 49 -10.478 -10.040 12.231 379 HE2 LYS 49 HE2 LYS 49 -9.904 -9.716 14.524 380 HE3 LYS 49 HE3 LYS 49 -8.781 -10.896 13.853 381 HZ1 LYS 49 HZ1 LYS 49 -8.217 -8.013 14.289 382 HZ2 LYS 49 HZ2 LYS 49 -7.133 -9.126 13.623 383 HZ3 LYS 49 HZ3 LYS 49 -7.637 -9.291 15.234 384 H GLN 50 H GLN 50 -7.154 -13.751 10.191 385 HA GLN 50 HA GLN 50 -7.224 -15.539 8.787 386 HB2 GLN 50 HB2 GLN 50 -9.073 -16.491 10.974 387 HB3 GLN 50 HB3 GLN 50 -8.503 -17.526 9.672 388 HG2 GLN 50 HG2 GLN 50 -6.245 -17.319 10.396 389 HG3 GLN 50 HG3 GLN 50 -6.674 -16.063 11.557 390 HE21 GLN 50 HE21 GLN 50 -5.351 -18.631 11.979 391 HE22 GLN 50 HE22 GLN 50 -6.324 -19.488 13.126 392 HA PRO 51 HA PRO 51 -11.232 -14.266 6.815 393 HB2 PRO 51 HB2 PRO 51 -10.153 -13.390 4.471 394 HB3 PRO 51 HB3 PRO 51 -10.375 -12.361 5.887 395 HG2 PRO 51 HG2 PRO 51 -7.910 -13.639 4.839 396 HG3 PRO 51 HG3 PRO 51 -8.113 -12.088 5.662 397 HD2 PRO 51 HD2 PRO 51 -7.157 -14.394 6.849 398 HD3 PRO 51 HD3 PRO 51 -7.858 -13.018 7.720 399 H MET 52 H MET 52 -8.467 -15.730 5.082 400 HA MET 52 HA MET 52 -10.347 -17.708 3.971 401 HB2 MET 52 HB2 MET 52 -7.958 -16.385 2.709 402 HB3 MET 52 HB3 MET 52 -8.623 -17.888 2.088 403 HG2 MET 52 HG2 MET 52 -10.143 -15.303 2.364 404 HG3 MET 52 HG3 MET 52 -9.421 -15.910 0.873 405 HE1 MET 52 HE1 MET 52 -12.492 -15.110 0.913 406 HE2 MET 52 HE2 MET 52 -13.132 -16.483 0.008 407 HE3 MET 52 HE3 MET 52 -11.592 -15.758 -0.459 408 H LEU 53 H LEU 53 -8.220 -17.442 6.297 409 HA LEU 53 HA LEU 53 -6.684 -18.728 7.366 410 HB2 LEU 53 HB2 LEU 53 -8.617 -20.669 6.173 411 HB3 LEU 53 HB3 LEU 53 -7.215 -21.278 7.032 412 HG LEU 53 HG LEU 53 -9.100 -19.306 8.299 413 HD11 LEU 53 HD11 LEU 53 -10.441 -21.217 7.590 414 HD12 LEU 53 HD12 LEU 53 -10.247 -21.197 9.345 415 HD13 LEU 53 HD13 LEU 53 -9.296 -22.313 8.365 416 HD21 LEU 53 HD21 LEU 53 -8.221 -20.369 10.368 417 HD22 LEU 53 HD22 LEU 53 -6.987 -19.542 9.421 418 HD23 LEU 53 HD23 LEU 53 -7.106 -21.300 9.368 419 H ASP 54 H ASP 54 -5.521 -17.732 5.147 420 HA ASP 54 HA ASP 54 -3.617 -19.806 4.507 421 HB2 ASP 54 HB2 ASP 54 -5.496 -19.894 2.762 422 HB3 ASP 54 HB3 ASP 54 -4.902 -18.332 2.213 423 H VAL 55 H VAL 55 -1.614 -19.006 4.091 424 HA VAL 55 HA VAL 55 -0.979 -16.436 4.989 425 HB VAL 55 HB VAL 55 0.764 -18.213 3.277 426 HG11 VAL 55 HG11 VAL 55 1.570 -15.905 3.473 427 HG12 VAL 55 HG12 VAL 55 2.622 -17.039 4.317 428 HG13 VAL 55 HG13 VAL 55 1.497 -16.035 5.230 429 HG21 VAL 55 HG21 VAL 55 0.509 -18.098 6.281 430 HG22 VAL 55 HG22 VAL 55 1.649 -19.088 5.369 431 HG23 VAL 55 HG23 VAL 55 -0.085 -19.398 5.247 432 HA PRO 56 HA PRO 56 -0.056 -15.175 0.336 433 HB2 PRO 56 HB2 PRO 56 -1.717 -16.510 -1.451 434 HB3 PRO 56 HB3 PRO 56 0.004 -16.830 -1.216 435 HG2 PRO 56 HG2 PRO 56 -2.366 -18.252 -0.086 436 HG3 PRO 56 HG3 PRO 56 -0.827 -18.915 -0.668 437 HD2 PRO 56 HD2 PRO 56 -1.330 -18.675 1.945 438 HD3 PRO 56 HD3 PRO 56 0.292 -18.366 1.293 439 H LYS 57 H LYS 57 -3.248 -16.323 1.301 440 HA LYS 57 HA LYS 57 -4.679 -14.259 -0.042 441 HB2 LYS 57 HB2 LYS 57 -5.375 -16.366 1.944 442 HB3 LYS 57 HB3 LYS 57 -6.482 -15.019 1.742 443 HG2 LYS 57 HG2 LYS 57 -7.267 -16.706 0.319 444 HG3 LYS 57 HG3 LYS 57 -6.465 -15.540 -0.728 445 HD2 LYS 57 HD2 LYS 57 -4.760 -16.961 -1.245 446 HD3 LYS 57 HD3 LYS 57 -4.842 -17.798 0.305 447 HE2 LYS 57 HE2 LYS 57 -7.042 -18.764 -0.473 448 HE3 LYS 57 HE3 LYS 57 -6.663 -18.120 -2.068 449 HZ1 LYS 57 HZ1 LYS 57 -6.050 -20.518 -1.606 450 HZ2 LYS 57 HZ2 LYS 57 -4.794 -19.917 -0.637 451 HZ3 LYS 57 HZ3 LYS 57 -4.849 -19.545 -2.289 452 H LEU 58 H LEU 58 -3.025 -14.485 2.965 453 HA LEU 58 HA LEU 58 -4.394 -12.269 4.214 454 HB2 LEU 58 HB2 LEU 58 -3.275 -14.247 5.400 455 HB3 LEU 58 HB3 LEU 58 -1.754 -13.448 5.047 456 HG LEU 58 HG LEU 58 -2.859 -11.405 6.254 457 HD11 LEU 58 HD11 LEU 58 -5.077 -12.283 6.455 458 HD12 LEU 58 HD12 LEU 58 -4.375 -12.153 8.069 459 HD13 LEU 58 HD13 LEU 58 -4.478 -13.726 7.274 460 HD21 LEU 58 HD21 LEU 58 -1.985 -13.802 7.853 461 HD22 LEU 58 HD22 LEU 58 -1.885 -12.105 8.328 462 HD23 LEU 58 HD23 LEU 58 -0.885 -12.712 7.008 463 H ALA 59 H ALA 59 -1.319 -12.867 2.611 464 HA ALA 59 HA ALA 59 -0.142 -10.350 3.060 465 HB1 ALA 59 HB1 ALA 59 1.346 -10.967 1.174 466 HB2 ALA 59 HB2 ALA 59 0.311 -12.364 0.867 467 HB3 ALA 59 HB3 ALA 59 1.187 -12.234 2.392 468 H VAL 60 H VAL 60 -2.222 -11.529 0.443 469 HA VAL 60 HA VAL 60 -1.996 -9.104 -1.064 470 HB VAL 60 HB VAL 60 -2.579 -11.323 -2.081 471 HG11 VAL 60 HG11 VAL 60 -4.186 -12.091 -0.423 472 HG12 VAL 60 HG12 VAL 60 -4.906 -12.065 -2.031 473 HG13 VAL 60 HG13 VAL 60 -5.290 -10.793 -0.869 474 HG21 VAL 60 HG21 VAL 60 -2.916 -9.227 -3.293 475 HG22 VAL 60 HG22 VAL 60 -4.537 -9.089 -2.609 476 HG23 VAL 60 HG23 VAL 60 -4.152 -10.414 -3.707 477 H LEU 61 H LEU 61 -4.014 -10.243 1.508 478 HA LEU 61 HA LEU 61 -6.166 -8.425 1.187 479 HB2 LEU 61 HB2 LEU 61 -6.240 -10.515 2.555 480 HB3 LEU 61 HB3 LEU 61 -5.197 -9.736 3.728 481 HG LEU 61 HG LEU 61 -7.082 -7.919 3.784 482 HD11 LEU 61 HD11 LEU 61 -8.362 -8.842 1.920 483 HD12 LEU 61 HD12 LEU 61 -9.302 -8.838 3.412 484 HD13 LEU 61 HD13 LEU 61 -8.593 -10.341 2.821 485 HD21 LEU 61 HD21 LEU 61 -8.323 -9.497 5.443 486 HD22 LEU 61 HD22 LEU 61 -6.671 -8.991 5.776 487 HD23 LEU 61 HD23 LEU 61 -6.982 -10.590 5.105 488 H THR 62 H THR 62 -3.107 -8.326 2.937 489 HA THR 62 HA THR 62 -3.663 -5.867 4.264 490 HB THR 62 HB THR 62 -0.947 -5.979 4.237 491 HG1 THR 62 HG1 THR 62 -1.767 -8.702 4.250 492 HG21 THR 62 HG21 THR 62 -1.099 -7.047 6.392 493 HG22 THR 62 HG22 THR 62 -2.723 -7.629 6.020 494 HG23 THR 62 HG23 THR 62 -2.423 -5.898 6.202 495 H ALA 63 H ALA 63 -2.163 -6.784 1.236 496 HA ALA 63 HA ALA 63 -0.980 -4.351 0.536 497 HB1 ALA 63 HB1 ALA 63 -0.612 -6.519 -0.617 498 HB2 ALA 63 HB2 ALA 63 -0.937 -5.182 -1.718 499 HB3 ALA 63 HB3 ALA 63 -2.206 -6.354 -1.356 500 H VAL 64 H VAL 64 -4.208 -5.609 -0.273 501 HA VAL 64 HA VAL 64 -5.007 -3.278 -1.670 502 HB VAL 64 HB VAL 64 -6.083 -5.432 -2.091 503 HG11 VAL 64 HG11 VAL 64 -7.912 -6.117 -0.427 504 HG12 VAL 64 HG12 VAL 64 -6.994 -5.170 0.745 505 HG13 VAL 64 HG13 VAL 64 -6.242 -6.544 -0.063 506 HG21 VAL 64 HG21 VAL 64 -7.280 -3.399 -2.675 507 HG22 VAL 64 HG22 VAL 64 -8.011 -3.355 -1.072 508 HG23 VAL 64 HG23 VAL 64 -8.402 -4.668 -2.182 509 H GLN 65 H GLN 65 -5.192 -4.209 1.706 510 HA GLN 65 HA GLN 65 -7.027 -2.187 2.491 511 HB2 GLN 65 HB2 GLN 65 -5.211 -4.069 3.890 512 HB3 GLN 65 HB3 GLN 65 -5.645 -2.610 4.772 513 HG2 GLN 65 HG2 GLN 65 -7.788 -4.246 3.477 514 HG3 GLN 65 HG3 GLN 65 -7.107 -4.758 5.022 515 HE21 GLN 65 HE21 GLN 65 -9.008 -4.427 6.127 516 HE22 GLN 65 HE22 GLN 65 -9.632 -2.852 6.463 517 H ILE 66 H ILE 66 -3.474 -2.398 2.676 518 HA ILE 66 HA ILE 66 -3.014 0.171 3.697 519 HB ILE 66 HB ILE 66 -1.283 -1.573 1.933 520 HG12 ILE 66 HG12 ILE 66 -0.942 -0.933 4.863 521 HG13 ILE 66 HG13 ILE 66 -1.919 -2.287 4.309 522 HG21 ILE 66 HG21 ILE 66 -0.675 0.800 1.670 523 HG22 ILE 66 HG22 ILE 66 0.589 -0.132 2.472 524 HG23 ILE 66 HG23 ILE 66 -0.464 0.923 3.417 525 HD11 ILE 66 HD11 ILE 66 0.227 -3.111 4.890 526 HD12 ILE 66 HD12 ILE 66 1.031 -1.883 3.913 527 HD13 ILE 66 HD13 ILE 66 0.095 -3.157 3.133 528 H ALA 67 H ALA 67 -3.289 -1.007 0.376 529 HA ALA 67 HA ALA 67 -2.644 1.348 -0.974 530 HB1 ALA 67 HB1 ALA 67 -4.637 -0.731 -1.859 531 HB2 ALA 67 HB2 ALA 67 -2.889 -0.883 -2.026 532 HB3 ALA 67 HB3 ALA 67 -3.752 0.394 -2.888 533 H SER 68 H SER 68 -5.829 0.138 0.064 534 HA SER 68 HA SER 68 -7.333 2.307 -0.894 535 HB2 SER 68 HB2 SER 68 -7.940 0.501 1.459 536 HB3 SER 68 HB3 SER 68 -9.110 1.480 0.572 537 HG SER 68 HG SER 68 -7.683 -0.805 -0.287 538 H GLU 69 H GLU 69 -5.762 1.721 2.211 539 HA GLU 69 HA GLU 69 -6.803 3.903 3.619 540 HB2 GLU 69 HB2 GLU 69 -4.294 2.285 3.894 541 HB3 GLU 69 HB3 GLU 69 -4.583 3.666 4.941 542 HG2 GLU 69 HG2 GLU 69 -6.865 2.484 5.388 543 HG3 GLU 69 HG3 GLU 69 -6.015 1.055 4.801 544 H TYR 70 H TYR 70 -3.883 3.655 1.620 545 HA TYR 70 HA TYR 70 -3.203 6.419 2.153 546 HB2 TYR 70 HB2 TYR 70 -1.897 4.213 0.589 547 HB3 TYR 70 HB3 TYR 70 -1.337 5.876 0.450 548 HD1 TYR 70 HD2 TYR 70 -2.339 3.617 3.270 549 HD2 TYR 70 HD1 TYR 70 0.547 6.318 1.700 550 HE1 TYR 70 HE2 TYR 70 -0.975 3.331 5.298 551 HE2 TYR 70 HE1 TYR 70 1.916 6.041 3.719 552 HH TYR 70 HH TYR 70 0.970 3.775 6.283 553 H LEU 71 H LEU 71 -4.839 4.639 -0.345 554 HA LEU 71 HA LEU 71 -4.500 6.489 -2.444 555 HB2 LEU 71 HB2 LEU 71 -6.242 4.193 -1.913 556 HB3 LEU 71 HB3 LEU 71 -6.969 5.406 -2.945 557 HG LEU 71 HG LEU 71 -4.247 4.227 -3.518 558 HD11 LEU 71 HD11 LEU 71 -6.933 3.263 -4.496 559 HD12 LEU 71 HD12 LEU 71 -5.762 2.361 -3.530 560 HD13 LEU 71 HD13 LEU 71 -5.383 2.799 -5.194 561 HD21 LEU 71 HD21 LEU 71 -4.783 6.354 -4.630 562 HD22 LEU 71 HD22 LEU 71 -6.240 5.625 -5.305 563 HD23 LEU 71 HD23 LEU 71 -4.654 5.021 -5.774 564 H LYS 72 H LYS 72 -6.857 6.305 0.158 565 HA LYS 72 HA LYS 72 -8.460 8.441 -0.882 566 HB2 LYS 72 HB2 LYS 72 -9.703 8.310 1.175 567 HB3 LYS 72 HB3 LYS 72 -9.385 6.683 0.590 568 HG2 LYS 72 HG2 LYS 72 -7.534 6.490 2.216 569 HG3 LYS 72 HG3 LYS 72 -7.933 8.097 2.826 570 HD2 LYS 72 HD2 LYS 72 -10.072 7.353 3.594 571 HD3 LYS 72 HD3 LYS 72 -9.890 5.801 2.774 572 HE2 LYS 72 HE2 LYS 72 -9.443 5.362 5.037 573 HE3 LYS 72 HE3 LYS 72 -7.864 5.425 4.255 574 HZ1 LYS 72 HZ1 LYS 72 -9.131 7.537 5.906 575 HZ2 LYS 72 HZ2 LYS 72 -7.712 7.767 5.020 576 HZ3 LYS 72 HZ3 LYS 72 -7.743 6.637 6.277 577 H LEU 73 H LEU 73 -5.477 8.365 0.540 578 HA LEU 73 HA LEU 73 -5.745 10.930 1.904 579 HB2 LEU 73 HB2 LEU 73 -4.500 9.372 3.154 580 HB3 LEU 73 HB3 LEU 73 -3.588 8.847 1.756 581 HG LEU 73 HG LEU 73 -2.441 11.064 1.732 582 HD11 LEU 73 HD11 LEU 73 -3.888 11.421 4.352 583 HD12 LEU 73 HD12 LEU 73 -4.104 12.387 2.894 584 HD13 LEU 73 HD13 LEU 73 -2.574 12.439 3.767 585 HD21 LEU 73 HD21 LEU 73 -1.000 10.568 3.646 586 HD22 LEU 73 HD22 LEU 73 -1.409 9.104 2.750 587 HD23 LEU 73 HD23 LEU 73 -2.219 9.460 4.276 588 H LYS 74 H LYS 74 -4.076 9.457 -0.848 589 HA LYS 74 HA LYS 74 -2.669 11.837 -1.535 590 HB2 LYS 74 HB2 LYS 74 -2.034 10.693 -3.577 591 HB3 LYS 74 HB3 LYS 74 -1.862 9.612 -2.203 592 HG2 LYS 74 HG2 LYS 74 -3.163 8.117 -3.174 593 HG3 LYS 74 HG3 LYS 74 -4.471 9.293 -3.311 594 HD2 LYS 74 HD2 LYS 74 -4.011 8.550 -5.510 595 HD3 LYS 74 HD3 LYS 74 -3.307 10.160 -5.377 596 HE2 LYS 74 HE2 LYS 74 -1.104 9.151 -4.969 597 HE3 LYS 74 HE3 LYS 74 -1.815 7.548 -5.123 598 HZ1 LYS 74 HZ1 LYS 74 -0.669 8.527 -7.143 599 HZ2 LYS 74 HZ2 LYS 74 -2.012 9.539 -7.288 600 HZ3 LYS 74 HZ3 LYS 74 -2.206 7.863 -7.382 601 H GLU 75 H GLU 75 -5.894 10.829 -2.018 602 HA GLU 75 HA GLU 75 -6.271 12.471 -4.364 603 HB2 GLU 75 HB2 GLU 75 -8.553 11.744 -4.355 604 HB3 GLU 75 HB3 GLU 75 -7.529 10.352 -4.042 605 HG2 GLU 75 HG2 GLU 75 -8.058 10.473 -1.674 606 HG3 GLU 75 HG3 GLU 75 -9.055 11.898 -1.961 607 H GLU 76 H GLU 76 -6.925 12.700 -0.895 608 HA GLU 76 HA GLU 76 -8.483 15.066 -1.106 609 HB2 GLU 76 HB2 GLU 76 -8.250 15.275 1.296 610 HB3 GLU 76 HB3 GLU 76 -8.589 13.605 0.874 611 HG2 GLU 76 HG2 GLU 76 -6.251 13.029 1.193 612 HG3 GLU 76 HG3 GLU 76 -5.880 14.714 1.563 613 H TYR 77 H TYR 77 -5.082 14.416 -1.032 614 HA TYR 77 HA TYR 77 -4.112 16.948 -0.312 615 HB2 TYR 77 HB2 TYR 77 -2.547 15.160 -0.399 616 HB3 TYR 77 HB3 TYR 77 -2.991 14.751 -2.051 617 HD1 TYR 77 HD2 TYR 77 -2.022 18.022 -0.511 618 HD2 TYR 77 HD1 TYR 77 -1.085 15.001 -3.359 619 HE1 TYR 77 HE2 TYR 77 -0.172 19.400 -1.354 620 HE2 TYR 77 HE1 TYR 77 0.771 16.375 -4.206 621 HH TYR 77 HH TYR 77 2.208 18.654 -2.745 622 H GLN 78 H GLN 78 -5.138 15.601 -3.386 623 HA GLN 78 HA GLN 78 -4.398 17.866 -4.940 624 HB2 GLN 78 HB2 GLN 78 -6.214 15.516 -5.481 625 HB3 GLN 78 HB3 GLN 78 -5.900 16.774 -6.670 626 HG2 GLN 78 HG2 GLN 78 -3.638 16.188 -6.858 627 HG3 GLN 78 HG3 GLN 78 -3.673 15.232 -5.379 628 HE21 GLN 78 HE21 GLN 78 -4.505 13.152 -5.425 629 HE22 GLN 78 HE22 GLN 78 -4.827 12.315 -6.906 630 H ARG 79 H ARG 79 -7.206 16.971 -3.093 631 HA ARG 79 HA ARG 79 -9.137 18.617 -4.284 632 HB2 ARG 79 HB2 ARG 79 -8.838 17.507 -1.505 633 HB3 ARG 79 HB3 ARG 79 -10.195 18.537 -1.937 634 HG2 ARG 79 HG2 ARG 79 -9.492 15.960 -3.323 635 HG3 ARG 79 HG3 ARG 79 -10.710 16.131 -2.055 636 HD2 ARG 79 HD2 ARG 79 -11.885 17.787 -3.482 637 HD3 ARG 79 HD3 ARG 79 -10.714 17.466 -4.761 638 HE ARG 79 HE ARG 79 -12.331 15.271 -3.675 639 HH11 ARG 79 HH11 ARG 79 -11.397 17.333 -6.357 640 HH12 ARG 79 HH12 ARG 79 -12.221 16.359 -7.541 641 HH21 ARG 79 HH21 ARG 79 -13.425 14.013 -5.215 642 HH22 ARG 79 HH22 ARG 79 -13.374 14.467 -6.886 643 H LEU 80 H LEU 80 -7.109 19.269 -1.421 644 HA LEU 80 HA LEU 80 -8.046 21.946 -1.171 645 HB2 LEU 80 HB2 LEU 80 -6.390 22.224 0.527 646 HB3 LEU 80 HB3 LEU 80 -7.116 20.640 0.710 647 HG LEU 80 HG LEU 80 -4.853 20.247 -0.920 648 HD11 LEU 80 HD11 LEU 80 -3.028 21.140 0.408 649 HD12 LEU 80 HD12 LEU 80 -4.173 21.964 1.466 650 HD13 LEU 80 HD13 LEU 80 -4.031 22.444 -0.228 651 HD21 LEU 80 HD21 LEU 80 -5.755 18.668 0.709 652 HD22 LEU 80 HD22 LEU 80 -5.228 19.718 2.026 653 HD23 LEU 80 HD23 LEU 80 -4.037 18.955 0.974 654 H ARG 81 H ARG 81 -5.565 20.443 -3.043 655 HA ARG 81 HA ARG 81 -4.073 22.843 -3.489 656 HB2 ARG 81 HB2 ARG 81 -3.993 20.077 -4.637 657 HB3 ARG 81 HB3 ARG 81 -3.113 21.376 -5.428 658 HG2 ARG 81 HG2 ARG 81 -2.604 21.369 -2.587 659 HG3 ARG 81 HG3 ARG 81 -2.245 19.799 -3.303 660 HD2 ARG 81 HD2 ARG 81 -0.317 21.386 -3.285 661 HD3 ARG 81 HD3 ARG 81 -0.735 20.773 -4.882 662 HE ARG 81 HE ARG 81 -1.855 22.937 -5.271 663 HH11 ARG 81 HH11 ARG 81 0.609 22.730 -2.788 664 HH12 ARG 81 HH12 ARG 81 1.000 24.413 -2.855 665 HH21 ARG 81 HH21 ARG 81 -1.317 25.154 -5.386 666 HH22 ARG 81 HH22 ARG 81 -0.099 25.795 -4.331 667 H GLU 82 H GLU 82 -6.535 21.026 -5.291 668 HA GLU 82 HA GLU 82 -6.444 22.745 -7.571 669 HB2 GLU 82 HB2 GLU 82 -8.354 21.542 -8.382 670 HB3 GLU 82 HB3 GLU 82 -7.262 20.386 -7.640 671 HG2 GLU 82 HG2 GLU 82 -8.658 20.312 -5.656 672 HG3 GLU 82 HG3 GLU 82 -9.736 21.517 -6.356 673 H GLN 83 H GLN 83 -8.099 22.798 -4.536 674 HA GLN 83 HA GLN 83 -10.146 24.641 -5.255 675 HB2 GLN 83 HB2 GLN 83 -10.218 23.096 -3.296 676 HB3 GLN 83 HB3 GLN 83 -8.983 24.075 -2.521 677 HG2 GLN 83 HG2 GLN 83 -11.236 25.671 -3.395 678 HG3 GLN 83 HG3 GLN 83 -11.722 24.378 -2.298 679 HE21 GLN 83 HE21 GLN 83 -12.202 25.740 -0.610 680 HE22 GLN 83 HE22 GLN 83 -10.992 26.595 0.279 681 H LEU 84 H LEU 84 -6.830 24.925 -4.354 682 HA LEU 84 HA LEU 84 -6.991 27.700 -3.607 683 HB2 LEU 84 HB2 LEU 84 -5.366 26.138 -2.592 684 HB3 LEU 84 HB3 LEU 84 -4.599 25.947 -4.154 685 HG LEU 84 HG LEU 84 -3.888 28.278 -4.144 686 HD11 LEU 84 HD11 LEU 84 -4.192 29.616 -2.041 687 HD12 LEU 84 HD12 LEU 84 -5.409 28.433 -1.556 688 HD13 LEU 84 HD13 LEU 84 -5.638 29.389 -3.023 689 HD21 LEU 84 HD21 LEU 84 -3.199 26.930 -1.532 690 HD22 LEU 84 HD22 LEU 84 -2.286 28.214 -2.319 691 HD23 LEU 84 HD23 LEU 84 -2.414 26.633 -3.085 692 H LYS 85 H LYS 85 -6.892 26.032 -6.509 693 HA LYS 85 HA LYS 85 -5.471 28.137 -7.944 694 HB2 LYS 85 HB2 LYS 85 -6.717 25.635 -9.073 695 HB3 LYS 85 HB3 LYS 85 -5.568 26.698 -9.872 696 HG2 LYS 85 HG2 LYS 85 -3.902 26.081 -8.128 697 HG3 LYS 85 HG3 LYS 85 -5.057 24.895 -7.520 698 HD2 LYS 85 HD2 LYS 85 -3.818 23.575 -8.925 699 HD3 LYS 85 HD3 LYS 85 -5.077 24.119 -10.037 700 HE2 LYS 85 HE2 LYS 85 -3.118 24.456 -11.241 701 HE3 LYS 85 HE3 LYS 85 -3.458 26.052 -10.573 702 HZ1 LYS 85 HZ1 LYS 85 -1.929 25.375 -8.694 703 HZ2 LYS 85 HZ2 LYS 85 -1.197 25.681 -10.188 704 HZ3 LYS 85 HZ3 LYS 85 -1.439 24.090 -9.676 705 H LYS 86 H LYS 86 -8.196 26.371 -9.273 706 HA LYS 86 HA LYS 86 -10.000 28.604 -9.091 707 HB2 LYS 86 HB2 LYS 86 -10.247 28.531 -11.696 708 HB3 LYS 86 HB3 LYS 86 -8.997 29.527 -10.961 709 HG2 LYS 86 HG2 LYS 86 -7.313 28.236 -11.748 710 HG3 LYS 86 HG3 LYS 86 -8.254 26.749 -11.636 711 HD2 LYS 86 HD2 LYS 86 -9.431 28.481 -13.592 712 HD3 LYS 86 HD3 LYS 86 -7.710 28.290 -13.930 713 HE2 LYS 86 HE2 LYS 86 -8.915 26.559 -15.077 714 HE3 LYS 86 HE3 LYS 86 -7.994 25.834 -13.762 715 HZ1 LYS 86 HZ1 LYS 86 -10.903 26.416 -13.775 716 HZ2 LYS 86 HZ2 LYS 86 -10.051 25.857 -12.423 717 HZ3 LYS 86 HZ3 LYS 86 -10.173 24.891 -13.808 718 H1 GLY 1 H1 GLY 1 -36.998 -6.422 18.808 719 H2 GLY 1 H2 GLY 1 -36.268 -7.530 19.854 720 H3 GLY 1 H3 GLY 1 -35.506 -7.109 18.406 721 HA2 GLY 1 HA3 GLY 1 -36.025 -5.267 20.671 722 HA3 GLY 1 HA2 GLY 1 -34.476 -6.014 20.308 723 H SER 2 H SER 2 -35.986 -3.194 20.124 724 HA SER 2 HA SER 2 -34.931 -2.484 17.480 725 HB2 SER 2 HB2 SER 2 -36.851 -0.942 19.240 726 HB3 SER 2 HB3 SER 2 -36.384 -0.528 17.592 727 HG SER 2 HG SER 2 -38.132 -1.649 17.161 728 H HIS 3 H HIS 3 -33.200 -1.223 17.299 729 HA HIS 3 HA HIS 3 -32.417 0.488 19.541 730 HB2 HIS 3 HB2 HIS 3 -30.926 -1.828 18.508 731 HB3 HIS 3 HB3 HIS 3 -29.978 -0.346 18.604 732 HD1 HIS 3 HD1 HIS 3 -31.074 0.823 21.228 733 HD2 HIS 3 HD2 HIS 3 -30.062 -3.174 20.701 734 HE1 HIS 3 HE1 HIS 3 -30.634 -0.071 23.533 735 HE2 HIS 3 HE2 HIS 3 -29.828 -2.428 23.166 736 H MET 4 H MET 4 -30.999 2.242 18.891 737 HA MET 4 HA MET 4 -31.697 3.285 16.336 738 HB2 MET 4 HB2 MET 4 -30.297 4.236 18.721 739 HB3 MET 4 HB3 MET 4 -29.628 4.871 17.223 740 HG2 MET 4 HG2 MET 4 -31.796 5.717 16.579 741 HG3 MET 4 HG3 MET 4 -32.520 5.018 18.025 742 HE1 MET 4 HE1 MET 4 -32.877 8.046 17.162 743 HE2 MET 4 HE2 MET 4 -32.688 8.860 18.717 744 HE3 MET 4 HE3 MET 4 -33.599 7.352 18.610 745 H THR 5 H THR 5 -30.725 3.010 14.463 746 HA THR 5 HA THR 5 -28.128 1.660 14.429 747 HB THR 5 HB THR 5 -29.851 0.477 13.220 748 HG1 THR 5 HG1 THR 5 -28.620 0.096 11.506 749 HG21 THR 5 HG21 THR 5 -30.206 2.967 11.547 750 HG22 THR 5 HG22 THR 5 -31.335 2.396 12.776 751 HG23 THR 5 HG23 THR 5 -31.042 1.430 11.331 752 H GLU 6 H GLU 6 -26.420 2.415 13.179 753 HA GLU 6 HA GLU 6 -26.679 5.183 12.202 754 HB2 GLU 6 HB2 GLU 6 -24.497 5.694 13.040 755 HB3 GLU 6 HB3 GLU 6 -25.411 4.983 14.360 756 HG2 GLU 6 HG2 GLU 6 -23.492 3.416 12.656 757 HG3 GLU 6 HG3 GLU 6 -23.020 4.241 14.140 758 H GLN 7 H GLN 7 -24.441 5.610 10.897 759 HA GLN 7 HA GLN 7 -24.240 3.392 8.968 760 HB2 GLN 7 HB2 GLN 7 -24.302 6.366 8.566 761 HB3 GLN 7 HB3 GLN 7 -23.520 5.325 7.383 762 HG2 GLN 7 HG2 GLN 7 -26.386 5.106 8.271 763 HG3 GLN 7 HG3 GLN 7 -25.829 5.859 6.775 764 HE21 GLN 7 HE21 GLN 7 -27.617 3.588 7.193 765 HE22 GLN 7 HE22 GLN 7 -26.909 2.270 6.326 766 HA PRO 8 HA PRO 8 -19.985 3.893 10.513 767 HB2 PRO 8 HB2 PRO 8 -19.471 1.312 10.970 768 HB3 PRO 8 HB3 PRO 8 -20.508 2.235 12.067 769 HG2 PRO 8 HG2 PRO 8 -21.254 0.249 9.972 770 HG3 PRO 8 HG3 PRO 8 -21.986 0.538 11.558 771 HD2 PRO 8 HD2 PRO 8 -22.923 1.512 9.096 772 HD3 PRO 8 HD3 PRO 8 -23.430 2.070 10.702 773 H LYS 9 H LYS 9 -17.971 2.382 9.792 774 HA LYS 9 HA LYS 9 -17.699 2.742 7.003 775 HB2 LYS 9 HB2 LYS 9 -16.034 1.241 9.022 776 HB3 LYS 9 HB3 LYS 9 -15.584 1.370 7.326 777 HG2 LYS 9 HG2 LYS 9 -15.586 3.831 7.555 778 HG3 LYS 9 HG3 LYS 9 -15.919 3.638 9.277 779 HD2 LYS 9 HD2 LYS 9 -13.562 2.272 8.027 780 HD3 LYS 9 HD3 LYS 9 -13.472 3.978 8.476 781 HE2 LYS 9 HE2 LYS 9 -14.005 3.441 10.770 782 HE3 LYS 9 HE3 LYS 9 -14.242 1.744 10.350 783 HZ1 LYS 9 HZ1 LYS 9 -12.057 2.226 11.366 784 HZ2 LYS 9 HZ2 LYS 9 -11.668 3.192 10.033 785 HZ3 LYS 9 HZ3 LYS 9 -11.935 1.534 9.829 786 H THR 10 H THR 10 -18.204 1.437 5.357 787 HA THR 10 HA THR 10 -19.401 -1.139 5.971 788 HB THR 10 HB THR 10 -20.543 0.508 4.448 789 HG1 THR 10 HG1 THR 10 -21.435 -1.150 3.426 790 HG21 THR 10 HG21 THR 10 -19.769 0.529 2.073 791 HG22 THR 10 HG22 THR 10 -18.278 -0.250 2.596 792 HG23 THR 10 HG23 THR 10 -18.682 1.363 3.182 793 H ARG 11 H ARG 11 -18.966 -2.885 4.274 794 HA ARG 11 HA ARG 11 -16.073 -3.010 3.764 795 HB2 ARG 11 HB2 ARG 11 -16.086 -5.358 4.267 796 HB3 ARG 11 HB3 ARG 11 -16.826 -4.509 5.616 797 HG2 ARG 11 HG2 ARG 11 -19.060 -5.084 4.594 798 HG3 ARG 11 HG3 ARG 11 -18.178 -6.154 3.501 799 HD2 ARG 11 HD2 ARG 11 -17.138 -7.120 5.655 800 HD3 ARG 11 HD3 ARG 11 -18.482 -6.330 6.475 801 HE ARG 11 HE ARG 11 -19.353 -7.950 4.287 802 HH11 ARG 11 HH11 ARG 11 -18.341 -7.999 7.632 803 HH12 ARG 11 HH12 ARG 11 -19.158 -9.483 8.002 804 HH21 ARG 11 HH21 ARG 11 -20.429 -9.936 4.764 805 HH22 ARG 11 HH22 ARG 11 -20.351 -10.572 6.376 806 H VAL 12 H VAL 12 -15.420 -4.154 1.891 807 HA VAL 12 HA VAL 12 -17.567 -4.660 -0.065 808 HB VAL 12 HB VAL 12 -16.540 -2.414 -0.444 809 HG11 VAL 12 HG11 VAL 12 -14.300 -2.743 0.260 810 HG12 VAL 12 HG12 VAL 12 -14.253 -2.382 -1.465 811 HG13 VAL 12 HG13 VAL 12 -14.057 -4.042 -0.903 812 HG21 VAL 12 HG21 VAL 12 -17.577 -3.476 -2.309 813 HG22 VAL 12 HG22 VAL 12 -16.172 -4.504 -2.580 814 HG23 VAL 12 HG23 VAL 12 -16.064 -2.769 -2.875 815 H SER 13 H SER 13 -17.148 -6.291 -1.563 816 HA SER 13 HA SER 13 -14.759 -7.912 -0.998 817 HB2 SER 13 HB2 SER 13 -16.566 -9.533 -2.363 818 HB3 SER 13 HB3 SER 13 -16.258 -9.550 -0.626 819 HG SER 13 HG SER 13 -18.196 -7.952 -1.961 820 H VAL 14 H VAL 14 -13.259 -7.720 -2.545 821 HA VAL 14 HA VAL 14 -14.176 -7.471 -5.337 822 HB VAL 14 HB VAL 14 -12.153 -6.152 -5.841 823 HG11 VAL 14 HG11 VAL 14 -14.279 -5.031 -5.423 824 HG12 VAL 14 HG12 VAL 14 -12.917 -4.048 -4.886 825 HG13 VAL 14 HG13 VAL 14 -13.888 -4.927 -3.706 826 HG21 VAL 14 HG21 VAL 14 -11.777 -6.018 -2.849 827 HG22 VAL 14 HG22 VAL 14 -10.824 -5.167 -4.062 828 HG23 VAL 14 HG23 VAL 14 -10.759 -6.925 -3.968 829 H ARG 15 H ARG 15 -12.836 -8.416 -6.931 830 HA ARG 15 HA ARG 15 -11.408 -10.755 -5.937 831 HB2 ARG 15 HB2 ARG 15 -13.128 -11.225 -7.539 832 HB3 ARG 15 HB3 ARG 15 -12.485 -10.034 -8.658 833 HG2 ARG 15 HG2 ARG 15 -10.505 -11.398 -9.004 834 HG3 ARG 15 HG3 ARG 15 -11.098 -12.575 -7.830 835 HD2 ARG 15 HD2 ARG 15 -11.497 -13.189 -10.222 836 HD3 ARG 15 HD3 ARG 15 -12.943 -13.148 -9.214 837 HE ARG 15 HE ARG 15 -12.263 -10.799 -10.833 838 HH11 ARG 15 HH11 ARG 15 -14.386 -13.508 -10.182 839 HH12 ARG 15 HH12 ARG 15 -15.653 -12.919 -11.205 840 HH21 ARG 15 HH21 ARG 15 -13.925 -10.020 -12.170 841 HH22 ARG 15 HH22 ARG 15 -15.397 -10.922 -12.332 842 H ILE 16 H ILE 16 -9.259 -10.862 -5.922 843 HA ILE 16 HA ILE 16 -7.763 -9.172 -7.810 844 HB ILE 16 HB ILE 16 -6.955 -9.648 -4.938 845 HG12 ILE 16 HG12 ILE 16 -7.784 -7.007 -6.138 846 HG13 ILE 16 HG13 ILE 16 -8.944 -8.074 -5.351 847 HG21 ILE 16 HG21 ILE 16 -5.127 -9.409 -6.614 848 HG22 ILE 16 HG22 ILE 16 -5.126 -8.168 -5.364 849 HG23 ILE 16 HG23 ILE 16 -5.739 -7.795 -6.975 850 HD11 ILE 16 HD11 ILE 16 -8.209 -6.388 -3.805 851 HD12 ILE 16 HD12 ILE 16 -6.521 -6.815 -4.087 852 HD13 ILE 16 HD13 ILE 16 -7.599 -7.962 -3.291 853 H TYR 17 H TYR 17 -6.629 -10.398 -9.089 854 HA TYR 17 HA TYR 17 -5.335 -12.038 -9.928 855 HB2 TYR 17 HB2 TYR 17 -4.139 -11.424 -7.589 856 HB3 TYR 17 HB3 TYR 17 -4.471 -13.131 -7.321 857 HD1 TYR 17 HD1 TYR 17 -3.230 -11.012 -10.147 858 HD2 TYR 17 HD2 TYR 17 -2.712 -14.533 -7.816 859 HE1 TYR 17 HE1 TYR 17 -1.246 -11.594 -11.476 860 HE2 TYR 17 HE2 TYR 17 -0.729 -15.122 -9.142 861 HH TYR 17 HH TYR 17 0.212 -14.678 -11.325 862 H GLY 18 H GLY 18 -8.137 -12.611 -9.073 863 HA2 GLY 18 HA2 GLY 18 -9.090 -14.702 -9.969 864 HA3 GLY 18 HA3 GLY 18 -7.858 -15.552 -9.055 865 H GLN 19 H GLN 19 -8.014 -14.527 -6.569 866 HA GLN 19 HA GLN 19 -10.643 -15.481 -5.741 867 HB2 GLN 19 HB2 GLN 19 -8.217 -14.865 -4.045 868 HB3 GLN 19 HB3 GLN 19 -9.680 -15.669 -3.505 869 HG2 GLN 19 HG2 GLN 19 -8.242 -17.429 -3.805 870 HG3 GLN 19 HG3 GLN 19 -9.113 -17.406 -5.335 871 HE21 GLN 19 HE21 GLN 19 -6.575 -15.140 -4.408 872 HE22 GLN 19 HE22 GLN 19 -5.425 -15.677 -5.585 873 H ASP 20 H ASP 20 -12.017 -14.359 -4.351 874 HA ASP 20 HA ASP 20 -11.519 -11.466 -4.277 875 HB2 ASP 20 HB2 ASP 20 -13.895 -11.087 -4.208 876 HB3 ASP 20 HB3 ASP 20 -13.545 -12.164 -5.551 877 H TYR 21 H TYR 21 -11.695 -10.319 -2.424 878 HA TYR 21 HA TYR 21 -12.200 -11.832 0.049 879 HB2 TYR 21 HB2 TYR 21 -10.044 -9.759 0.022 880 HB3 TYR 21 HB3 TYR 21 -10.225 -11.167 1.060 881 HD1 TYR 21 HD2 TYR 21 -9.696 -13.450 0.107 882 HD2 TYR 21 HD1 TYR 21 -8.733 -9.843 -1.930 883 HE1 TYR 21 HE2 TYR 21 -8.111 -14.678 -1.310 884 HE2 TYR 21 HE1 TYR 21 -7.143 -11.068 -3.348 885 HH TYR 21 HH TYR 21 -6.033 -13.003 -3.623 886 H THR 22 H THR 22 -12.669 -10.428 1.903 887 HA THR 22 HA THR 22 -14.141 -8.050 1.042 888 HB THR 22 HB THR 22 -14.593 -8.851 3.795 889 HG1 THR 22 HG1 THR 22 -15.738 -10.833 3.100 890 HG21 THR 22 HG21 THR 22 -16.076 -7.396 2.481 891 HG22 THR 22 HG22 THR 22 -16.927 -8.825 3.066 892 HG23 THR 22 HG23 THR 22 -16.408 -8.733 1.383 893 H ILE 23 H ILE 23 -13.388 -6.103 1.530 894 HA ILE 23 HA ILE 23 -11.596 -5.823 3.848 895 HB ILE 23 HB ILE 23 -10.393 -4.012 2.657 896 HG12 ILE 23 HG12 ILE 23 -12.339 -3.863 0.893 897 HG13 ILE 23 HG13 ILE 23 -10.689 -3.466 0.447 898 HG21 ILE 23 HG21 ILE 23 -10.225 -6.788 1.524 899 HG22 ILE 23 HG22 ILE 23 -9.327 -6.111 2.881 900 HG23 ILE 23 HG23 ILE 23 -9.020 -5.529 1.248 901 HD11 ILE 23 HD11 ILE 23 -10.429 -5.488 -0.745 902 HD12 ILE 23 HD12 ILE 23 -12.004 -4.844 -1.197 903 HD13 ILE 23 HD13 ILE 23 -11.896 -6.173 -0.049 904 H VAL 24 H VAL 24 -11.370 -3.336 4.336 905 HA VAL 24 HA VAL 24 -14.082 -2.440 4.807 906 HB VAL 24 HB VAL 24 -11.405 -1.424 5.782 907 HG11 VAL 24 HG11 VAL 24 -12.710 0.065 7.286 908 HG12 VAL 24 HG12 VAL 24 -14.166 -0.357 6.386 909 HG13 VAL 24 HG13 VAL 24 -12.851 0.499 5.583 910 HG21 VAL 24 HG21 VAL 24 -12.165 -3.527 6.767 911 HG22 VAL 24 HG22 VAL 24 -13.697 -2.774 7.212 912 HG23 VAL 24 HG23 VAL 24 -12.193 -2.224 7.955 913 H GLY 25 H GLY 25 -15.103 -0.929 3.656 914 HA2 GLY 25 HA2 GLY 25 -13.519 0.650 1.734 915 HA3 GLY 25 HA3 GLY 25 -15.222 0.249 1.552 916 H ALA 26 H ALA 26 -12.912 2.213 3.317 917 HA ALA 26 HA ALA 26 -15.031 3.786 4.552 918 HB1 ALA 26 HB1 ALA 26 -12.028 3.932 4.779 919 HB2 ALA 26 HB2 ALA 26 -13.156 3.244 5.950 920 HB3 ALA 26 HB3 ALA 26 -13.148 4.982 5.645 921 H GLU 27 H GLU 27 -14.747 3.831 1.669 922 HA GLU 27 HA GLU 27 -14.599 6.702 1.312 923 HB2 GLU 27 HB2 GLU 27 -12.404 5.073 0.589 924 HB3 GLU 27 HB3 GLU 27 -13.215 5.499 -0.911 925 HG2 GLU 27 HG2 GLU 27 -12.158 7.398 1.172 926 HG3 GLU 27 HG3 GLU 27 -11.492 7.110 -0.433 927 H SER 28 H SER 28 -14.847 6.878 -1.383 928 HA SER 28 HA SER 28 -17.519 6.240 -1.856 929 HB2 SER 28 HB2 SER 28 -15.473 6.685 -4.030 930 HB3 SER 28 HB3 SER 28 -17.182 7.119 -4.037 931 HG SER 28 HG SER 28 -15.134 8.267 -2.421 932 HA PRO 29 HA PRO 29 -17.650 1.928 -2.762 933 HB2 PRO 29 HB2 PRO 29 -19.591 2.090 -4.774 934 HB3 PRO 29 HB3 PRO 29 -19.888 1.901 -3.046 935 HG2 PRO 29 HG2 PRO 29 -19.949 4.363 -4.724 936 HG3 PRO 29 HG3 PRO 29 -20.968 3.914 -3.344 937 HD2 PRO 29 HD2 PRO 29 -19.009 5.718 -3.101 938 HD3 PRO 29 HD3 PRO 29 -19.364 4.565 -1.794 939 H ALA 30 H ALA 30 -17.415 4.174 -5.504 940 HA ALA 30 HA ALA 30 -16.430 2.086 -7.253 941 HB1 ALA 30 HB1 ALA 30 -16.374 3.733 -8.964 942 HB2 ALA 30 HB2 ALA 30 -16.464 5.046 -7.791 943 HB3 ALA 30 HB3 ALA 30 -17.852 3.988 -8.040 944 H HIS 31 H HIS 31 -15.101 4.569 -5.219 945 HA HIS 31 HA HIS 31 -12.518 4.693 -6.385 946 HB2 HIS 31 HB2 HIS 31 -13.514 6.380 -4.785 947 HB3 HIS 31 HB3 HIS 31 -13.211 5.227 -3.492 948 HD1 HIS 31 HD1 HIS 31 -11.145 6.859 -6.249 949 HD2 HIS 31 HD2 HIS 31 -10.878 5.738 -2.263 950 HE1 HIS 31 HE1 HIS 31 -8.872 7.607 -5.492 951 HE2 HIS 31 HE2 HIS 31 -8.907 7.230 -3.002 952 H ILE 32 H ILE 32 -14.020 2.621 -4.035 953 HA ILE 32 HA ILE 32 -11.545 1.276 -3.349 954 HB ILE 32 HB ILE 32 -12.851 -0.114 -1.873 955 HG12 ILE 32 HG12 ILE 32 -15.273 1.114 -3.232 956 HG13 ILE 32 HG13 ILE 32 -14.815 -0.580 -3.198 957 HG21 ILE 32 HG21 ILE 32 -12.262 2.220 -1.225 958 HG22 ILE 32 HG22 ILE 32 -13.649 1.561 -0.362 959 HG23 ILE 32 HG23 ILE 32 -13.895 2.709 -1.679 960 HD11 ILE 32 HD11 ILE 32 -16.621 -0.327 -1.719 961 HD12 ILE 32 HD12 ILE 32 -15.911 1.097 -0.964 962 HD13 ILE 32 HD13 ILE 32 -15.190 -0.493 -0.703 963 H ARG 33 H ARG 33 -13.247 1.213 -6.055 964 HA ARG 33 HA ARG 33 -13.167 -1.686 -6.431 965 HB2 ARG 33 HB2 ARG 33 -14.734 0.461 -7.564 966 HB3 ARG 33 HB3 ARG 33 -13.950 -0.461 -8.837 967 HG2 ARG 33 HG2 ARG 33 -16.127 -1.374 -8.419 968 HG3 ARG 33 HG3 ARG 33 -14.904 -2.527 -7.882 969 HD2 ARG 33 HD2 ARG 33 -15.201 -1.762 -5.575 970 HD3 ARG 33 HD3 ARG 33 -16.423 -0.613 -6.115 971 HE ARG 33 HE ARG 33 -16.871 -3.447 -6.675 972 HH11 ARG 33 HH11 ARG 33 -17.624 -0.611 -4.774 973 HH12 ARG 33 HH12 ARG 33 -19.107 -1.259 -4.148 974 HH21 ARG 33 HH21 ARG 33 -18.821 -4.318 -5.850 975 HH22 ARG 33 HH22 ARG 33 -19.788 -3.370 -4.762 976 H LEU 34 H LEU 34 -11.762 1.307 -7.679 977 HA LEU 34 HA LEU 34 -10.189 0.088 -9.681 978 HB2 LEU 34 HB2 LEU 34 -8.945 2.185 -9.757 979 HB3 LEU 34 HB3 LEU 34 -10.672 2.469 -9.729 980 HG LEU 34 HG LEU 34 -10.116 2.679 -7.085 981 HD11 LEU 34 HD11 LEU 34 -8.081 4.003 -6.834 982 HD12 LEU 34 HD12 LEU 34 -7.698 3.755 -8.537 983 HD13 LEU 34 HD13 LEU 34 -7.712 2.384 -7.428 984 HD21 LEU 34 HD21 LEU 34 -10.241 5.085 -7.420 985 HD22 LEU 34 HD22 LEU 34 -11.388 4.250 -8.470 986 HD23 LEU 34 HD23 LEU 34 -9.879 4.879 -9.135 987 H VAL 35 H VAL 35 -9.816 0.408 -6.270 988 HA VAL 35 HA VAL 35 -7.051 0.115 -5.979 989 HB VAL 35 HB VAL 35 -9.116 -1.108 -4.145 990 HG11 VAL 35 HG11 VAL 35 -6.751 -1.705 -3.756 991 HG12 VAL 35 HG12 VAL 35 -7.460 -0.795 -2.423 992 HG13 VAL 35 HG13 VAL 35 -6.381 0.009 -3.564 993 HG21 VAL 35 HG21 VAL 35 -8.077 1.721 -4.104 994 HG22 VAL 35 HG22 VAL 35 -9.194 1.000 -2.950 995 HG23 VAL 35 HG23 VAL 35 -9.690 1.240 -4.625 996 H ALA 36 H ALA 36 -9.624 -2.224 -6.392 997 HA ALA 36 HA ALA 36 -8.181 -4.581 -5.995 998 HB1 ALA 36 HB1 ALA 36 -10.661 -4.360 -6.205 999 HB2 ALA 36 HB2 ALA 36 -9.962 -5.704 -7.105 1000 HB3 ALA 36 HB3 ALA 36 -10.440 -4.231 -7.948 1001 H ALA 37 H ALA 37 -8.839 -2.817 -9.016 1002 HA ALA 37 HA ALA 37 -7.387 -4.556 -10.706 1003 HB1 ALA 37 HB1 ALA 37 -9.098 -2.956 -11.504 1004 HB2 ALA 37 HB2 ALA 37 -7.572 -2.815 -12.376 1005 HB3 ALA 37 HB3 ALA 37 -7.995 -1.631 -11.141 1006 H PHE 38 H PHE 38 -6.485 -1.809 -8.752 1007 HA PHE 38 HA PHE 38 -3.960 -1.287 -9.883 1008 HB2 PHE 38 HB2 PHE 38 -5.118 0.285 -8.386 1009 HB3 PHE 38 HB3 PHE 38 -4.921 -0.840 -7.047 1010 HD1 PHE 38 HD1 PHE 38 -3.063 1.294 -9.432 1011 HD2 PHE 38 HD2 PHE 38 -2.961 -0.848 -5.758 1012 HE1 PHE 38 HE1 PHE 38 -0.896 2.331 -8.891 1013 HE2 PHE 38 HE2 PHE 38 -0.798 0.182 -5.212 1014 HZ PHE 38 HZ PHE 38 0.241 1.775 -6.782 1015 H VAL 39 H VAL 39 -4.931 -3.336 -7.148 1016 HA VAL 39 HA VAL 39 -2.254 -4.197 -6.598 1017 HB VAL 39 HB VAL 39 -4.859 -5.463 -5.722 1018 HG11 VAL 39 HG11 VAL 39 -3.541 -6.475 -3.935 1019 HG12 VAL 39 HG12 VAL 39 -2.074 -5.747 -4.591 1020 HG13 VAL 39 HG13 VAL 39 -2.941 -6.973 -5.518 1021 HG21 VAL 39 HG21 VAL 39 -4.479 -4.258 -3.603 1022 HG22 VAL 39 HG22 VAL 39 -4.766 -3.172 -4.961 1023 HG23 VAL 39 HG23 VAL 39 -3.127 -3.408 -4.353 1024 H ASP 40 H ASP 40 -4.962 -5.428 -8.453 1025 HA ASP 40 HA ASP 40 -4.055 -8.021 -8.974 1026 HB2 ASP 40 HB2 ASP 40 -6.325 -6.868 -9.538 1027 HB3 ASP 40 HB3 ASP 40 -5.526 -6.393 -11.033 1028 H ASP 41 H ASP 41 -3.567 -5.020 -10.803 1029 HA ASP 41 HA ASP 41 -1.897 -6.203 -12.782 1030 HB2 ASP 41 HB2 ASP 41 -3.097 -4.150 -13.263 1031 HB3 ASP 41 HB3 ASP 41 -2.254 -3.315 -11.961 1032 H LYS 42 H LYS 42 -1.291 -4.484 -9.773 1033 HA LYS 42 HA LYS 42 1.457 -4.100 -9.998 1034 HB2 LYS 42 HB2 LYS 42 -0.230 -3.283 -8.194 1035 HB3 LYS 42 HB3 LYS 42 0.174 -4.780 -7.370 1036 HG2 LYS 42 HG2 LYS 42 1.876 -3.703 -6.441 1037 HG3 LYS 42 HG3 LYS 42 2.635 -3.664 -8.032 1038 HD2 LYS 42 HD2 LYS 42 0.608 -1.581 -7.507 1039 HD3 LYS 42 HD3 LYS 42 2.103 -1.465 -6.579 1040 HE2 LYS 42 HE2 LYS 42 2.158 -1.873 -9.545 1041 HE3 LYS 42 HE3 LYS 42 1.949 -0.263 -8.859 1042 HZ1 LYS 42 HZ1 LYS 42 4.182 -1.998 -7.998 1043 HZ2 LYS 42 HZ2 LYS 42 4.049 -0.306 -7.895 1044 HZ3 LYS 42 HZ3 LYS 42 4.302 -1.052 -9.397 1045 H MET 43 H MET 43 -0.338 -6.933 -8.858 1046 HA MET 43 HA MET 43 2.007 -8.349 -8.046 1047 HB2 MET 43 HB2 MET 43 -0.788 -8.762 -7.860 1048 HB3 MET 43 HB3 MET 43 -0.122 -10.155 -8.704 1049 HG2 MET 43 HG2 MET 43 1.552 -10.345 -6.840 1050 HG3 MET 43 HG3 MET 43 0.612 -9.124 -5.980 1051 HE1 MET 43 HE1 MET 43 -2.391 -10.008 -7.006 1052 HE2 MET 43 HE2 MET 43 -1.966 -9.432 -5.394 1053 HE3 MET 43 HE3 MET 43 -2.850 -10.947 -5.584 1054 H HIS 44 H HIS 44 0.351 -7.927 -11.045 1055 HA HIS 44 HA HIS 44 1.302 -10.238 -12.370 1056 HB2 HIS 44 HB2 HIS 44 0.041 -7.684 -13.216 1057 HB3 HIS 44 HB3 HIS 44 0.948 -8.568 -14.440 1058 HD1 HIS 44 HD1 HIS 44 0.174 -11.272 -14.503 1059 HD2 HIS 44 HD2 HIS 44 -2.543 -8.445 -13.120 1060 HE1 HIS 44 HE1 HIS 44 -2.088 -12.347 -14.715 1061 HE2 HIS 44 HE2 HIS 44 -3.711 -10.643 -13.817 1062 H GLU 45 H GLU 45 2.762 -7.101 -11.756 1063 HA GLU 45 HA GLU 45 4.804 -7.389 -13.732 1064 HB2 GLU 45 HB2 GLU 45 5.758 -5.408 -12.890 1065 HB3 GLU 45 HB3 GLU 45 4.028 -5.202 -12.679 1066 HG2 GLU 45 HG2 GLU 45 4.171 -5.541 -10.341 1067 HG3 GLU 45 HG3 GLU 45 5.817 -6.163 -10.459 1068 H PHE 46 H PHE 46 4.582 -8.148 -10.293 1069 HA PHE 46 HA PHE 46 7.342 -8.884 -10.098 1070 HB2 PHE 46 HB2 PHE 46 4.984 -9.040 -8.264 1071 HB3 PHE 46 HB3 PHE 46 6.441 -9.952 -7.883 1072 HD1 PHE 46 HD1 PHE 46 8.654 -8.356 -8.422 1073 HD2 PHE 46 HD2 PHE 46 4.825 -7.089 -7.068 1074 HE1 PHE 46 HE1 PHE 46 9.669 -6.342 -7.446 1075 HE2 PHE 46 HE2 PHE 46 5.836 -5.073 -6.089 1076 HZ PHE 46 HZ PHE 46 8.259 -4.697 -6.281 1077 H SER 47 H SER 47 4.423 -10.507 -10.992 1078 HA SER 47 HA SER 47 5.244 -13.160 -10.521 1079 HB2 SER 47 HB2 SER 47 3.244 -11.964 -12.438 1080 HB3 SER 47 HB3 SER 47 3.515 -13.704 -12.320 1081 HG SER 47 HG SER 47 1.799 -12.998 -10.965 1082 H GLU 48 H GLU 48 6.158 -10.858 -12.894 1083 HA GLU 48 HA GLU 48 7.210 -12.851 -14.727 1084 HB2 GLU 48 HB2 GLU 48 6.241 -10.820 -15.670 1085 HB3 GLU 48 HB3 GLU 48 7.369 -9.828 -14.751 1086 HG2 GLU 48 HG2 GLU 48 9.218 -10.621 -16.027 1087 HG3 GLU 48 HG3 GLU 48 8.221 -11.839 -16.823 1088 H LYS 49 H LYS 49 8.265 -10.759 -12.158 1089 HA LYS 49 HA LYS 49 11.058 -10.934 -12.699 1090 HB2 LYS 49 HB2 LYS 49 9.686 -10.315 -10.074 1091 HB3 LYS 49 HB3 LYS 49 11.373 -10.007 -10.461 1092 HG2 LYS 49 HG2 LYS 49 8.966 -8.682 -11.697 1093 HG3 LYS 49 HG3 LYS 49 10.129 -7.953 -10.587 1094 HD2 LYS 49 HD2 LYS 49 11.897 -8.479 -12.344 1095 HD3 LYS 49 HD3 LYS 49 10.550 -8.812 -13.438 1096 HE2 LYS 49 HE2 LYS 49 9.704 -6.470 -12.710 1097 HE3 LYS 49 HE3 LYS 49 11.368 -6.217 -12.182 1098 HZ1 LYS 49 HZ1 LYS 49 10.441 -6.853 -14.927 1099 HZ2 LYS 49 HZ2 LYS 49 12.069 -6.806 -14.466 1100 HZ3 LYS 49 HZ3 LYS 49 11.126 -5.404 -14.390 1101 H GLN 50 H GLN 50 8.841 -12.635 -10.543 1102 HA GLN 50 HA GLN 50 8.956 -14.604 -9.426 1103 HB2 GLN 50 HB2 GLN 50 11.063 -15.305 -11.481 1104 HB3 GLN 50 HB3 GLN 50 10.144 -16.439 -10.504 1105 HG2 GLN 50 HG2 GLN 50 8.240 -16.185 -11.743 1106 HG3 GLN 50 HG3 GLN 50 8.652 -14.544 -12.241 1107 HE21 GLN 50 HE21 GLN 50 7.765 -16.752 -13.881 1108 HE22 GLN 50 HE22 GLN 50 9.013 -17.035 -15.046 1109 HA PRO 51 HA PRO 51 12.770 -13.257 -7.158 1110 HB2 PRO 51 HB2 PRO 51 11.053 -12.999 -4.832 1111 HB3 PRO 51 HB3 PRO 51 12.017 -11.763 -5.639 1112 HG2 PRO 51 HG2 PRO 51 9.297 -11.804 -5.675 1113 HG3 PRO 51 HG3 PRO 51 10.283 -11.086 -6.960 1114 HD2 PRO 51 HD2 PRO 51 8.898 -13.737 -6.885 1115 HD3 PRO 51 HD3 PRO 51 9.076 -12.593 -8.234 1116 H MET 52 H MET 52 10.354 -14.686 -4.998 1117 HA MET 52 HA MET 52 12.258 -16.831 -4.401 1118 HB2 MET 52 HB2 MET 52 9.731 -16.283 -2.855 1119 HB3 MET 52 HB3 MET 52 11.187 -17.105 -2.318 1120 HG2 MET 52 HG2 MET 52 10.875 -14.155 -2.836 1121 HG3 MET 52 HG3 MET 52 11.028 -14.946 -1.266 1122 HE1 MET 52 HE1 MET 52 12.924 -12.997 -0.883 1123 HE2 MET 52 HE2 MET 52 12.811 -12.464 -2.560 1124 HE3 MET 52 HE3 MET 52 14.381 -12.871 -1.866 1125 H LEU 53 H LEU 53 9.869 -16.311 -6.456 1126 HA LEU 53 HA LEU 53 8.315 -17.502 -7.592 1127 HB2 LEU 53 HB2 LEU 53 10.361 -19.605 -6.933 1128 HB3 LEU 53 HB3 LEU 53 8.976 -19.940 -7.956 1129 HG LEU 53 HG LEU 53 10.139 -17.607 -8.997 1130 HD11 LEU 53 HD11 LEU 53 12.433 -18.325 -9.479 1131 HD12 LEU 53 HD12 LEU 53 12.219 -19.696 -8.389 1132 HD13 LEU 53 HD13 LEU 53 12.167 -18.050 -7.757 1133 HD21 LEU 53 HD21 LEU 53 10.612 -19.040 -10.928 1134 HD22 LEU 53 HD22 LEU 53 8.992 -19.312 -10.285 1135 HD23 LEU 53 HD23 LEU 53 10.283 -20.464 -9.942 1136 H ASP 54 H ASP 54 6.990 -16.986 -5.576 1137 HA ASP 54 HA ASP 54 5.449 -19.317 -4.958 1138 HB2 ASP 54 HB2 ASP 54 7.350 -19.342 -3.261 1139 HB3 ASP 54 HB3 ASP 54 6.663 -17.858 -2.609 1140 H VAL 55 H VAL 55 3.387 -18.775 -4.165 1141 HA VAL 55 HA VAL 55 2.417 -16.268 -4.996 1142 HB VAL 55 HB VAL 55 0.973 -18.164 -3.149 1143 HG11 VAL 55 HG11 VAL 55 -0.025 -16.117 -5.129 1144 HG12 VAL 55 HG12 VAL 55 -0.086 -15.988 -3.371 1145 HG13 VAL 55 HG13 VAL 55 -1.034 -17.224 -4.197 1146 HG21 VAL 55 HG21 VAL 55 1.826 -19.360 -5.109 1147 HG22 VAL 55 HG22 VAL 55 1.055 -18.177 -6.164 1148 HG23 VAL 55 HG23 VAL 55 0.070 -19.224 -5.143 1149 HA PRO 56 HA PRO 56 1.770 -15.104 -0.300 1150 HB2 PRO 56 HB2 PRO 56 3.618 -16.302 1.387 1151 HB3 PRO 56 HB3 PRO 56 1.920 -16.763 1.238 1152 HG2 PRO 56 HG2 PRO 56 4.335 -17.992 -0.008 1153 HG3 PRO 56 HG3 PRO 56 2.882 -18.777 0.639 1154 HD2 PRO 56 HD2 PRO 56 3.263 -18.485 -1.995 1155 HD3 PRO 56 HD3 PRO 56 1.647 -18.348 -1.270 1156 H LYS 57 H LYS 57 5.010 -16.025 -1.389 1157 HA LYS 57 HA LYS 57 6.318 -13.814 -0.148 1158 HB2 LYS 57 HB2 LYS 57 7.119 -15.863 -2.182 1159 HB3 LYS 57 HB3 LYS 57 8.147 -14.468 -1.901 1160 HG2 LYS 57 HG2 LYS 57 9.025 -16.146 -0.536 1161 HG3 LYS 57 HG3 LYS 57 8.098 -15.120 0.560 1162 HD2 LYS 57 HD2 LYS 57 6.559 -16.730 0.976 1163 HD3 LYS 57 HD3 LYS 57 6.635 -17.378 -0.663 1164 HE2 LYS 57 HE2 LYS 57 8.848 -18.364 -0.097 1165 HE3 LYS 57 HE3 LYS 57 8.616 -17.827 1.565 1166 HZ1 LYS 57 HZ1 LYS 57 6.724 -19.633 0.150 1167 HZ2 LYS 57 HZ2 LYS 57 6.758 -19.260 1.804 1168 HZ3 LYS 57 HZ3 LYS 57 7.996 -20.184 1.126 1169 H LEU 58 H LEU 58 4.504 -14.213 -3.008 1170 HA LEU 58 HA LEU 58 5.657 -11.923 -4.369 1171 HB2 LEU 58 HB2 LEU 58 4.754 -14.066 -5.461 1172 HB3 LEU 58 HB3 LEU 58 3.160 -13.407 -5.142 1173 HG LEU 58 HG LEU 58 4.248 -11.309 -6.425 1174 HD11 LEU 58 HD11 LEU 58 5.540 -12.186 -8.338 1175 HD12 LEU 58 HD12 LEU 58 5.606 -13.757 -7.544 1176 HD13 LEU 58 HD13 LEU 58 6.385 -12.360 -6.801 1177 HD21 LEU 58 HD21 LEU 58 3.083 -12.113 -8.410 1178 HD22 LEU 58 HD22 LEU 58 2.146 -12.434 -6.950 1179 HD23 LEU 58 HD23 LEU 58 3.034 -13.740 -7.731 1180 H ALA 59 H ALA 59 2.563 -12.853 -2.912 1181 HA ALA 59 HA ALA 59 1.197 -10.454 -3.358 1182 HB1 ALA 59 HB1 ALA 59 0.811 -12.482 -1.162 1183 HB2 ALA 59 HB2 ALA 59 0.047 -12.493 -2.753 1184 HB3 ALA 59 HB3 ALA 59 -0.338 -11.218 -1.598 1185 H VAL 60 H VAL 60 3.327 -11.415 -0.706 1186 HA VAL 60 HA VAL 60 2.745 -9.099 0.879 1187 HB VAL 60 HB VAL 60 3.611 -11.242 1.847 1188 HG11 VAL 60 HG11 VAL 60 6.198 -10.345 0.584 1189 HG12 VAL 60 HG12 VAL 60 5.300 -11.821 0.239 1190 HG13 VAL 60 HG13 VAL 60 6.061 -11.602 1.811 1191 HG21 VAL 60 HG21 VAL 60 5.199 -8.744 2.425 1192 HG22 VAL 60 HG22 VAL 60 5.119 -10.160 3.472 1193 HG23 VAL 60 HG23 VAL 60 3.665 -9.215 3.155 1194 H LEU 61 H LEU 61 4.926 -9.847 -1.702 1195 HA LEU 61 HA LEU 61 6.805 -7.774 -1.246 1196 HB2 LEU 61 HB2 LEU 61 7.044 -9.851 -2.728 1197 HB3 LEU 61 HB3 LEU 61 6.126 -8.962 -3.928 1198 HG LEU 61 HG LEU 61 7.883 -7.229 -3.978 1199 HD11 LEU 61 HD11 LEU 61 9.093 -8.979 -1.872 1200 HD12 LEU 61 HD12 LEU 61 8.907 -7.225 -1.893 1201 HD13 LEU 61 HD13 LEU 61 10.113 -7.996 -2.921 1202 HD21 LEU 61 HD21 LEU 61 9.597 -8.593 -5.091 1203 HD22 LEU 61 HD22 LEU 61 7.964 -9.056 -5.574 1204 HD23 LEU 61 HD23 LEU 61 8.859 -10.047 -4.421 1205 H THR 62 H THR 62 3.800 -8.016 -3.059 1206 HA THR 62 HA THR 62 3.960 -5.467 -4.276 1207 HB THR 62 HB THR 62 1.273 -5.914 -4.079 1208 HG1 THR 62 HG1 THR 62 1.494 -7.858 -2.938 1209 HG21 THR 62 HG21 THR 62 1.348 -6.677 -6.289 1210 HG22 THR 62 HG22 THR 62 2.923 -7.430 -6.068 1211 HG23 THR 62 HG23 THR 62 2.788 -5.671 -6.127 1212 H ALA 63 H ALA 63 2.675 -6.643 -1.232 1213 HA ALA 63 HA ALA 63 1.247 -4.377 -0.430 1214 HB1 ALA 63 HB1 ALA 63 1.390 -5.279 1.821 1215 HB2 ALA 63 HB2 ALA 63 2.695 -6.357 1.328 1216 HB3 ALA 63 HB3 ALA 63 1.075 -6.575 0.666 1217 H VAL 64 H VAL 64 4.621 -5.298 0.250 1218 HA VAL 64 HA VAL 64 5.156 -2.919 1.711 1219 HB VAL 64 HB VAL 64 6.410 -5.078 1.971 1220 HG11 VAL 64 HG11 VAL 64 7.780 -4.169 -0.553 1221 HG12 VAL 64 HG12 VAL 64 6.804 -5.624 -0.349 1222 HG13 VAL 64 HG13 VAL 64 8.339 -5.467 0.504 1223 HG21 VAL 64 HG21 VAL 64 8.589 -3.972 2.367 1224 HG22 VAL 64 HG22 VAL 64 7.215 -3.093 3.033 1225 HG23 VAL 64 HG23 VAL 64 7.970 -2.544 1.538 1226 H GLN 65 H GLN 65 5.301 -3.751 -1.664 1227 HA GLN 65 HA GLN 65 6.975 -1.579 -2.456 1228 HB2 GLN 65 HB2 GLN 65 6.523 -3.691 -3.801 1229 HB3 GLN 65 HB3 GLN 65 4.956 -2.997 -4.197 1230 HG2 GLN 65 HG2 GLN 65 6.396 -0.941 -4.963 1231 HG3 GLN 65 HG3 GLN 65 7.675 -2.149 -5.088 1232 HE21 GLN 65 HE21 GLN 65 7.793 -2.012 -7.315 1233 HE22 GLN 65 HE22 GLN 65 6.556 -2.622 -8.360 1234 H ILE 66 H ILE 66 3.451 -2.116 -2.519 1235 HA ILE 66 HA ILE 66 2.747 0.393 -3.569 1236 HB ILE 66 HB ILE 66 1.176 -1.400 -1.710 1237 HG12 ILE 66 HG12 ILE 66 0.801 -1.057 -4.682 1238 HG13 ILE 66 HG13 ILE 66 1.933 -2.235 -4.028 1239 HG21 ILE 66 HG21 ILE 66 0.209 0.759 -1.552 1240 HG22 ILE 66 HG22 ILE 66 -0.805 -0.160 -2.661 1241 HG23 ILE 66 HG23 ILE 66 0.341 1.024 -3.289 1242 HD11 ILE 66 HD11 ILE 66 -0.077 -3.379 -4.498 1243 HD12 ILE 66 HD12 ILE 66 -1.049 -2.160 -3.675 1244 HD13 ILE 66 HD13 ILE 66 0.016 -3.216 -2.746 1245 H ALA 67 H ALA 67 3.284 -0.705 -0.271 1246 HA ALA 67 HA ALA 67 2.404 1.570 1.096 1247 HB1 ALA 67 HB1 ALA 67 3.718 0.766 2.963 1248 HB2 ALA 67 HB2 ALA 67 4.633 -0.300 1.898 1249 HB3 ALA 67 HB3 ALA 67 2.915 -0.586 2.170 1250 H SER 68 H SER 68 5.630 0.779 -0.199 1251 HA SER 68 HA SER 68 6.817 3.180 0.795 1252 HB2 SER 68 HB2 SER 68 8.604 2.462 -1.024 1253 HB3 SER 68 HB3 SER 68 8.430 1.565 0.483 1254 HG SER 68 HG SER 68 7.387 -0.041 -0.572 1255 H GLU 69 H GLU 69 5.381 2.199 -2.270 1256 HA GLU 69 HA GLU 69 6.164 4.423 -3.801 1257 HB2 GLU 69 HB2 GLU 69 3.815 2.547 -4.022 1258 HB3 GLU 69 HB3 GLU 69 4.086 3.841 -5.178 1259 HG2 GLU 69 HG2 GLU 69 6.481 2.722 -5.308 1260 HG3 GLU 69 HG3 GLU 69 5.574 1.312 -4.770 1261 H TYR 70 H TYR 70 3.496 3.956 -1.561 1262 HA TYR 70 HA TYR 70 2.394 6.567 -2.255 1263 HB2 TYR 70 HB2 TYR 70 1.412 4.239 -0.648 1264 HB3 TYR 70 HB3 TYR 70 0.674 5.823 -0.445 1265 HD1 TYR 70 HD2 TYR 70 1.621 3.442 -3.157 1266 HD2 TYR 70 HD1 TYR 70 -1.138 6.368 -1.777 1267 HE1 TYR 70 HE2 TYR 70 0.209 3.028 -5.123 1268 HE2 TYR 70 HE1 TYR 70 -2.560 5.959 -3.740 1269 HH TYR 70 HH TYR 70 -2.197 3.297 -5.755 1270 H LEU 71 H LEU 71 4.288 5.086 0.260 1271 HA LEU 71 HA LEU 71 3.714 6.903 2.327 1272 HB2 LEU 71 HB2 LEU 71 4.904 4.720 2.582 1273 HB3 LEU 71 HB3 LEU 71 6.319 5.467 1.865 1274 HG LEU 71 HG LEU 71 6.356 7.112 3.750 1275 HD11 LEU 71 HD11 LEU 71 4.111 7.110 4.520 1276 HD12 LEU 71 HD12 LEU 71 5.104 6.455 5.817 1277 HD13 LEU 71 HD13 LEU 71 4.141 5.370 4.817 1278 HD21 LEU 71 HD21 LEU 71 7.218 5.547 5.435 1279 HD22 LEU 71 HD22 LEU 71 7.834 5.202 3.824 1280 HD23 LEU 71 HD23 LEU 71 6.553 4.202 4.514 1281 H LYS 72 H LYS 72 6.087 7.010 -0.291 1282 HA LYS 72 HA LYS 72 7.451 9.304 0.643 1283 HB2 LYS 72 HB2 LYS 72 8.339 9.490 -1.643 1284 HB3 LYS 72 HB3 LYS 72 8.458 7.853 -1.019 1285 HG2 LYS 72 HG2 LYS 72 6.778 7.062 -2.420 1286 HG3 LYS 72 HG3 LYS 72 6.157 8.683 -2.743 1287 HD2 LYS 72 HD2 LYS 72 7.324 7.955 -4.697 1288 HD3 LYS 72 HD3 LYS 72 8.309 9.190 -3.913 1289 HE2 LYS 72 HE2 LYS 72 9.970 7.696 -4.184 1290 HE3 LYS 72 HE3 LYS 72 9.282 6.945 -2.746 1291 HZ1 LYS 72 HZ1 LYS 72 9.683 5.387 -4.610 1292 HZ2 LYS 72 HZ2 LYS 72 8.527 6.213 -5.521 1293 HZ3 LYS 72 HZ3 LYS 72 8.071 5.419 -4.102 1294 H LEU 73 H LEU 73 4.362 8.934 -0.726 1295 HA LEU 73 HA LEU 73 4.206 11.576 -1.858 1296 HB2 LEU 73 HB2 LEU 73 2.926 9.617 -2.743 1297 HB3 LEU 73 HB3 LEU 73 1.988 9.607 -1.266 1298 HG LEU 73 HG LEU 73 0.955 10.654 -3.374 1299 HD11 LEU 73 HD11 LEU 73 -0.254 12.319 -2.081 1300 HD12 LEU 73 HD12 LEU 73 0.968 12.236 -0.811 1301 HD13 LEU 73 HD13 LEU 73 -0.038 10.831 -1.160 1302 HD21 LEU 73 HD21 LEU 73 2.571 13.048 -2.524 1303 HD22 LEU 73 HD22 LEU 73 1.451 12.920 -3.880 1304 HD23 LEU 73 HD23 LEU 73 2.974 12.034 -3.912 1305 H LYS 74 H LYS 74 2.862 9.915 1.006 1306 HA LYS 74 HA LYS 74 1.606 12.258 2.008 1307 HB2 LYS 74 HB2 LYS 74 1.182 11.034 4.017 1308 HB3 LYS 74 HB3 LYS 74 0.974 9.931 2.663 1309 HG2 LYS 74 HG2 LYS 74 2.585 8.570 3.383 1310 HG3 LYS 74 HG3 LYS 74 3.677 9.908 3.745 1311 HD2 LYS 74 HD2 LYS 74 3.194 8.783 5.803 1312 HD3 LYS 74 HD3 LYS 74 2.351 10.329 5.825 1313 HE2 LYS 74 HE2 LYS 74 0.339 9.001 4.926 1314 HE3 LYS 74 HE3 LYS 74 1.228 7.573 5.437 1315 HZ1 LYS 74 HZ1 LYS 74 1.210 8.351 7.681 1316 HZ2 LYS 74 HZ2 LYS 74 -0.376 8.405 7.098 1317 HZ3 LYS 74 HZ3 LYS 74 0.525 9.830 7.234 1318 H GLU 75 H GLU 75 4.827 11.101 2.070 1319 HA GLU 75 HA GLU 75 5.745 12.497 4.363 1320 HB2 GLU 75 HB2 GLU 75 6.907 10.571 3.193 1321 HB3 GLU 75 HB3 GLU 75 7.393 11.722 1.955 1322 HG2 GLU 75 HG2 GLU 75 9.129 11.270 3.667 1323 HG3 GLU 75 HG3 GLU 75 8.685 12.970 3.522 1324 H GLU 76 H GLU 76 5.899 13.226 0.872 1325 HA GLU 76 HA GLU 76 7.077 15.783 1.261 1326 HB2 GLU 76 HB2 GLU 76 6.676 16.174 -1.085 1327 HB3 GLU 76 HB3 GLU 76 7.262 14.533 -0.863 1328 HG2 GLU 76 HG2 GLU 76 5.019 13.660 -1.140 1329 HG3 GLU 76 HG3 GLU 76 4.375 15.298 -1.272 1330 H TYR 77 H TYR 77 3.819 14.618 1.259 1331 HA TYR 77 HA TYR 77 2.396 16.958 0.777 1332 HB2 TYR 77 HB2 TYR 77 1.279 14.817 0.873 1333 HB3 TYR 77 HB3 TYR 77 1.729 14.610 2.562 1334 HD1 TYR 77 HD2 TYR 77 0.291 17.588 0.840 1335 HD2 TYR 77 HD1 TYR 77 -0.289 14.509 3.715 1336 HE1 TYR 77 HE2 TYR 77 -1.830 18.631 1.507 1337 HE2 TYR 77 HE1 TYR 77 -2.412 15.542 4.399 1338 HH TYR 77 HH TYR 77 -3.577 18.538 2.881 1339 H GLN 78 H GLN 78 3.688 15.692 3.819 1340 HA GLN 78 HA GLN 78 2.671 17.919 5.334 1341 HB2 GLN 78 HB2 GLN 78 4.363 15.530 5.984 1342 HB3 GLN 78 HB3 GLN 78 4.182 16.843 7.141 1343 HG2 GLN 78 HG2 GLN 78 1.947 15.212 5.958 1344 HG3 GLN 78 HG3 GLN 78 2.607 15.042 7.583 1345 HE21 GLN 78 HE21 GLN 78 -0.112 15.640 6.772 1346 HE22 GLN 78 HE22 GLN 78 -0.510 17.162 7.487 1347 H ARG 79 H ARG 79 5.120 17.803 3.192 1348 HA ARG 79 HA ARG 79 6.990 19.376 4.799 1349 HB2 ARG 79 HB2 ARG 79 7.262 18.358 1.966 1350 HB3 ARG 79 HB3 ARG 79 8.518 19.174 2.889 1351 HG2 ARG 79 HG2 ARG 79 7.275 16.512 3.555 1352 HG3 ARG 79 HG3 ARG 79 8.876 16.776 2.864 1353 HD2 ARG 79 HD2 ARG 79 9.675 17.788 4.838 1354 HD3 ARG 79 HD3 ARG 79 8.051 17.977 5.491 1355 HE ARG 79 HE ARG 79 8.407 15.266 5.181 1356 HH11 ARG 79 HH11 ARG 79 9.935 17.860 6.962 1357 HH12 ARG 79 HH12 ARG 79 10.508 16.820 8.227 1358 HH21 ARG 79 HH21 ARG 79 9.104 13.905 6.852 1359 HH22 ARG 79 HH22 ARG 79 10.024 14.569 8.178 1360 H LEU 80 H LEU 80 5.301 19.636 1.662 1361 HA LEU 80 HA LEU 80 5.989 22.374 1.310 1362 HB2 LEU 80 HB2 LEU 80 4.703 22.335 -0.632 1363 HB3 LEU 80 HB3 LEU 80 5.311 20.700 -0.484 1364 HG LEU 80 HG LEU 80 2.721 20.983 0.805 1365 HD11 LEU 80 HD11 LEU 80 2.365 22.705 -0.889 1366 HD12 LEU 80 HD12 LEU 80 1.386 21.273 -1.204 1367 HD13 LEU 80 HD13 LEU 80 2.844 21.569 -2.149 1368 HD21 LEU 80 HD21 LEU 80 3.632 19.275 -1.505 1369 HD22 LEU 80 HD22 LEU 80 2.204 19.025 -0.502 1370 HD23 LEU 80 HD23 LEU 80 3.814 18.859 0.198 1371 H ARG 81 H ARG 81 3.772 20.917 3.364 1372 HA ARG 81 HA ARG 81 2.002 23.245 3.383 1373 HB2 ARG 81 HB2 ARG 81 1.781 20.625 4.878 1374 HB3 ARG 81 HB3 ARG 81 0.596 21.925 4.926 1375 HG2 ARG 81 HG2 ARG 81 1.393 20.558 2.372 1376 HG3 ARG 81 HG3 ARG 81 0.083 19.976 3.397 1377 HD2 ARG 81 HD2 ARG 81 -0.848 21.332 1.649 1378 HD3 ARG 81 HD3 ARG 81 -1.006 22.195 3.174 1379 HE ARG 81 HE ARG 81 1.266 22.828 1.436 1380 HH11 ARG 81 HH11 ARG 81 -1.808 23.752 2.839 1381 HH12 ARG 81 HH12 ARG 81 -1.645 25.430 2.425 1382 HH21 ARG 81 HH21 ARG 81 1.480 25.048 0.869 1383 HH22 ARG 81 HH22 ARG 81 0.220 26.164 1.308 1384 H GLU 82 H GLU 82 4.401 21.606 5.352 1385 HA GLU 82 HA GLU 82 3.945 23.197 7.690 1386 HB2 GLU 82 HB2 GLU 82 5.807 22.103 8.636 1387 HB3 GLU 82 HB3 GLU 82 5.061 20.897 7.599 1388 HG2 GLU 82 HG2 GLU 82 6.730 21.253 5.905 1389 HG3 GLU 82 HG3 GLU 82 7.428 22.585 6.822 1390 H GLN 83 H GLN 83 5.837 23.477 4.804 1391 HA GLN 83 HA GLN 83 7.668 25.445 5.659 1392 HB2 GLN 83 HB2 GLN 83 7.685 23.961 3.540 1393 HB3 GLN 83 HB3 GLN 83 6.672 25.213 2.834 1394 HG2 GLN 83 HG2 GLN 83 8.487 26.853 3.495 1395 HG3 GLN 83 HG3 GLN 83 9.492 25.441 3.815 1396 HE21 GLN 83 HE21 GLN 83 10.948 25.928 2.212 1397 HE22 GLN 83 HE22 GLN 83 10.577 25.776 0.529 1398 H LEU 84 H LEU 84 4.330 25.605 4.901 1399 HA LEU 84 HA LEU 84 4.443 28.484 4.412 1400 HB2 LEU 84 HB2 LEU 84 2.659 26.352 3.649 1401 HB3 LEU 84 HB3 LEU 84 1.765 27.625 4.452 1402 HG LEU 84 HG LEU 84 1.725 27.997 2.064 1403 HD11 LEU 84 HD11 LEU 84 3.697 30.062 2.834 1404 HD12 LEU 84 HD12 LEU 84 2.265 29.909 3.852 1405 HD13 LEU 84 HD13 LEU 84 2.089 30.231 2.127 1406 HD21 LEU 84 HD21 LEU 84 4.728 27.890 2.243 1407 HD22 LEU 84 HD22 LEU 84 3.843 28.489 0.842 1408 HD23 LEU 84 HD23 LEU 84 3.667 26.808 1.343 1409 H LYS 85 H LYS 85 4.641 26.754 7.053 1410 HA LYS 85 HA LYS 85 2.614 28.244 8.566 1411 HB2 LYS 85 HB2 LYS 85 4.278 25.858 9.379 1412 HB3 LYS 85 HB3 LYS 85 3.087 26.656 10.397 1413 HG2 LYS 85 HG2 LYS 85 1.359 26.100 8.688 1414 HG3 LYS 85 HG3 LYS 85 2.582 25.155 7.836 1415 HD2 LYS 85 HD2 LYS 85 1.471 23.568 9.130 1416 HD3 LYS 85 HD3 LYS 85 2.904 23.946 10.086 1417 HE2 LYS 85 HE2 LYS 85 0.868 23.831 11.458 1418 HE3 LYS 85 HE3 LYS 85 1.608 25.429 11.499 1419 HZ1 LYS 85 HZ1 LYS 85 -0.033 26.220 9.953 1420 HZ2 LYS 85 HZ2 LYS 85 -0.820 25.493 11.257 1421 HZ3 LYS 85 HZ3 LYS 85 -0.694 24.676 9.785 1422 H LYS 86 H LYS 86 5.593 26.972 9.902 1423 HA LYS 86 HA LYS 86 6.786 29.609 10.095 1424 HB2 LYS 86 HB2 LYS 86 6.994 29.559 12.517 1425 HB3 LYS 86 HB3 LYS 86 5.295 29.488 12.070 1426 HG2 LYS 86 HG2 LYS 86 5.129 27.220 12.632 1427 HG3 LYS 86 HG3 LYS 86 6.878 27.015 12.678 1428 HD2 LYS 86 HD2 LYS 86 6.757 28.792 14.579 1429 HD3 LYS 86 HD3 LYS 86 5.066 28.293 14.674 1430 HE2 LYS 86 HE2 LYS 86 6.383 26.998 16.239 1431 HE3 LYS 86 HE3 LYS 86 5.799 25.958 14.939 1432 HZ1 LYS 86 HZ1 LYS 86 8.146 25.572 15.520 1433 HZ2 LYS 86 HZ2 LYS 86 8.518 27.151 15.043 1434 HZ3 LYS 86 HZ3 LYS 86 7.948 26.033 13.907 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 27.112 -6.199 -7.887 2 H2 GLY 1 H2 GLY 1 28.635 -6.927 -7.897 3 H3 GLY 1 H3 GLY 1 27.685 -6.941 -9.293 4 HA2 GLY 1 HA3 GLY 1 29.003 -4.614 -8.024 5 HA3 GLY 1 HA2 GLY 1 29.347 -5.299 -9.605 6 H SER 2 H SER 2 28.550 -2.570 -8.846 7 HA SER 2 HA SER 2 25.841 -2.191 -9.681 8 HB2 SER 2 HB2 SER 2 27.595 0.139 -9.889 9 HB3 SER 2 HB3 SER 2 26.163 -0.106 -8.887 10 HG SER 2 HG SER 2 28.664 -0.083 -8.097 11 H HIS 3 H HIS 3 28.981 -1.399 -11.166 12 HA HIS 3 HA HIS 3 29.629 -1.036 -13.311 13 HB2 HIS 3 HB2 HIS 3 27.553 -3.155 -13.560 14 HB3 HIS 3 HB3 HIS 3 28.072 -2.358 -15.042 15 HD1 HIS 3 HD1 HIS 3 29.367 -4.282 -16.032 16 HD2 HIS 3 HD2 HIS 3 30.565 -3.341 -12.166 17 HE1 HIS 3 HE1 HIS 3 31.454 -5.619 -15.627 18 HE2 HIS 3 HE2 HIS 3 32.088 -5.133 -13.241 19 H MET 4 H MET 4 28.049 0.946 -12.217 20 HA MET 4 HA MET 4 26.848 2.072 -14.623 21 HB2 MET 4 HB2 MET 4 25.370 1.380 -12.148 22 HB3 MET 4 HB3 MET 4 25.021 2.950 -12.854 23 HG2 MET 4 HG2 MET 4 24.665 1.692 -15.043 24 HG3 MET 4 HG3 MET 4 24.633 0.234 -14.050 25 HE1 MET 4 HE1 MET 4 21.592 3.689 -13.864 26 HE2 MET 4 HE2 MET 4 22.940 3.571 -14.996 27 HE3 MET 4 HE3 MET 4 23.247 3.896 -13.288 28 H THR 5 H THR 5 27.048 4.259 -14.769 29 HA THR 5 HA THR 5 28.837 5.534 -12.895 30 HB THR 5 HB THR 5 27.530 7.048 -15.110 31 HG1 THR 5 HG1 THR 5 29.626 5.844 -16.169 32 HG21 THR 5 HG21 THR 5 29.764 7.999 -15.332 33 HG22 THR 5 HG22 THR 5 30.383 6.861 -14.135 34 HG23 THR 5 HG23 THR 5 29.217 8.096 -13.660 35 H GLU 6 H GLU 6 25.547 6.045 -14.100 36 HA GLU 6 HA GLU 6 25.026 8.173 -12.219 37 HB2 GLU 6 HB2 GLU 6 24.048 8.184 -14.491 38 HB3 GLU 6 HB3 GLU 6 23.174 6.706 -14.115 39 HG2 GLU 6 HG2 GLU 6 21.759 8.697 -13.992 40 HG3 GLU 6 HG3 GLU 6 21.863 7.849 -12.452 41 H GLN 7 H GLN 7 23.341 8.069 -10.603 42 HA GLN 7 HA GLN 7 23.077 5.358 -9.486 43 HB2 GLN 7 HB2 GLN 7 24.232 7.207 -8.143 44 HB3 GLN 7 HB3 GLN 7 22.636 7.925 -7.972 45 HG2 GLN 7 HG2 GLN 7 21.839 5.846 -6.919 46 HG3 GLN 7 HG3 GLN 7 23.469 5.187 -7.033 47 HE21 GLN 7 HE21 GLN 7 23.712 4.963 -4.825 48 HE22 GLN 7 HE22 GLN 7 23.891 6.321 -3.765 49 HA PRO 8 HA PRO 8 18.755 6.147 -10.574 50 HB2 PRO 8 HB2 PRO 8 18.147 3.645 -11.271 51 HB3 PRO 8 HB3 PRO 8 19.168 4.639 -12.317 52 HG2 PRO 8 HG2 PRO 8 19.949 2.466 -10.420 53 HG3 PRO 8 HG3 PRO 8 20.581 2.825 -12.035 54 HD2 PRO 8 HD2 PRO 8 21.760 3.588 -9.627 55 HD3 PRO 8 HD3 PRO 8 22.102 4.307 -11.214 56 H LYS 9 H LYS 9 16.759 4.568 -9.871 57 HA LYS 9 HA LYS 9 16.511 4.715 -7.123 58 HB2 LYS 9 HB2 LYS 9 14.571 3.202 -7.371 59 HB3 LYS 9 HB3 LYS 9 14.582 4.479 -8.578 60 HG2 LYS 9 HG2 LYS 9 15.865 2.573 -9.956 61 HG3 LYS 9 HG3 LYS 9 14.893 1.559 -8.892 62 HD2 LYS 9 HD2 LYS 9 12.867 2.723 -9.636 63 HD3 LYS 9 HD3 LYS 9 13.841 3.735 -10.705 64 HE2 LYS 9 HE2 LYS 9 14.635 1.582 -11.786 65 HE3 LYS 9 HE3 LYS 9 13.362 0.772 -10.877 66 HZ1 LYS 9 HZ1 LYS 9 13.004 2.913 -12.897 67 HZ2 LYS 9 HZ2 LYS 9 11.756 2.280 -11.951 68 HZ3 LYS 9 HZ3 LYS 9 12.565 1.286 -13.050 69 H THR 10 H THR 10 17.350 3.571 -5.492 70 HA THR 10 HA THR 10 18.951 1.241 -6.089 71 HB THR 10 HB THR 10 19.624 3.167 -4.520 72 HG1 THR 10 HG1 THR 10 20.842 1.263 -4.653 73 HG21 THR 10 HG21 THR 10 19.010 2.828 -2.152 74 HG22 THR 10 HG22 THR 10 17.861 1.585 -2.642 75 HG23 THR 10 HG23 THR 10 17.621 3.256 -3.150 76 H ARG 11 H ARG 11 18.819 -0.711 -4.771 77 HA ARG 11 HA ARG 11 16.044 -1.319 -4.002 78 HB2 ARG 11 HB2 ARG 11 18.103 -3.094 -5.319 79 HB3 ARG 11 HB3 ARG 11 16.614 -3.706 -4.609 80 HG2 ARG 11 HG2 ARG 11 15.417 -2.057 -6.161 81 HG3 ARG 11 HG3 ARG 11 16.961 -1.943 -7.007 82 HD2 ARG 11 HD2 ARG 11 15.402 -4.481 -6.521 83 HD3 ARG 11 HD3 ARG 11 15.467 -3.590 -8.039 84 HE ARG 11 HE ARG 11 17.755 -4.980 -6.797 85 HH11 ARG 11 HH11 ARG 11 16.108 -3.725 -9.624 86 HH12 ARG 11 HH12 ARG 11 17.251 -4.391 -10.744 87 HH21 ARG 11 HH21 ARG 11 19.268 -5.855 -8.267 88 HH22 ARG 11 HH22 ARG 11 19.062 -5.591 -9.969 89 H VAL 12 H VAL 12 15.750 -1.907 -1.952 90 HA VAL 12 HA VAL 12 18.129 -2.626 -0.369 91 HB VAL 12 HB VAL 12 17.098 -0.466 0.274 92 HG11 VAL 12 HG11 VAL 12 14.815 -0.725 -0.235 93 HG12 VAL 12 HG12 VAL 12 14.897 -0.598 1.522 94 HG13 VAL 12 HG13 VAL 12 14.675 -2.174 0.762 95 HG21 VAL 12 HG21 VAL 12 18.306 -1.722 1.953 96 HG22 VAL 12 HG22 VAL 12 16.858 -2.652 2.336 97 HG23 VAL 12 HG23 VAL 12 16.916 -0.927 2.692 98 H SER 13 H SER 13 17.970 -4.309 1.116 99 HA SER 13 HA SER 13 15.790 -6.182 0.606 100 HB2 SER 13 HB2 SER 13 18.046 -7.059 2.283 101 HB3 SER 13 HB3 SER 13 17.306 -7.845 0.888 102 HG SER 13 HG SER 13 19.464 -6.110 1.021 103 H VAL 14 H VAL 14 14.155 -6.148 2.020 104 HA VAL 14 HA VAL 14 14.749 -5.490 4.832 105 HB VAL 14 HB VAL 14 12.376 -4.741 5.028 106 HG11 VAL 14 HG11 VAL 14 14.045 -3.220 3.033 107 HG12 VAL 14 HG12 VAL 14 14.199 -3.138 4.785 108 HG13 VAL 14 HG13 VAL 14 12.730 -2.558 4.003 109 HG21 VAL 14 HG21 VAL 14 11.019 -4.338 3.133 110 HG22 VAL 14 HG22 VAL 14 11.627 -5.983 2.952 111 HG23 VAL 14 HG23 VAL 14 12.344 -4.670 2.017 112 H ARG 15 H ARG 15 13.331 -6.529 6.426 113 HA ARG 15 HA ARG 15 12.581 -9.216 5.508 114 HB2 ARG 15 HB2 ARG 15 14.437 -9.000 7.207 115 HB3 ARG 15 HB3 ARG 15 13.234 -8.396 8.337 116 HG2 ARG 15 HG2 ARG 15 12.171 -10.442 8.508 117 HG3 ARG 15 HG3 ARG 15 12.829 -11.025 6.978 118 HD2 ARG 15 HD2 ARG 15 14.375 -10.577 9.529 119 HD3 ARG 15 HD3 ARG 15 13.889 -12.139 8.870 120 HE ARG 15 HE ARG 15 15.988 -10.377 7.846 121 HH11 ARG 15 HH11 ARG 15 14.175 -13.370 7.535 122 HH12 ARG 15 HH12 ARG 15 15.331 -14.093 6.464 123 HH21 ARG 15 HH21 ARG 15 17.498 -11.345 6.445 124 HH22 ARG 15 HH22 ARG 15 17.216 -12.955 5.855 125 H ILE 16 H ILE 16 10.494 -9.710 5.487 126 HA ILE 16 HA ILE 16 8.686 -8.358 7.380 127 HB ILE 16 HB ILE 16 7.801 -9.031 4.582 128 HG12 ILE 16 HG12 ILE 16 8.584 -6.245 5.396 129 HG13 ILE 16 HG13 ILE 16 9.787 -7.345 4.732 130 HG21 ILE 16 HG21 ILE 16 6.038 -7.417 5.076 131 HG22 ILE 16 HG22 ILE 16 6.756 -7.108 6.657 132 HG23 ILE 16 HG23 ILE 16 6.087 -8.697 6.287 133 HD11 ILE 16 HD11 ILE 16 8.903 -5.932 2.993 134 HD12 ILE 16 HD12 ILE 16 7.256 -6.432 3.380 135 HD13 ILE 16 HD13 ILE 16 8.401 -7.599 2.716 136 H TYR 17 H TYR 17 7.546 -9.752 8.537 137 HA TYR 17 HA TYR 17 6.553 -11.636 9.299 138 HB2 TYR 17 HB2 TYR 17 5.573 -11.373 6.804 139 HB3 TYR 17 HB3 TYR 17 6.373 -12.930 6.633 140 HD1 TYR 17 HD2 TYR 17 4.388 -11.378 9.411 141 HD2 TYR 17 HD1 TYR 17 4.796 -14.618 6.680 142 HE1 TYR 17 HE2 TYR 17 2.429 -12.469 10.420 143 HE2 TYR 17 HE1 TYR 17 2.835 -15.716 7.681 144 HH TYR 17 HH TYR 17 0.659 -14.166 9.666 145 H GLY 18 H GLY 18 9.515 -11.478 8.582 146 HA2 GLY 18 HA2 GLY 18 11.078 -13.006 9.560 147 HA3 GLY 18 HA3 GLY 18 10.023 -14.326 9.093 148 H GLN 19 H GLN 19 9.776 -12.927 6.359 149 HA GLN 19 HA GLN 19 12.169 -14.209 5.256 150 HB2 GLN 19 HB2 GLN 19 9.445 -13.608 4.241 151 HB3 GLN 19 HB3 GLN 19 10.754 -13.613 3.071 152 HG2 GLN 19 HG2 GLN 19 10.075 -15.889 4.911 153 HG3 GLN 19 HG3 GLN 19 9.597 -15.765 3.220 154 HE21 GLN 19 HE21 GLN 19 12.160 -16.433 5.418 155 HE22 GLN 19 HE22 GLN 19 13.319 -16.942 4.240 156 H ASP 20 H ASP 20 13.330 -13.181 3.492 157 HA ASP 20 HA ASP 20 13.453 -10.270 3.863 158 HB2 ASP 20 HB2 ASP 20 15.697 -10.419 3.747 159 HB3 ASP 20 HB3 ASP 20 15.472 -12.149 3.946 160 H TYR 21 H TYR 21 13.236 -8.871 2.183 161 HA TYR 21 HA TYR 21 12.750 -9.992 -0.495 162 HB2 TYR 21 HB2 TYR 21 11.025 -7.848 0.761 163 HB3 TYR 21 HB3 TYR 21 10.783 -8.630 -0.797 164 HD1 TYR 21 HD1 TYR 21 9.853 -10.868 -0.929 165 HD2 TYR 21 HD2 TYR 21 10.448 -8.972 2.827 166 HE1 TYR 21 HE1 TYR 21 8.429 -12.563 0.141 167 HE2 TYR 21 HE2 TYR 21 9.034 -10.668 3.911 168 HH TYR 21 HH TYR 21 7.405 -12.262 3.455 169 H THR 22 H THR 22 13.577 -8.810 -2.147 170 HA THR 22 HA THR 22 15.036 -6.374 -1.456 171 HB THR 22 HB THR 22 15.295 -7.163 -4.222 172 HG1 THR 22 HG1 THR 22 15.977 -9.145 -2.277 173 HG21 THR 22 HG21 THR 22 16.921 -5.789 -3.080 174 HG22 THR 22 HG22 THR 22 17.687 -7.295 -3.586 175 HG23 THR 22 HG23 THR 22 17.221 -7.066 -1.901 176 H ILE 23 H ILE 23 13.903 -4.552 -1.632 177 HA ILE 23 HA ILE 23 12.051 -4.258 -3.913 178 HB ILE 23 HB ILE 23 10.708 -2.726 -2.471 179 HG12 ILE 23 HG12 ILE 23 12.306 -3.911 -0.195 180 HG13 ILE 23 HG13 ILE 23 12.585 -2.299 -0.842 181 HG21 ILE 23 HG21 ILE 23 10.007 -5.026 -2.859 182 HG22 ILE 23 HG22 ILE 23 9.581 -4.504 -1.229 183 HG23 ILE 23 HG23 ILE 23 10.970 -5.561 -1.480 184 HD11 ILE 23 HD11 ILE 23 10.311 -3.336 0.766 185 HD12 ILE 23 HD12 ILE 23 10.057 -1.969 -0.320 186 HD13 ILE 23 HD13 ILE 23 11.258 -1.861 0.968 187 H VAL 24 H VAL 24 11.557 -1.877 -4.323 188 HA VAL 24 HA VAL 24 14.065 -0.514 -4.719 189 HB VAL 24 HB VAL 24 11.264 0.394 -5.413 190 HG11 VAL 24 HG11 VAL 24 12.839 2.242 -5.303 191 HG12 VAL 24 HG12 VAL 24 12.380 1.920 -6.975 192 HG13 VAL 24 HG13 VAL 24 13.947 1.382 -6.371 193 HG21 VAL 24 HG21 VAL 24 13.324 -1.000 -7.124 194 HG22 VAL 24 HG22 VAL 24 11.780 -0.361 -7.690 195 HG23 VAL 24 HG23 VAL 24 11.812 -1.695 -6.538 196 H GLY 25 H GLY 25 14.860 1.114 -3.505 197 HA2 GLY 25 HA2 GLY 25 13.049 2.271 -1.476 198 HA3 GLY 25 HA3 GLY 25 14.707 1.824 -1.107 199 H ALA 26 H ALA 26 12.796 3.920 -3.244 200 HA ALA 26 HA ALA 26 15.041 5.713 -3.630 201 HB1 ALA 26 HB1 ALA 26 12.169 6.042 -4.501 202 HB2 ALA 26 HB2 ALA 26 13.428 5.250 -5.449 203 HB3 ALA 26 HB3 ALA 26 13.557 6.967 -5.071 204 H GLU 27 H GLU 27 13.572 5.179 -1.005 205 HA GLU 27 HA GLU 27 12.791 7.914 -0.281 206 HB2 GLU 27 HB2 GLU 27 11.461 5.608 0.142 207 HB3 GLU 27 HB3 GLU 27 12.453 5.631 1.587 208 HG2 GLU 27 HG2 GLU 27 11.506 7.671 2.314 209 HG3 GLU 27 HG3 GLU 27 10.688 7.908 0.771 210 H SER 28 H SER 28 13.253 7.970 2.365 211 HA SER 28 HA SER 28 16.066 8.316 2.556 212 HB2 SER 28 HB2 SER 28 14.632 8.209 5.100 213 HB3 SER 28 HB3 SER 28 15.513 9.549 4.364 214 HG SER 28 HG SER 28 13.704 10.078 3.178 215 HA PRO 29 HA PRO 29 17.527 4.316 3.694 216 HB2 PRO 29 HB2 PRO 29 19.326 5.072 5.678 217 HB3 PRO 29 HB3 PRO 29 19.663 5.015 3.945 218 HG2 PRO 29 HG2 PRO 29 18.908 7.343 5.657 219 HG3 PRO 29 HG3 PRO 29 20.068 7.261 4.319 220 HD2 PRO 29 HD2 PRO 29 17.661 8.355 3.977 221 HD3 PRO 29 HD3 PRO 29 18.401 7.362 2.702 222 H ALA 30 H ALA 30 16.549 6.466 6.343 223 HA ALA 30 HA ALA 30 16.197 4.182 8.110 224 HB1 ALA 30 HB1 ALA 30 15.710 5.800 9.835 225 HB2 ALA 30 HB2 ALA 30 15.636 7.095 8.639 226 HB3 ALA 30 HB3 ALA 30 17.167 6.286 8.966 227 H HIS 31 H HIS 31 14.375 6.085 5.946 228 HA HIS 31 HA HIS 31 11.811 5.671 7.172 229 HB2 HIS 31 HB2 HIS 31 12.698 7.476 5.383 230 HB3 HIS 31 HB3 HIS 31 11.980 6.310 4.279 231 HD1 HIS 31 HD1 HIS 31 9.420 6.109 4.262 232 HD2 HIS 31 HD2 HIS 31 10.887 8.907 6.970 233 HE1 HIS 31 HE1 HIS 31 7.427 7.452 5.000 234 HE2 HIS 31 HE2 HIS 31 8.396 9.321 6.386 235 H ILE 32 H ILE 32 13.546 4.292 4.414 236 HA ILE 32 HA ILE 32 11.545 2.526 3.562 237 HB ILE 32 HB ILE 32 13.497 1.144 2.616 238 HG12 ILE 32 HG12 ILE 32 15.128 3.622 3.092 239 HG13 ILE 32 HG13 ILE 32 15.114 2.334 4.300 240 HG21 ILE 32 HG21 ILE 32 13.991 3.255 1.043 241 HG22 ILE 32 HG22 ILE 32 12.555 3.831 1.887 242 HG23 ILE 32 HG23 ILE 32 12.496 2.322 0.981 243 HD11 ILE 32 HD11 ILE 32 15.974 0.777 2.684 244 HD12 ILE 32 HD12 ILE 32 17.007 2.204 2.736 245 HD13 ILE 32 HD13 ILE 32 15.866 1.987 1.408 246 H ARG 33 H ARG 33 13.599 2.314 6.294 247 HA ARG 33 HA ARG 33 13.415 -0.546 6.520 248 HB2 ARG 33 HB2 ARG 33 14.680 1.633 8.080 249 HB3 ARG 33 HB3 ARG 33 14.252 0.173 8.964 250 HG2 ARG 33 HG2 ARG 33 15.789 -1.104 7.882 251 HG3 ARG 33 HG3 ARG 33 15.673 -0.171 6.389 252 HD2 ARG 33 HD2 ARG 33 17.852 0.085 7.513 253 HD3 ARG 33 HD3 ARG 33 16.981 1.609 7.354 254 HE ARG 33 HE ARG 33 16.546 0.271 9.866 255 HH11 ARG 33 HH11 ARG 33 18.595 2.484 8.106 256 HH12 ARG 33 HH12 ARG 33 19.209 3.258 9.532 257 HH21 ARG 33 HH21 ARG 33 17.309 1.304 11.746 258 HH22 ARG 33 HH22 ARG 33 18.477 2.583 11.613 259 H LEU 34 H LEU 34 11.650 2.227 7.784 260 HA LEU 34 HA LEU 34 10.187 0.593 9.653 261 HB2 LEU 34 HB2 LEU 34 8.935 2.546 10.223 262 HB3 LEU 34 HB3 LEU 34 10.625 2.982 10.117 263 HG LEU 34 HG LEU 34 9.867 3.700 7.645 264 HD11 LEU 34 HD11 LEU 34 7.537 3.006 7.984 265 HD12 LEU 34 HD12 LEU 34 7.671 4.744 7.711 266 HD13 LEU 34 HD13 LEU 34 7.408 4.125 9.343 267 HD21 LEU 34 HD21 LEU 34 10.985 5.083 9.349 268 HD22 LEU 34 HD22 LEU 34 9.424 5.364 10.119 269 HD23 LEU 34 HD23 LEU 34 9.721 5.966 8.488 270 H VAL 35 H VAL 35 9.976 1.367 6.343 271 HA VAL 35 HA VAL 35 7.246 1.213 5.807 272 HB VAL 35 HB VAL 35 9.511 0.112 4.116 273 HG11 VAL 35 HG11 VAL 35 6.698 0.872 3.339 274 HG12 VAL 35 HG12 VAL 35 7.358 -0.760 3.405 275 HG13 VAL 35 HG13 VAL 35 7.978 0.394 2.226 276 HG21 VAL 35 HG21 VAL 35 8.168 2.787 3.839 277 HG22 VAL 35 HG22 VAL 35 9.621 2.210 3.034 278 HG23 VAL 35 HG23 VAL 35 9.648 2.549 4.763 279 H ALA 36 H ALA 36 9.659 -1.365 5.958 280 HA ALA 36 HA ALA 36 7.944 -3.521 5.427 281 HB1 ALA 36 HB1 ALA 36 10.550 -3.402 6.928 282 HB2 ALA 36 HB2 ALA 36 10.314 -3.769 5.220 283 HB3 ALA 36 HB3 ALA 36 9.745 -4.895 6.450 284 H ALA 37 H ALA 37 8.952 -2.046 8.492 285 HA ALA 37 HA ALA 37 7.714 -3.933 10.187 286 HB1 ALA 37 HB1 ALA 37 8.343 -1.036 10.738 287 HB2 ALA 37 HB2 ALA 37 9.451 -2.393 10.954 288 HB3 ALA 37 HB3 ALA 37 7.995 -2.275 11.945 289 H PHE 38 H PHE 38 6.540 -1.064 8.570 290 HA PHE 38 HA PHE 38 4.124 -0.740 9.989 291 HB2 PHE 38 HB2 PHE 38 5.129 0.977 8.502 292 HB3 PHE 38 HB3 PHE 38 4.745 -0.028 7.112 293 HD1 PHE 38 HD2 PHE 38 3.326 2.035 9.805 294 HD2 PHE 38 HD1 PHE 38 2.551 -0.087 6.199 295 HE1 PHE 38 HE2 PHE 38 1.119 3.112 9.651 296 HE2 PHE 38 HE1 PHE 38 0.344 0.987 6.037 297 HZ PHE 38 HZ PHE 38 -0.373 2.589 7.763 298 H VAL 39 H VAL 39 4.901 -2.429 6.975 299 HA VAL 39 HA VAL 39 2.270 -3.401 6.519 300 HB VAL 39 HB VAL 39 4.854 -4.572 5.467 301 HG11 VAL 39 HG11 VAL 39 2.800 -5.947 5.174 302 HG12 VAL 39 HG12 VAL 39 3.523 -5.424 3.652 303 HG13 VAL 39 HG13 VAL 39 2.085 -4.611 4.271 304 HG21 VAL 39 HG21 VAL 39 3.712 -1.997 5.020 305 HG22 VAL 39 HG22 VAL 39 3.591 -2.942 3.538 306 HG23 VAL 39 HG23 VAL 39 5.163 -2.705 4.305 307 H ASP 40 H ASP 40 5.114 -4.671 8.144 308 HA ASP 40 HA ASP 40 4.312 -7.315 8.537 309 HB2 ASP 40 HB2 ASP 40 6.570 -6.679 9.030 310 HB3 ASP 40 HB3 ASP 40 6.036 -5.495 10.218 311 H ASP 41 H ASP 41 3.519 -4.395 10.330 312 HA ASP 41 HA ASP 41 2.232 -5.753 12.488 313 HB2 ASP 41 HB2 ASP 41 3.169 -3.344 12.447 314 HB3 ASP 41 HB3 ASP 41 1.642 -2.915 11.680 315 H LYS 42 H LYS 42 1.218 -4.361 9.443 316 HA LYS 42 HA LYS 42 -1.558 -4.456 9.812 317 HB2 LYS 42 HB2 LYS 42 -0.405 -3.227 7.994 318 HB3 LYS 42 HB3 LYS 42 -0.009 -4.759 7.234 319 HG2 LYS 42 HG2 LYS 42 -1.874 -3.858 6.087 320 HG3 LYS 42 HG3 LYS 42 -2.460 -5.210 7.052 321 HD2 LYS 42 HD2 LYS 42 -3.983 -3.310 7.159 322 HD3 LYS 42 HD3 LYS 42 -3.290 -3.658 8.742 323 HE2 LYS 42 HE2 LYS 42 -1.801 -1.799 8.582 324 HE3 LYS 42 HE3 LYS 42 -2.190 -1.561 6.879 325 HZ1 LYS 42 HZ1 LYS 42 -4.149 -1.247 9.088 326 HZ2 LYS 42 HZ2 LYS 42 -4.381 -0.851 7.456 327 HZ3 LYS 42 HZ3 LYS 42 -3.287 0.033 8.398 328 H MET 43 H MET 43 0.709 -6.887 8.556 329 HA MET 43 HA MET 43 -1.383 -8.768 7.994 330 HB2 MET 43 HB2 MET 43 0.380 -10.351 7.496 331 HB3 MET 43 HB3 MET 43 0.759 -8.802 6.770 332 HG2 MET 43 HG2 MET 43 2.179 -8.383 8.856 333 HG3 MET 43 HG3 MET 43 2.028 -10.118 9.133 334 HE1 MET 43 HE1 MET 43 2.716 -7.486 6.463 335 HE2 MET 43 HE2 MET 43 2.206 -8.753 5.349 336 HE3 MET 43 HE3 MET 43 3.890 -8.233 5.383 337 H HIS 44 H HIS 44 0.535 -7.974 10.748 338 HA HIS 44 HA HIS 44 0.193 -10.412 12.163 339 HB2 HIS 44 HB2 HIS 44 1.198 -7.711 12.794 340 HB3 HIS 44 HB3 HIS 44 0.471 -8.563 14.152 341 HD1 HIS 44 HD1 HIS 44 3.447 -8.596 11.901 342 HD2 HIS 44 HD2 HIS 44 1.854 -10.865 15.006 343 HE1 HIS 44 HE1 HIS 44 5.282 -10.167 12.607 344 HE2 HIS 44 HE2 HIS 44 4.284 -11.553 14.461 345 H GLU 45 H GLU 45 -1.571 -7.346 12.139 346 HA GLU 45 HA GLU 45 -3.486 -8.181 14.094 347 HB2 GLU 45 HB2 GLU 45 -4.615 -6.114 13.628 348 HB3 GLU 45 HB3 GLU 45 -2.884 -5.801 13.646 349 HG2 GLU 45 HG2 GLU 45 -2.843 -5.829 11.200 350 HG3 GLU 45 HG3 GLU 45 -4.573 -6.163 11.171 351 H PHE 46 H PHE 46 -3.089 -8.913 10.828 352 HA PHE 46 HA PHE 46 -5.948 -9.389 10.431 353 HB2 PHE 46 HB2 PHE 46 -3.684 -8.856 8.633 354 HB3 PHE 46 HB3 PHE 46 -4.804 -10.085 8.057 355 HD1 PHE 46 HD2 PHE 46 -7.373 -9.389 8.413 356 HD2 PHE 46 HD1 PHE 46 -4.104 -6.700 7.994 357 HE1 PHE 46 HE2 PHE 46 -8.924 -7.632 7.657 358 HE2 PHE 46 HE1 PHE 46 -5.645 -4.935 7.238 359 HZ PHE 46 HZ PHE 46 -8.060 -5.400 7.069 360 H SER 47 H SER 47 -2.929 -11.092 10.826 361 HA SER 47 HA SER 47 -3.748 -13.605 9.866 362 HB2 SER 47 HB2 SER 47 -1.710 -12.910 11.993 363 HB3 SER 47 HB3 SER 47 -1.905 -14.512 11.285 364 HG SER 47 HG SER 47 -1.275 -12.140 9.839 365 H GLU 48 H GLU 48 -4.195 -12.000 12.947 366 HA GLU 48 HA GLU 48 -5.170 -14.304 14.327 367 HB2 GLU 48 HB2 GLU 48 -5.868 -12.682 16.062 368 HB3 GLU 48 HB3 GLU 48 -4.184 -12.503 15.594 369 HG2 GLU 48 HG2 GLU 48 -4.497 -10.387 15.015 370 HG3 GLU 48 HG3 GLU 48 -5.874 -10.804 13.996 371 H LYS 49 H LYS 49 -6.560 -12.242 12.022 372 HA LYS 49 HA LYS 49 -9.277 -12.407 12.979 373 HB2 LYS 49 HB2 LYS 49 -8.243 -11.607 10.247 374 HB3 LYS 49 HB3 LYS 49 -9.883 -11.387 10.828 375 HG2 LYS 49 HG2 LYS 49 -7.490 -10.121 12.126 376 HG3 LYS 49 HG3 LYS 49 -8.427 -9.343 10.852 377 HD2 LYS 49 HD2 LYS 49 -9.608 -10.310 13.455 378 HD3 LYS 49 HD3 LYS 49 -9.041 -8.665 13.187 379 HE2 LYS 49 HE2 LYS 49 -10.628 -8.659 11.170 380 HE3 LYS 49 HE3 LYS 49 -11.352 -10.087 11.908 381 HZ1 LYS 49 HZ1 LYS 49 -12.566 -8.196 12.618 382 HZ2 LYS 49 HZ2 LYS 49 -11.166 -7.368 13.080 383 HZ3 LYS 49 HZ3 LYS 49 -11.667 -8.729 13.946 384 H GLN 50 H GLN 50 -7.209 -14.135 10.775 385 HA GLN 50 HA GLN 50 -7.444 -16.045 9.567 386 HB2 GLN 50 HB2 GLN 50 -9.597 -16.671 11.591 387 HB3 GLN 50 HB3 GLN 50 -8.781 -17.829 10.553 388 HG2 GLN 50 HG2 GLN 50 -6.754 -17.597 11.705 389 HG3 GLN 50 HG3 GLN 50 -7.298 -16.140 12.534 390 HE21 GLN 50 HE21 GLN 50 -7.499 -19.601 12.402 391 HE22 GLN 50 HE22 GLN 50 -8.264 -19.821 13.934 392 HA PRO 51 HA PRO 51 -11.202 -14.287 7.391 393 HB2 PRO 51 HB2 PRO 51 -9.867 -14.067 4.966 394 HB3 PRO 51 HB3 PRO 51 -10.140 -12.753 6.109 395 HG2 PRO 51 HG2 PRO 51 -7.692 -14.340 5.605 396 HG3 PRO 51 HG3 PRO 51 -7.861 -12.672 6.168 397 HD2 PRO 51 HD2 PRO 51 -7.182 -14.783 7.786 398 HD3 PRO 51 HD3 PRO 51 -7.954 -13.294 8.359 399 H MET 52 H MET 52 -8.874 -16.115 5.393 400 HA MET 52 HA MET 52 -10.910 -18.224 5.123 401 HB2 MET 52 HB2 MET 52 -10.115 -18.608 2.836 402 HB3 MET 52 HB3 MET 52 -10.704 -16.966 3.042 403 HG2 MET 52 HG2 MET 52 -7.791 -17.614 3.280 404 HG3 MET 52 HG3 MET 52 -8.546 -17.339 1.712 405 HE1 MET 52 HE1 MET 52 -10.632 -15.075 2.133 406 HE2 MET 52 HE2 MET 52 -9.419 -15.064 0.851 407 HE3 MET 52 HE3 MET 52 -9.646 -13.638 1.864 408 H LEU 53 H LEU 53 -8.261 -17.686 6.712 409 HA LEU 53 HA LEU 53 -6.495 -18.845 7.529 410 HB2 LEU 53 HB2 LEU 53 -8.425 -21.033 6.821 411 HB3 LEU 53 HB3 LEU 53 -6.872 -21.395 7.551 412 HG LEU 53 HG LEU 53 -8.649 -19.398 8.884 413 HD11 LEU 53 HD11 LEU 53 -10.164 -21.220 8.425 414 HD12 LEU 53 HD12 LEU 53 -9.732 -21.220 10.136 415 HD13 LEU 53 HD13 LEU 53 -8.992 -22.387 9.039 416 HD21 LEU 53 HD21 LEU 53 -6.672 -21.463 9.838 417 HD22 LEU 53 HD22 LEU 53 -7.605 -20.398 10.888 418 HD23 LEU 53 HD23 LEU 53 -6.430 -19.715 9.763 419 H ASP 54 H ASP 54 -5.326 -17.967 5.614 420 HA ASP 54 HA ASP 54 -3.798 -20.045 4.388 421 HB2 ASP 54 HB2 ASP 54 -5.721 -20.028 2.862 422 HB3 ASP 54 HB3 ASP 54 -5.526 -18.298 2.618 423 H VAL 55 H VAL 55 -1.764 -19.302 4.150 424 HA VAL 55 HA VAL 55 -1.054 -16.753 5.063 425 HB VAL 55 HB VAL 55 0.674 -18.609 3.436 426 HG11 VAL 55 HG11 VAL 55 1.594 -16.353 3.623 427 HG12 VAL 55 HG12 VAL 55 2.539 -17.497 4.577 428 HG13 VAL 55 HG13 VAL 55 1.399 -16.413 5.374 429 HG21 VAL 55 HG21 VAL 55 0.161 -18.482 6.397 430 HG22 VAL 55 HG22 VAL 55 1.481 -19.383 5.657 431 HG23 VAL 55 HG23 VAL 55 -0.188 -19.818 5.306 432 HA PRO 56 HA PRO 56 0.134 -15.525 0.472 433 HB2 PRO 56 HB2 PRO 56 -1.559 -16.818 -1.366 434 HB3 PRO 56 HB3 PRO 56 0.172 -17.086 -1.162 435 HG2 PRO 56 HG2 PRO 56 -2.122 -18.661 -0.142 436 HG3 PRO 56 HG3 PRO 56 -0.494 -19.198 -0.593 437 HD2 PRO 56 HD2 PRO 56 -1.303 -18.984 1.982 438 HD3 PRO 56 HD3 PRO 56 0.374 -18.700 1.480 439 H LYS 57 H LYS 57 -3.213 -16.625 0.971 440 HA LYS 57 HA LYS 57 -4.397 -14.377 -0.287 441 HB2 LYS 57 HB2 LYS 57 -5.357 -16.599 1.447 442 HB3 LYS 57 HB3 LYS 57 -6.380 -15.178 1.323 443 HG2 LYS 57 HG2 LYS 57 -6.819 -17.116 -0.283 444 HG3 LYS 57 HG3 LYS 57 -6.757 -15.487 -0.953 445 HD2 LYS 57 HD2 LYS 57 -4.924 -15.934 -2.182 446 HD3 LYS 57 HD3 LYS 57 -4.175 -16.884 -0.899 447 HE2 LYS 57 HE2 LYS 57 -6.414 -17.849 -2.673 448 HE3 LYS 57 HE3 LYS 57 -4.707 -18.203 -2.932 449 HZ1 LYS 57 HZ1 LYS 57 -5.373 -20.038 -1.776 450 HZ2 LYS 57 HZ2 LYS 57 -6.516 -19.203 -0.855 451 HZ3 LYS 57 HZ3 LYS 57 -4.869 -19.057 -0.489 452 H LEU 58 H LEU 58 -3.264 -14.999 2.940 453 HA LEU 58 HA LEU 58 -4.533 -12.782 4.198 454 HB2 LEU 58 HB2 LEU 58 -3.540 -14.918 5.258 455 HB3 LEU 58 HB3 LEU 58 -1.989 -14.131 5.104 456 HG LEU 58 HG LEU 58 -3.007 -14.038 7.381 457 HD11 LEU 58 HD11 LEU 58 -2.416 -11.735 7.826 458 HD12 LEU 58 HD12 LEU 58 -2.516 -11.358 6.104 459 HD13 LEU 58 HD13 LEU 58 -1.276 -12.464 6.696 460 HD21 LEU 58 HD21 LEU 58 -4.882 -12.779 7.892 461 HD22 LEU 58 HD22 LEU 58 -5.353 -13.625 6.419 462 HD23 LEU 58 HD23 LEU 58 -4.865 -11.929 6.351 463 H ALA 59 H ALA 59 -1.381 -13.371 2.760 464 HA ALA 59 HA ALA 59 -0.129 -10.964 3.452 465 HB1 ALA 59 HB1 ALA 59 1.361 -11.471 1.493 466 HB2 ALA 59 HB2 ALA 59 0.309 -12.841 1.139 467 HB3 ALA 59 HB3 ALA 59 1.195 -12.778 2.665 468 H VAL 60 H VAL 60 -1.790 -11.834 0.413 469 HA VAL 60 HA VAL 60 -1.482 -9.268 -0.748 470 HB VAL 60 HB VAL 60 -1.937 -11.349 -2.042 471 HG11 VAL 60 HG11 VAL 60 -4.816 -10.960 -1.279 472 HG12 VAL 60 HG12 VAL 60 -3.767 -12.158 -0.526 473 HG13 VAL 60 HG13 VAL 60 -4.115 -12.251 -2.253 474 HG21 VAL 60 HG21 VAL 60 -2.147 -9.223 -3.139 475 HG22 VAL 60 HG22 VAL 60 -3.781 -9.009 -2.508 476 HG23 VAL 60 HG23 VAL 60 -3.448 -10.277 -3.689 477 H LEU 61 H LEU 61 -3.789 -10.550 1.486 478 HA LEU 61 HA LEU 61 -5.928 -8.781 1.045 479 HB2 LEU 61 HB2 LEU 61 -6.171 -10.795 2.373 480 HB3 LEU 61 HB3 LEU 61 -5.030 -10.192 3.559 481 HG LEU 61 HG LEU 61 -6.680 -8.310 4.005 482 HD11 LEU 61 HD11 LEU 61 -9.023 -8.790 3.392 483 HD12 LEU 61 HD12 LEU 61 -8.463 -10.121 2.382 484 HD13 LEU 61 HD13 LEU 61 -8.001 -8.465 1.992 485 HD21 LEU 61 HD21 LEU 61 -6.386 -10.196 5.520 486 HD22 LEU 61 HD22 LEU 61 -7.531 -11.148 4.576 487 HD23 LEU 61 HD23 LEU 61 -8.083 -9.714 5.443 488 H THR 62 H THR 62 -2.915 -8.418 2.757 489 HA THR 62 HA THR 62 -3.717 -6.032 4.140 490 HB THR 62 HB THR 62 -1.410 -5.851 4.865 491 HG1 THR 62 HG1 THR 62 -0.866 -8.044 3.112 492 HG21 THR 62 HG21 THR 62 -1.137 -8.226 5.780 493 HG22 THR 62 HG22 THR 62 -2.643 -8.587 4.943 494 HG23 THR 62 HG23 THR 62 -2.605 -7.351 6.202 495 H ALA 63 H ALA 63 -2.084 -6.803 1.137 496 HA ALA 63 HA ALA 63 -0.951 -4.321 0.542 497 HB1 ALA 63 HB1 ALA 63 -2.094 -6.328 -1.396 498 HB2 ALA 63 HB2 ALA 63 -0.474 -6.381 -0.704 499 HB3 ALA 63 HB3 ALA 63 -0.931 -5.054 -1.771 500 H VAL 64 H VAL 64 -4.123 -5.622 -0.340 501 HA VAL 64 HA VAL 64 -4.992 -3.264 -1.649 502 HB VAL 64 HB VAL 64 -5.951 -5.504 -2.092 503 HG11 VAL 64 HG11 VAL 64 -7.735 -6.350 -0.595 504 HG12 VAL 64 HG12 VAL 64 -7.237 -5.159 0.608 505 HG13 VAL 64 HG13 VAL 64 -6.124 -6.431 0.110 506 HG21 VAL 64 HG21 VAL 64 -7.158 -3.605 -2.875 507 HG22 VAL 64 HG22 VAL 64 -7.876 -3.334 -1.286 508 HG23 VAL 64 HG23 VAL 64 -8.322 -4.760 -2.228 509 H GLN 65 H GLN 65 -5.109 -4.323 1.685 510 HA GLN 65 HA GLN 65 -7.046 -2.411 2.524 511 HB2 GLN 65 HB2 GLN 65 -6.094 -4.592 3.707 512 HB3 GLN 65 HB3 GLN 65 -4.976 -3.435 4.420 513 HG2 GLN 65 HG2 GLN 65 -7.931 -2.939 4.507 514 HG3 GLN 65 HG3 GLN 65 -7.165 -4.011 5.679 515 HE21 GLN 65 HE21 GLN 65 -8.490 -1.381 5.974 516 HE22 GLN 65 HE22 GLN 65 -7.333 -0.371 6.770 517 H ILE 66 H ILE 66 -3.503 -2.545 2.697 518 HA ILE 66 HA ILE 66 -3.055 -0.042 3.847 519 HB ILE 66 HB ILE 66 -1.345 -1.661 1.950 520 HG12 ILE 66 HG12 ILE 66 -0.972 -1.195 4.906 521 HG13 ILE 66 HG13 ILE 66 -1.935 -2.528 4.278 522 HG21 ILE 66 HG21 ILE 66 -0.784 0.760 1.860 523 HG22 ILE 66 HG22 ILE 66 0.520 -0.252 2.477 524 HG23 ILE 66 HG23 ILE 66 -0.457 0.704 3.593 525 HD11 ILE 66 HD11 ILE 66 0.069 -3.305 3.038 526 HD12 ILE 66 HD12 ILE 66 0.246 -3.334 4.792 527 HD13 ILE 66 HD13 ILE 66 1.002 -2.049 3.854 528 H ALA 67 H ALA 67 -3.256 -1.001 0.443 529 HA ALA 67 HA ALA 67 -2.708 1.495 -0.703 530 HB1 ALA 67 HB1 ALA 67 -2.737 -0.672 -1.915 531 HB2 ALA 67 HB2 ALA 67 -3.630 0.610 -2.731 532 HB3 ALA 67 HB3 ALA 67 -4.497 -0.643 -1.843 533 H SER 68 H SER 68 -5.802 0.020 0.232 534 HA SER 68 HA SER 68 -7.502 1.982 -0.783 535 HB2 SER 68 HB2 SER 68 -8.308 -0.190 0.024 536 HB3 SER 68 HB3 SER 68 -7.883 0.254 1.676 537 HG SER 68 HG SER 68 -10.032 0.688 1.460 538 H GLU 69 H GLU 69 -5.887 1.792 2.368 539 HA GLU 69 HA GLU 69 -7.158 4.120 3.409 540 HB2 GLU 69 HB2 GLU 69 -4.643 2.706 4.311 541 HB3 GLU 69 HB3 GLU 69 -5.491 3.948 5.224 542 HG2 GLU 69 HG2 GLU 69 -7.484 2.482 5.286 543 HG3 GLU 69 HG3 GLU 69 -6.548 1.231 4.470 544 H TYR 70 H TYR 70 -3.986 3.537 1.927 545 HA TYR 70 HA TYR 70 -3.048 6.190 2.335 546 HB2 TYR 70 HB2 TYR 70 -2.101 3.817 0.823 547 HB3 TYR 70 HB3 TYR 70 -1.465 5.387 0.337 548 HD1 TYR 70 HD1 TYR 70 -0.037 6.675 1.833 549 HD2 TYR 70 HD2 TYR 70 -1.558 2.872 2.999 550 HE1 TYR 70 HE1 TYR 70 1.581 6.600 3.684 551 HE2 TYR 70 HE2 TYR 70 0.055 2.796 4.853 552 HH TYR 70 HH TYR 70 2.120 3.749 5.538 553 H LEU 71 H LEU 71 -4.920 4.705 -0.220 554 HA LEU 71 HA LEU 71 -4.488 6.640 -2.226 555 HB2 LEU 71 HB2 LEU 71 -6.488 4.534 -1.701 556 HB3 LEU 71 HB3 LEU 71 -7.023 5.834 -2.745 557 HG LEU 71 HG LEU 71 -4.412 4.468 -3.317 558 HD11 LEU 71 HD11 LEU 71 -5.982 2.624 -3.113 559 HD12 LEU 71 HD12 LEU 71 -5.565 2.901 -4.802 560 HD13 LEU 71 HD13 LEU 71 -7.119 3.452 -4.181 561 HD21 LEU 71 HD21 LEU 71 -6.432 5.511 -5.268 562 HD22 LEU 71 HD22 LEU 71 -4.697 5.273 -5.481 563 HD23 LEU 71 HD23 LEU 71 -5.290 6.589 -4.466 564 H LYS 72 H LYS 72 -6.639 6.611 0.535 565 HA LYS 72 HA LYS 72 -8.229 8.831 -0.266 566 HB2 LYS 72 HB2 LYS 72 -7.790 8.179 2.621 567 HB3 LYS 72 HB3 LYS 72 -9.265 8.664 1.798 568 HG2 LYS 72 HG2 LYS 72 -8.983 6.343 0.607 569 HG3 LYS 72 HG3 LYS 72 -8.021 5.971 2.036 570 HD2 LYS 72 HD2 LYS 72 -9.903 6.503 3.474 571 HD3 LYS 72 HD3 LYS 72 -10.862 6.974 2.069 572 HE2 LYS 72 HE2 LYS 72 -9.968 4.251 2.923 573 HE3 LYS 72 HE3 LYS 72 -11.581 4.809 2.479 574 HZ1 LYS 72 HZ1 LYS 72 -10.807 3.495 0.695 575 HZ2 LYS 72 HZ2 LYS 72 -9.293 4.243 0.681 576 HZ3 LYS 72 HZ3 LYS 72 -10.662 5.102 0.159 577 H LEU 73 H LEU 73 -5.094 8.534 1.124 578 HA LEU 73 HA LEU 73 -5.022 11.126 2.336 579 HB2 LEU 73 HB2 LEU 73 -3.630 9.149 3.020 580 HB3 LEU 73 HB3 LEU 73 -2.714 9.348 1.544 581 HG LEU 73 HG LEU 73 -1.726 10.249 3.735 582 HD11 LEU 73 HD11 LEU 73 -0.744 10.718 1.574 583 HD12 LEU 73 HD12 LEU 73 -0.679 12.149 2.605 584 HD13 LEU 73 HD13 LEU 73 -1.884 12.041 1.322 585 HD21 LEU 73 HD21 LEU 73 -3.871 11.435 4.373 586 HD22 LEU 73 HD22 LEU 73 -3.452 12.638 3.148 587 HD23 LEU 73 HD23 LEU 73 -2.381 12.365 4.520 588 H LYS 74 H LYS 74 -3.871 9.738 -0.706 589 HA LYS 74 HA LYS 74 -2.702 12.200 -1.563 590 HB2 LYS 74 HB2 LYS 74 -2.276 11.098 -3.657 591 HB3 LYS 74 HB3 LYS 74 -1.882 10.008 -2.340 592 HG2 LYS 74 HG2 LYS 74 -3.834 8.713 -2.710 593 HG3 LYS 74 HG3 LYS 74 -4.485 9.904 -3.837 594 HD2 LYS 74 HD2 LYS 74 -1.933 8.359 -4.288 595 HD3 LYS 74 HD3 LYS 74 -3.504 7.884 -4.931 596 HE2 LYS 74 HE2 LYS 74 -3.314 10.509 -5.699 597 HE3 LYS 74 HE3 LYS 74 -1.648 9.950 -5.838 598 HZ1 LYS 74 HZ1 LYS 74 -4.041 8.786 -7.145 599 HZ2 LYS 74 HZ2 LYS 74 -2.509 8.074 -7.178 600 HZ3 LYS 74 HZ3 LYS 74 -2.753 9.581 -7.902 601 H GLU 75 H GLU 75 -5.859 10.793 -1.751 602 HA GLU 75 HA GLU 75 -6.792 12.387 -3.923 603 HB2 GLU 75 HB2 GLU 75 -7.802 10.203 -3.035 604 HB3 GLU 75 HB3 GLU 75 -8.526 11.185 -1.772 605 HG2 GLU 75 HG2 GLU 75 -10.128 10.824 -3.514 606 HG3 GLU 75 HG3 GLU 75 -9.662 12.523 -3.496 607 H GLU 76 H GLU 76 -6.865 12.693 -0.392 608 HA GLU 76 HA GLU 76 -8.457 15.032 -0.320 609 HB2 GLU 76 HB2 GLU 76 -7.942 15.187 1.972 610 HB3 GLU 76 HB3 GLU 76 -7.916 13.464 1.630 611 HG2 GLU 76 HG2 GLU 76 -5.598 13.344 1.781 612 HG3 GLU 76 HG3 GLU 76 -5.401 15.083 1.569 613 H TYR 77 H TYR 77 -5.118 14.459 -0.972 614 HA TYR 77 HA TYR 77 -4.037 16.987 -0.419 615 HB2 TYR 77 HB2 TYR 77 -2.609 15.064 -0.878 616 HB3 TYR 77 HB3 TYR 77 -3.266 14.920 -2.501 617 HD1 TYR 77 HD1 TYR 77 -2.296 18.143 -0.959 618 HD2 TYR 77 HD2 TYR 77 -1.193 15.048 -3.662 619 HE1 TYR 77 HE1 TYR 77 -0.475 19.546 -1.803 620 HE2 TYR 77 HE2 TYR 77 0.637 16.448 -4.522 621 HH TYR 77 HH TYR 77 1.775 18.341 -4.281 622 H GLN 78 H GLN 78 -5.536 15.649 -3.328 623 HA GLN 78 HA GLN 78 -5.237 17.998 -4.897 624 HB2 GLN 78 HB2 GLN 78 -6.967 15.550 -5.143 625 HB3 GLN 78 HB3 GLN 78 -7.097 16.882 -6.283 626 HG2 GLN 78 HG2 GLN 78 -4.559 15.366 -5.718 627 HG3 GLN 78 HG3 GLN 78 -5.658 15.022 -7.052 628 HE21 GLN 78 HE21 GLN 78 -2.885 15.803 -7.146 629 HE22 GLN 78 HE22 GLN 78 -2.816 17.270 -8.059 630 H ARG 79 H ARG 79 -7.562 16.934 -2.556 631 HA ARG 79 HA ARG 79 -9.672 18.700 -3.319 632 HB2 ARG 79 HB2 ARG 79 -10.072 16.652 -1.987 633 HB3 ARG 79 HB3 ARG 79 -9.156 17.349 -0.661 634 HG2 ARG 79 HG2 ARG 79 -11.511 17.572 -0.216 635 HG3 ARG 79 HG3 ARG 79 -10.811 19.169 -0.502 636 HD2 ARG 79 HD2 ARG 79 -11.606 19.037 -2.849 637 HD3 ARG 79 HD3 ARG 79 -12.398 17.511 -2.460 638 HE ARG 79 HE ARG 79 -13.473 19.149 -0.639 639 HH11 ARG 79 HH11 ARG 79 -12.926 19.591 -4.075 640 HH12 ARG 79 HH12 ARG 79 -14.350 20.566 -4.297 641 HH21 ARG 79 HH21 ARG 79 -15.335 20.456 -0.938 642 HH22 ARG 79 HH22 ARG 79 -15.723 21.043 -2.522 643 H LEU 80 H LEU 80 -7.082 18.749 -0.954 644 HA LEU 80 HA LEU 80 -7.725 21.212 0.259 645 HB2 LEU 80 HB2 LEU 80 -6.275 19.722 1.399 646 HB3 LEU 80 HB3 LEU 80 -5.189 19.620 0.028 647 HG LEU 80 HG LEU 80 -4.824 22.171 0.467 648 HD11 LEU 80 HD11 LEU 80 -6.627 22.326 2.142 649 HD12 LEU 80 HD12 LEU 80 -5.058 22.830 2.768 650 HD13 LEU 80 HD13 LEU 80 -5.709 21.247 3.193 651 HD21 LEU 80 HD21 LEU 80 -3.056 20.556 0.664 652 HD22 LEU 80 HD22 LEU 80 -3.690 19.987 2.210 653 HD23 LEU 80 HD23 LEU 80 -3.017 21.611 2.076 654 H ARG 81 H ARG 81 -5.580 20.358 -2.426 655 HA ARG 81 HA ARG 81 -4.535 22.953 -2.819 656 HB2 ARG 81 HB2 ARG 81 -4.788 20.659 -4.765 657 HB3 ARG 81 HB3 ARG 81 -3.844 22.112 -5.046 658 HG2 ARG 81 HG2 ARG 81 -2.773 21.357 -2.710 659 HG3 ARG 81 HG3 ARG 81 -3.275 19.783 -3.328 660 HD2 ARG 81 HD2 ARG 81 -1.003 20.248 -4.010 661 HD3 ARG 81 HD3 ARG 81 -2.064 20.224 -5.417 662 HE ARG 81 HE ARG 81 -2.036 22.788 -5.036 663 HH11 ARG 81 HH11 ARG 81 0.662 20.597 -4.562 664 HH12 ARG 81 HH12 ARG 81 1.856 21.800 -4.936 665 HH21 ARG 81 HH21 ARG 81 -0.452 24.355 -5.540 666 HH22 ARG 81 HH22 ARG 81 1.227 23.919 -5.502 667 H GLU 82 H GLU 82 -7.238 21.232 -4.402 668 HA GLU 82 HA GLU 82 -7.829 23.376 -6.163 669 HB2 GLU 82 HB2 GLU 82 -9.707 22.154 -6.850 670 HB3 GLU 82 HB3 GLU 82 -8.536 20.929 -6.398 671 HG2 GLU 82 HG2 GLU 82 -9.669 20.692 -4.224 672 HG3 GLU 82 HG3 GLU 82 -10.876 21.859 -4.757 673 H GLN 83 H GLN 83 -8.588 22.744 -2.863 674 HA GLN 83 HA GLN 83 -10.868 24.395 -2.584 675 HB2 GLN 83 HB2 GLN 83 -9.758 22.673 -0.929 676 HB3 GLN 83 HB3 GLN 83 -8.858 24.081 -0.381 677 HG2 GLN 83 HG2 GLN 83 -10.626 24.096 1.066 678 HG3 GLN 83 HG3 GLN 83 -11.220 25.163 -0.206 679 HE21 GLN 83 HE21 GLN 83 -11.504 22.046 1.285 680 HE22 GLN 83 HE22 GLN 83 -12.988 21.589 0.523 681 H LEU 84 H LEU 84 -7.417 24.963 -2.466 682 HA LEU 84 HA LEU 84 -7.593 27.697 -1.636 683 HB2 LEU 84 HB2 LEU 84 -5.620 26.264 -1.224 684 HB3 LEU 84 HB3 LEU 84 -5.337 26.176 -2.952 685 HG LEU 84 HG LEU 84 -5.015 28.679 -2.942 686 HD11 LEU 84 HD11 LEU 84 -6.161 29.235 -0.893 687 HD12 LEU 84 HD12 LEU 84 -4.471 29.723 -0.774 688 HD13 LEU 84 HD13 LEU 84 -5.027 28.263 0.047 689 HD21 LEU 84 HD21 LEU 84 -3.088 27.231 -3.041 690 HD22 LEU 84 HD22 LEU 84 -3.126 26.996 -1.292 691 HD23 LEU 84 HD23 LEU 84 -2.739 28.580 -1.962 692 H LYS 85 H LYS 85 -7.870 25.988 -4.576 693 HA LYS 85 HA LYS 85 -7.459 28.372 -6.218 694 HB2 LYS 85 HB2 LYS 85 -7.993 25.496 -6.988 695 HB3 LYS 85 HB3 LYS 85 -7.731 26.808 -8.132 696 HG2 LYS 85 HG2 LYS 85 -5.483 27.149 -7.177 697 HG3 LYS 85 HG3 LYS 85 -5.751 25.767 -6.113 698 HD2 LYS 85 HD2 LYS 85 -5.995 25.551 -9.100 699 HD3 LYS 85 HD3 LYS 85 -4.446 25.365 -8.278 700 HE2 LYS 85 HE2 LYS 85 -5.609 23.605 -6.844 701 HE3 LYS 85 HE3 LYS 85 -6.915 23.668 -8.030 702 HZ1 LYS 85 HZ1 LYS 85 -5.387 21.891 -8.548 703 HZ2 LYS 85 HZ2 LYS 85 -4.078 22.962 -8.580 704 HZ3 LYS 85 HZ3 LYS 85 -5.295 23.079 -9.748 705 H LYS 86 H LYS 86 -9.815 27.354 -4.374 706 HA LYS 86 HA LYS 86 -12.005 27.746 -6.275 707 HB2 LYS 86 HB2 LYS 86 -11.661 26.061 -4.022 708 HB3 LYS 86 HB3 LYS 86 -12.900 27.234 -3.597 709 HG2 LYS 86 HG2 LYS 86 -13.974 25.322 -4.509 710 HG3 LYS 86 HG3 LYS 86 -14.097 26.623 -5.691 711 HD2 LYS 86 HD2 LYS 86 -12.558 25.644 -7.124 712 HD3 LYS 86 HD3 LYS 86 -11.839 24.667 -5.842 713 HE2 LYS 86 HE2 LYS 86 -13.106 23.206 -7.251 714 HE3 LYS 86 HE3 LYS 86 -13.977 23.382 -5.729 715 HZ1 LYS 86 HZ1 LYS 86 -15.403 25.042 -6.824 716 HZ2 LYS 86 HZ2 LYS 86 -15.499 23.524 -7.561 717 HZ3 LYS 86 HZ3 LYS 86 -14.601 24.758 -8.287 718 H1 GLY 1 H1 GLY 1 -27.782 -10.542 7.906 719 H2 GLY 1 H2 GLY 1 -26.485 -10.317 8.965 720 H3 GLY 1 H3 GLY 1 -26.609 -9.369 7.570 721 HA2 GLY 1 HA3 GLY 1 -28.645 -8.366 8.414 722 HA3 GLY 1 HA2 GLY 1 -28.471 -9.327 9.875 723 H SER 2 H SER 2 -28.068 -6.322 8.723 724 HA SER 2 HA SER 2 -25.509 -5.644 9.808 725 HB2 SER 2 HB2 SER 2 -27.348 -3.414 9.550 726 HB3 SER 2 HB3 SER 2 -25.861 -3.742 8.657 727 HG SER 2 HG SER 2 -27.608 -3.752 7.237 728 H HIS 3 H HIS 3 -28.791 -4.621 10.738 729 HA HIS 3 HA HIS 3 -29.709 -3.962 12.704 730 HB2 HIS 3 HB2 HIS 3 -27.888 -6.160 13.678 731 HB3 HIS 3 HB3 HIS 3 -29.031 -5.331 14.733 732 HD1 HIS 3 HD1 HIS 3 -31.419 -6.115 14.679 733 HD2 HIS 3 HD2 HIS 3 -29.160 -7.642 11.544 734 HE1 HIS 3 HE1 HIS 3 -32.892 -7.804 13.544 735 HE2 HIS 3 HE2 HIS 3 -31.577 -8.547 11.525 736 H MET 4 H MET 4 -27.844 -2.217 11.872 737 HA MET 4 HA MET 4 -26.554 -1.375 14.378 738 HB2 MET 4 HB2 MET 4 -24.777 -0.315 13.024 739 HB3 MET 4 HB3 MET 4 -24.822 -2.059 12.816 740 HG2 MET 4 HG2 MET 4 -26.064 -1.738 10.706 741 HG3 MET 4 HG3 MET 4 -25.901 0.005 10.909 742 HE1 MET 4 HE1 MET 4 -22.396 -2.902 10.148 743 HE2 MET 4 HE2 MET 4 -24.084 -3.379 10.323 744 HE3 MET 4 HE3 MET 4 -23.181 -2.801 11.723 745 H THR 5 H THR 5 -26.880 0.724 14.991 746 HA THR 5 HA THR 5 -28.862 2.202 13.439 747 HB THR 5 HB THR 5 -28.218 3.610 15.803 748 HG1 THR 5 HG1 THR 5 -27.982 2.113 17.315 749 HG21 THR 5 HG21 THR 5 -30.423 3.544 14.837 750 HG22 THR 5 HG22 THR 5 -30.508 2.877 16.466 751 HG23 THR 5 HG23 THR 5 -30.517 1.800 15.072 752 H GLU 6 H GLU 6 -25.522 2.156 13.941 753 HA GLU 6 HA GLU 6 -25.283 4.946 13.037 754 HB2 GLU 6 HB2 GLU 6 -24.251 4.200 15.299 755 HB3 GLU 6 HB3 GLU 6 -23.044 3.388 14.311 756 HG2 GLU 6 HG2 GLU 6 -22.486 5.714 15.159 757 HG3 GLU 6 HG3 GLU 6 -22.230 5.401 13.444 758 H GLN 7 H GLN 7 -23.442 5.347 11.563 759 HA GLN 7 HA GLN 7 -23.116 3.074 9.726 760 HB2 GLN 7 HB2 GLN 7 -24.218 5.249 8.944 761 HB3 GLN 7 HB3 GLN 7 -22.616 5.966 9.050 762 HG2 GLN 7 HG2 GLN 7 -21.777 4.300 7.457 763 HG3 GLN 7 HG3 GLN 7 -23.401 3.624 7.329 764 HE21 GLN 7 HE21 GLN 7 -23.625 4.061 5.167 765 HE22 GLN 7 HE22 GLN 7 -23.788 5.667 4.545 766 HA PRO 8 HA PRO 8 -18.852 3.527 11.246 767 HB2 PRO 8 HB2 PRO 8 -18.534 0.703 11.047 768 HB3 PRO 8 HB3 PRO 8 -18.780 1.649 12.514 769 HG2 PRO 8 HG2 PRO 8 -20.574 -0.188 11.458 770 HG3 PRO 8 HG3 PRO 8 -20.966 1.073 12.638 771 HD2 PRO 8 HD2 PRO 8 -21.390 1.041 9.681 772 HD3 PRO 8 HD3 PRO 8 -22.412 1.724 10.965 773 H LYS 9 H LYS 9 -16.863 1.979 10.349 774 HA LYS 9 HA LYS 9 -16.402 2.798 7.712 775 HB2 LYS 9 HB2 LYS 9 -15.112 0.625 9.367 776 HB3 LYS 9 HB3 LYS 9 -14.516 1.116 7.790 777 HG2 LYS 9 HG2 LYS 9 -13.956 3.288 8.583 778 HG3 LYS 9 HG3 LYS 9 -14.808 3.014 10.103 779 HD2 LYS 9 HD2 LYS 9 -13.192 1.275 10.701 780 HD3 LYS 9 HD3 LYS 9 -12.343 1.533 9.176 781 HE2 LYS 9 HE2 LYS 9 -12.772 3.757 11.147 782 HE3 LYS 9 HE3 LYS 9 -11.404 2.655 11.279 783 HZ1 LYS 9 HZ1 LYS 9 -10.693 3.318 9.073 784 HZ2 LYS 9 HZ2 LYS 9 -10.833 4.675 10.072 785 HZ3 LYS 9 HZ3 LYS 9 -12.024 4.348 8.920 786 H THR 10 H THR 10 -17.438 2.091 5.938 787 HA THR 10 HA THR 10 -18.882 -0.360 5.909 788 HB THR 10 HB THR 10 -19.573 1.687 4.632 789 HG1 THR 10 HG1 THR 10 -20.186 0.403 2.730 790 HG21 THR 10 HG21 THR 10 -18.584 1.990 2.374 791 HG22 THR 10 HG22 THR 10 -17.318 0.843 2.810 792 HG23 THR 10 HG23 THR 10 -17.464 2.367 3.682 793 H ARG 11 H ARG 11 -18.533 -2.181 4.635 794 HA ARG 11 HA ARG 11 -15.710 -2.651 3.971 795 HB2 ARG 11 HB2 ARG 11 -16.195 -5.048 4.328 796 HB3 ARG 11 HB3 ARG 11 -16.490 -4.088 5.769 797 HG2 ARG 11 HG2 ARG 11 -18.847 -4.188 5.451 798 HG3 ARG 11 HG3 ARG 11 -18.654 -4.918 3.855 799 HD2 ARG 11 HD2 ARG 11 -17.263 -6.482 5.809 800 HD3 ARG 11 HD3 ARG 11 -18.920 -6.215 6.342 801 HE ARG 11 HE ARG 11 -18.274 -7.314 3.683 802 HH11 ARG 11 HH11 ARG 11 -20.116 -7.384 6.664 803 HH12 ARG 11 HH12 ARG 11 -21.133 -8.689 6.151 804 HH21 ARG 11 HH21 ARG 11 -19.572 -9.065 3.030 805 HH22 ARG 11 HH22 ARG 11 -20.805 -9.668 4.088 806 H VAL 12 H VAL 12 -15.175 -3.622 2.053 807 HA VAL 12 HA VAL 12 -17.359 -4.017 0.119 808 HB VAL 12 HB VAL 12 -16.216 -1.842 -0.282 809 HG11 VAL 12 HG11 VAL 12 -13.927 -1.875 -1.223 810 HG12 VAL 12 HG12 VAL 12 -13.800 -3.574 -0.768 811 HG13 VAL 12 HG13 VAL 12 -13.992 -2.341 0.477 812 HG21 VAL 12 HG21 VAL 12 -15.906 -3.965 -2.394 813 HG22 VAL 12 HG22 VAL 12 -15.748 -2.235 -2.699 814 HG23 VAL 12 HG23 VAL 12 -17.286 -2.896 -2.141 815 H SER 13 H SER 13 -17.086 -5.674 -1.341 816 HA SER 13 HA SER 13 -14.845 -7.487 -0.790 817 HB2 SER 13 HB2 SER 13 -16.808 -8.880 -2.230 818 HB3 SER 13 HB3 SER 13 -16.465 -9.014 -0.505 819 HG SER 13 HG SER 13 -18.631 -8.003 -1.709 820 H VAL 14 H VAL 14 -13.336 -7.578 -2.320 821 HA VAL 14 HA VAL 14 -14.136 -7.141 -5.120 822 HB VAL 14 HB VAL 14 -11.821 -6.095 -5.431 823 HG11 VAL 14 HG11 VAL 14 -13.961 -4.619 -3.903 824 HG12 VAL 14 HG12 VAL 14 -13.846 -4.800 -5.653 825 HG13 VAL 14 HG13 VAL 14 -12.640 -3.854 -4.784 826 HG21 VAL 14 HG21 VAL 14 -10.825 -5.003 -3.518 827 HG22 VAL 14 HG22 VAL 14 -10.958 -6.732 -3.194 828 HG23 VAL 14 HG23 VAL 14 -12.103 -5.604 -2.466 829 H ARG 15 H ARG 15 -12.623 -8.056 -6.696 830 HA ARG 15 HA ARG 15 -11.452 -10.525 -5.634 831 HB2 ARG 15 HB2 ARG 15 -13.262 -10.746 -7.309 832 HB3 ARG 15 HB3 ARG 15 -12.271 -9.872 -8.468 833 HG2 ARG 15 HG2 ARG 15 -10.785 -11.627 -8.718 834 HG3 ARG 15 HG3 ARG 15 -11.231 -12.358 -7.175 835 HD2 ARG 15 HD2 ARG 15 -12.934 -12.252 -9.663 836 HD3 ARG 15 HD3 ARG 15 -12.097 -13.669 -9.035 837 HE ARG 15 HE ARG 15 -14.282 -12.299 -7.593 838 HH11 ARG 15 HH11 ARG 15 -12.629 -15.236 -8.571 839 HH12 ARG 15 HH12 ARG 15 -13.744 -16.281 -7.756 840 HH21 ARG 15 HH21 ARG 15 -15.736 -13.669 -6.512 841 HH22 ARG 15 HH22 ARG 15 -15.519 -15.390 -6.581 842 H ILE 16 H ILE 16 -9.322 -10.705 -5.554 843 HA ILE 16 HA ILE 16 -7.676 -9.190 -7.476 844 HB ILE 16 HB ILE 16 -6.838 -9.698 -4.620 845 HG12 ILE 16 HG12 ILE 16 -7.696 -7.006 -5.641 846 HG13 ILE 16 HG13 ILE 16 -8.878 -8.124 -4.970 847 HG21 ILE 16 HG21 ILE 16 -5.744 -7.845 -6.734 848 HG22 ILE 16 HG22 ILE 16 -5.038 -9.386 -6.246 849 HG23 ILE 16 HG23 ILE 16 -5.111 -8.048 -5.100 850 HD11 ILE 16 HD11 ILE 16 -7.592 -8.187 -2.878 851 HD12 ILE 16 HD12 ILE 16 -8.152 -6.565 -3.289 852 HD13 ILE 16 HD13 ILE 16 -6.467 -7.011 -3.558 853 H TYR 17 H TYR 17 -6.247 -10.414 -8.545 854 HA TYR 17 HA TYR 17 -5.029 -12.191 -9.237 855 HB2 TYR 17 HB2 TYR 17 -4.290 -11.828 -6.633 856 HB3 TYR 17 HB3 TYR 17 -4.801 -13.511 -6.613 857 HD1 TYR 17 HD2 TYR 17 -2.850 -11.307 -8.920 858 HD2 TYR 17 HD1 TYR 17 -3.086 -15.023 -6.866 859 HE1 TYR 17 HE2 TYR 17 -0.683 -11.963 -9.876 860 HE2 TYR 17 HE1 TYR 17 -0.917 -15.691 -7.814 861 HH TYR 17 HH TYR 17 0.564 -15.194 -9.566 862 H GLY 18 H GLY 18 -8.064 -12.428 -8.404 863 HA2 GLY 18 HA2 GLY 18 -9.396 -14.135 -9.495 864 HA3 GLY 18 HA3 GLY 18 -8.181 -15.307 -9.017 865 H GLN 19 H GLN 19 -8.221 -13.727 -6.308 866 HA GLN 19 HA GLN 19 -10.395 -15.361 -5.193 867 HB2 GLN 19 HB2 GLN 19 -8.181 -14.005 -3.659 868 HB3 GLN 19 HB3 GLN 19 -9.249 -15.285 -3.100 869 HG2 GLN 19 HG2 GLN 19 -7.343 -15.687 -5.377 870 HG3 GLN 19 HG3 GLN 19 -6.862 -15.917 -3.698 871 HE21 GLN 19 HE21 GLN 19 -6.978 -17.846 -5.842 872 HE22 GLN 19 HE22 GLN 19 -8.056 -19.095 -5.320 873 H ASP 20 H ASP 20 -11.731 -14.472 -3.500 874 HA ASP 20 HA ASP 20 -12.306 -11.636 -3.948 875 HB2 ASP 20 HB2 ASP 20 -14.176 -13.185 -4.270 876 HB3 ASP 20 HB3 ASP 20 -13.966 -13.796 -2.632 877 H TYR 21 H TYR 21 -11.876 -10.148 -2.445 878 HA TYR 21 HA TYR 21 -11.369 -11.050 0.315 879 HB2 TYR 21 HB2 TYR 21 -9.866 -8.866 -1.141 880 HB3 TYR 21 HB3 TYR 21 -9.571 -9.416 0.504 881 HD1 TYR 21 HD1 TYR 21 -8.646 -11.702 0.886 882 HD2 TYR 21 HD2 TYR 21 -8.942 -10.007 -3.004 883 HE1 TYR 21 HE1 TYR 21 -7.051 -13.373 0.040 884 HE2 TYR 21 HE2 TYR 21 -7.350 -11.672 -3.857 885 HH TYR 21 HH TYR 21 -5.625 -13.130 -3.071 886 H THR 22 H THR 22 -12.165 -9.789 1.929 887 HA THR 22 HA THR 22 -13.811 -7.489 1.118 888 HB THR 22 HB THR 22 -14.170 -9.270 3.544 889 HG1 THR 22 HG1 THR 22 -14.676 -10.200 1.390 890 HG21 THR 22 HG21 THR 22 -16.364 -8.127 3.714 891 HG22 THR 22 HG22 THR 22 -15.871 -7.046 2.409 892 HG23 THR 22 HG23 THR 22 -15.001 -7.032 3.942 893 H ILE 23 H ILE 23 -13.152 -5.563 1.820 894 HA ILE 23 HA ILE 23 -11.626 -5.386 4.316 895 HB ILE 23 HB ILE 23 -10.033 -3.778 3.335 896 HG12 ILE 23 HG12 ILE 23 -11.574 -3.309 1.317 897 HG13 ILE 23 HG13 ILE 23 -9.837 -3.307 1.061 898 HG21 ILE 23 HG21 ILE 23 -10.017 -6.582 2.269 899 HG22 ILE 23 HG22 ILE 23 -9.196 -5.935 3.688 900 HG23 ILE 23 HG23 ILE 23 -8.660 -5.470 2.075 901 HD11 ILE 23 HD11 ILE 23 -9.897 -5.320 -0.110 902 HD12 ILE 23 HD12 ILE 23 -11.311 -4.440 -0.676 903 HD13 ILE 23 HD13 ILE 23 -11.492 -5.739 0.499 904 H VAL 24 H VAL 24 -11.090 -2.792 4.493 905 HA VAL 24 HA VAL 24 -13.723 -1.609 4.699 906 HB VAL 24 HB VAL 24 -11.009 -0.571 5.554 907 HG11 VAL 24 HG11 VAL 24 -13.768 0.554 6.002 908 HG12 VAL 24 HG12 VAL 24 -12.433 1.312 5.136 909 HG13 VAL 24 HG13 VAL 24 -12.333 1.078 6.881 910 HG21 VAL 24 HG21 VAL 24 -11.670 -1.155 7.789 911 HG22 VAL 24 HG22 VAL 24 -11.862 -2.574 6.760 912 HG23 VAL 24 HG23 VAL 24 -13.275 -1.633 7.238 913 H GLY 25 H GLY 25 -14.569 -0.219 3.278 914 HA2 GLY 25 HA2 GLY 25 -12.724 1.207 1.467 915 HA3 GLY 25 HA3 GLY 25 -14.159 0.401 0.851 916 H ALA 26 H ALA 26 -13.760 2.333 3.786 917 HA ALA 26 HA ALA 26 -16.148 3.805 3.243 918 HB1 ALA 26 HB1 ALA 26 -14.060 4.313 5.357 919 HB2 ALA 26 HB2 ALA 26 -15.442 3.230 5.528 920 HB3 ALA 26 HB3 ALA 26 -15.698 4.963 5.322 921 H GLU 27 H GLU 27 -15.713 4.793 1.240 922 HA GLU 27 HA GLU 27 -14.686 7.430 1.456 923 HB2 GLU 27 HB2 GLU 27 -12.526 6.392 1.246 924 HB3 GLU 27 HB3 GLU 27 -13.053 5.420 -0.114 925 HG2 GLU 27 HG2 GLU 27 -13.307 7.469 -1.448 926 HG3 GLU 27 HG3 GLU 27 -12.714 8.409 -0.077 927 H SER 28 H SER 28 -14.753 5.188 -1.327 928 HA SER 28 HA SER 28 -17.255 6.213 -2.282 929 HB2 SER 28 HB2 SER 28 -15.062 6.635 -4.258 930 HB3 SER 28 HB3 SER 28 -16.577 7.517 -4.049 931 HG SER 28 HG SER 28 -15.531 8.318 -2.032 932 HA PRO 29 HA PRO 29 -17.338 2.014 -3.694 933 HB2 PRO 29 HB2 PRO 29 -19.106 2.429 -5.812 934 HB3 PRO 29 HB3 PRO 29 -19.555 2.075 -4.142 935 HG2 PRO 29 HG2 PRO 29 -19.419 4.697 -5.555 936 HG3 PRO 29 HG3 PRO 29 -20.589 4.128 -4.350 937 HD2 PRO 29 HD2 PRO 29 -18.653 5.845 -3.686 938 HD3 PRO 29 HD3 PRO 29 -19.150 4.552 -2.572 939 H ALA 30 H ALA 30 -17.015 4.558 -6.165 940 HA ALA 30 HA ALA 30 -15.892 2.753 -8.091 941 HB1 ALA 30 HB1 ALA 30 -15.525 4.732 -9.455 942 HB2 ALA 30 HB2 ALA 30 -15.908 5.767 -8.081 943 HB3 ALA 30 HB3 ALA 30 -17.151 4.731 -8.778 944 H HIS 31 H HIS 31 -14.593 5.113 -5.816 945 HA HIS 31 HA HIS 31 -11.925 5.051 -6.746 946 HB2 HIS 31 HB2 HIS 31 -13.150 6.714 -5.122 947 HB3 HIS 31 HB3 HIS 31 -12.570 5.613 -3.878 948 HD1 HIS 31 HD1 HIS 31 -10.346 6.206 -2.956 949 HD2 HIS 31 HD2 HIS 31 -10.876 7.673 -6.813 950 HE1 HIS 31 HE1 HIS 31 -8.283 7.547 -3.465 951 HE2 HIS 31 HE2 HIS 31 -8.792 8.683 -5.654 952 H ILE 32 H ILE 32 -13.684 3.105 -4.423 953 HA ILE 32 HA ILE 32 -11.294 1.708 -3.558 954 HB ILE 32 HB ILE 32 -12.707 0.428 -2.084 955 HG12 ILE 32 HG12 ILE 32 -15.058 1.756 -3.474 956 HG13 ILE 32 HG13 ILE 32 -14.621 0.059 -3.588 957 HG21 ILE 32 HG21 ILE 32 -12.064 2.774 -1.514 958 HG22 ILE 32 HG22 ILE 32 -13.491 2.179 -0.672 959 HG23 ILE 32 HG23 ILE 32 -13.670 3.281 -2.038 960 HD11 ILE 32 HD11 ILE 32 -15.002 -0.078 -1.106 961 HD12 ILE 32 HD12 ILE 32 -16.433 0.209 -2.096 962 HD13 ILE 32 HD13 ILE 32 -15.696 1.541 -1.209 963 H ARG 33 H ARG 33 -13.412 1.435 -6.145 964 HA ARG 33 HA ARG 33 -13.278 -1.432 -6.372 965 HB2 ARG 33 HB2 ARG 33 -15.133 0.087 -7.279 966 HB3 ARG 33 HB3 ARG 33 -14.020 0.475 -8.582 967 HG2 ARG 33 HG2 ARG 33 -14.280 -1.527 -9.585 968 HG3 ARG 33 HG3 ARG 33 -14.432 -2.396 -8.056 969 HD2 ARG 33 HD2 ARG 33 -16.519 -2.460 -9.310 970 HD3 ARG 33 HD3 ARG 33 -16.712 -1.560 -7.807 971 HE ARG 33 HE ARG 33 -16.083 0.121 -10.043 972 HH11 ARG 33 HH11 ARG 33 -18.680 -1.515 -8.359 973 HH12 ARG 33 HH12 ARG 33 -19.911 -0.464 -8.979 974 HH21 ARG 33 HH21 ARG 33 -17.692 1.519 -10.840 975 HH22 ARG 33 HH22 ARG 33 -19.347 1.281 -10.374 976 H LEU 34 H LEU 34 -11.492 1.328 -7.564 977 HA LEU 34 HA LEU 34 -9.994 -0.214 -9.476 978 HB2 LEU 34 HB2 LEU 34 -8.763 1.787 -9.923 979 HB3 LEU 34 HB3 LEU 34 -10.460 2.195 -9.792 980 HG LEU 34 HG LEU 34 -9.652 2.688 -7.252 981 HD11 LEU 34 HD11 LEU 34 -7.536 3.904 -7.352 982 HD12 LEU 34 HD12 LEU 34 -7.330 3.416 -9.035 983 HD13 LEU 34 HD13 LEU 34 -7.313 2.200 -7.757 984 HD21 LEU 34 HD21 LEU 34 -9.687 5.030 -7.880 985 HD22 LEU 34 HD22 LEU 34 -10.965 4.146 -8.718 986 HD23 LEU 34 HD23 LEU 34 -9.492 4.596 -9.576 987 H VAL 35 H VAL 35 -9.756 0.424 -6.118 988 HA VAL 35 HA VAL 35 -7.014 0.302 -5.639 989 HB VAL 35 HB VAL 35 -9.161 -0.957 -3.912 990 HG11 VAL 35 HG11 VAL 35 -6.490 0.174 -3.096 991 HG12 VAL 35 HG12 VAL 35 -6.778 -1.540 -3.396 992 HG13 VAL 35 HG13 VAL 35 -7.633 -0.718 -2.091 993 HG21 VAL 35 HG21 VAL 35 -9.434 1.120 -2.824 994 HG22 VAL 35 HG22 VAL 35 -9.529 1.460 -4.553 995 HG23 VAL 35 HG23 VAL 35 -8.053 1.823 -3.662 996 H ALA 36 H ALA 36 -9.375 -2.296 -5.944 997 HA ALA 36 HA ALA 36 -7.660 -4.462 -5.467 998 HB1 ALA 36 HB1 ALA 36 -9.362 -5.843 -6.281 999 HB2 ALA 36 HB2 ALA 36 -9.971 -4.599 -7.371 1000 HB3 ALA 36 HB3 ALA 36 -10.205 -4.436 -5.633 1001 H ALA 37 H ALA 37 -8.608 -2.946 -8.535 1002 HA ALA 37 HA ALA 37 -7.158 -4.647 -10.237 1003 HB1 ALA 37 HB1 ALA 37 -8.956 -3.175 -11.012 1004 HB2 ALA 37 HB2 ALA 37 -7.476 -2.932 -11.936 1005 HB3 ALA 37 HB3 ALA 37 -7.943 -1.767 -10.698 1006 H PHE 38 H PHE 38 -6.251 -1.778 -8.455 1007 HA PHE 38 HA PHE 38 -3.797 -1.251 -9.738 1008 HB2 PHE 38 HB2 PHE 38 -4.879 0.399 -8.311 1009 HB3 PHE 38 HB3 PHE 38 -4.710 -0.659 -6.914 1010 HD1 PHE 38 HD1 PHE 38 -2.512 0.798 -9.563 1011 HD2 PHE 38 HD2 PHE 38 -3.053 -0.109 -5.438 1012 HE1 PHE 38 HE1 PHE 38 -0.335 1.818 -9.056 1013 HE2 PHE 38 HE2 PHE 38 -0.875 0.911 -4.928 1014 HZ PHE 38 HZ PHE 38 0.486 1.879 -6.736 1015 H VAL 39 H VAL 39 -4.631 -3.234 -6.920 1016 HA VAL 39 HA VAL 39 -1.940 -3.997 -6.352 1017 HB VAL 39 HB VAL 39 -4.521 -5.367 -5.567 1018 HG11 VAL 39 HG11 VAL 39 -1.740 -5.662 -4.436 1019 HG12 VAL 39 HG12 VAL 39 -2.618 -6.870 -5.376 1020 HG13 VAL 39 HG13 VAL 39 -3.202 -6.399 -3.780 1021 HG21 VAL 39 HG21 VAL 39 -2.890 -3.199 -4.284 1022 HG22 VAL 39 HG22 VAL 39 -3.976 -4.222 -3.349 1023 HG23 VAL 39 HG23 VAL 39 -4.618 -3.215 -4.647 1024 H ASP 40 H ASP 40 -4.572 -5.386 -8.226 1025 HA ASP 40 HA ASP 40 -3.464 -7.889 -8.797 1026 HB2 ASP 40 HB2 ASP 40 -5.822 -6.881 -9.337 1027 HB3 ASP 40 HB3 ASP 40 -5.068 -6.398 -10.851 1028 H ASP 41 H ASP 41 -3.049 -4.750 -10.330 1029 HA ASP 41 HA ASP 41 -1.474 -5.595 -12.526 1030 HB2 ASP 41 HB2 ASP 41 -2.179 -3.438 -12.894 1031 HB3 ASP 41 HB3 ASP 41 -2.064 -2.998 -11.196 1032 H LYS 42 H LYS 42 -0.651 -4.420 -9.304 1033 HA LYS 42 HA LYS 42 2.127 -4.370 -9.587 1034 HB2 LYS 42 HB2 LYS 42 0.271 -4.033 -7.458 1035 HB3 LYS 42 HB3 LYS 42 1.470 -5.195 -6.919 1036 HG2 LYS 42 HG2 LYS 42 2.615 -3.385 -6.306 1037 HG3 LYS 42 HG3 LYS 42 3.045 -3.264 -8.009 1038 HD2 LYS 42 HD2 LYS 42 0.521 -2.059 -7.740 1039 HD3 LYS 42 HD3 LYS 42 1.495 -1.480 -6.390 1040 HE2 LYS 42 HE2 LYS 42 1.736 0.003 -8.285 1041 HE3 LYS 42 HE3 LYS 42 3.260 -0.823 -7.963 1042 HZ1 LYS 42 HZ1 LYS 42 3.017 -2.122 -9.828 1043 HZ2 LYS 42 HZ2 LYS 42 2.479 -0.659 -10.366 1044 HZ3 LYS 42 HZ3 LYS 42 1.353 -1.860 -9.980 1045 H MET 43 H MET 43 0.044 -6.965 -8.324 1046 HA MET 43 HA MET 43 2.128 -8.792 -7.847 1047 HB2 MET 43 HB2 MET 43 -0.815 -9.191 -8.357 1048 HB3 MET 43 HB3 MET 43 0.273 -10.538 -8.055 1049 HG2 MET 43 HG2 MET 43 0.936 -9.219 -5.934 1050 HG3 MET 43 HG3 MET 43 -0.577 -8.356 -6.207 1051 HE1 MET 43 HE1 MET 43 -0.094 -12.801 -5.131 1052 HE2 MET 43 HE2 MET 43 1.198 -11.628 -5.373 1053 HE3 MET 43 HE3 MET 43 0.314 -12.264 -6.759 1054 H HIS 44 H HIS 44 0.232 -8.105 -10.717 1055 HA HIS 44 HA HIS 44 1.108 -10.314 -12.246 1056 HB2 HIS 44 HB2 HIS 44 -0.885 -9.090 -12.868 1057 HB3 HIS 44 HB3 HIS 44 0.043 -7.614 -13.092 1058 HD1 HIS 44 HD1 HIS 44 0.217 -7.114 -15.495 1059 HD2 HIS 44 HD2 HIS 44 0.412 -11.204 -14.761 1060 HE1 HIS 44 HE1 HIS 44 0.580 -8.189 -17.739 1061 HE2 HIS 44 HE2 HIS 44 0.493 -10.664 -17.289 1062 H GLU 45 H GLU 45 2.434 -7.056 -11.804 1063 HA GLU 45 HA GLU 45 4.412 -7.435 -13.869 1064 HB2 GLU 45 HB2 GLU 45 5.076 -5.233 -13.480 1065 HB3 GLU 45 HB3 GLU 45 3.356 -5.211 -13.117 1066 HG2 GLU 45 HG2 GLU 45 3.868 -5.373 -10.721 1067 HG3 GLU 45 HG3 GLU 45 5.589 -5.362 -11.098 1068 H PHE 46 H PHE 46 4.177 -8.326 -10.599 1069 HA PHE 46 HA PHE 46 7.089 -8.447 -10.326 1070 HB2 PHE 46 HB2 PHE 46 4.842 -8.318 -8.401 1071 HB3 PHE 46 HB3 PHE 46 6.253 -9.248 -7.911 1072 HD1 PHE 46 HD2 PHE 46 8.506 -8.123 -7.925 1073 HD2 PHE 46 HD1 PHE 46 4.849 -5.974 -8.310 1074 HE1 PHE 46 HE2 PHE 46 9.658 -6.048 -7.273 1075 HE2 PHE 46 HE1 PHE 46 5.996 -3.898 -7.657 1076 HZ PHE 46 HZ PHE 46 8.405 -3.936 -7.139 1077 H SER 47 H SER 47 4.307 -10.496 -10.740 1078 HA SER 47 HA SER 47 5.499 -12.900 -9.806 1079 HB2 SER 47 HB2 SER 47 3.671 -13.910 -11.411 1080 HB3 SER 47 HB3 SER 47 3.201 -13.099 -9.918 1081 HG SER 47 HG SER 47 2.482 -11.405 -11.033 1082 H GLU 48 H GLU 48 5.896 -11.055 -12.629 1083 HA GLU 48 HA GLU 48 6.871 -13.233 -14.255 1084 HB2 GLU 48 HB2 GLU 48 7.445 -11.446 -15.880 1085 HB3 GLU 48 HB3 GLU 48 5.759 -11.414 -15.387 1086 HG2 GLU 48 HG2 GLU 48 5.965 -9.430 -14.298 1087 HG3 GLU 48 HG3 GLU 48 7.657 -9.703 -13.886 1088 H LYS 49 H LYS 49 8.097 -11.407 -11.745 1089 HA LYS 49 HA LYS 49 10.846 -11.410 -12.699 1090 HB2 LYS 49 HB2 LYS 49 9.602 -10.480 -10.105 1091 HB3 LYS 49 HB3 LYS 49 11.328 -10.433 -10.427 1092 HG2 LYS 49 HG2 LYS 49 10.128 -9.159 -12.606 1093 HG3 LYS 49 HG3 LYS 49 9.283 -8.566 -11.175 1094 HD2 LYS 49 HD2 LYS 49 12.287 -8.647 -11.413 1095 HD3 LYS 49 HD3 LYS 49 11.318 -7.243 -11.858 1096 HE2 LYS 49 HE2 LYS 49 10.583 -6.926 -9.636 1097 HE3 LYS 49 HE3 LYS 49 11.164 -8.512 -9.135 1098 HZ1 LYS 49 HZ1 LYS 49 12.641 -6.783 -8.360 1099 HZ2 LYS 49 HZ2 LYS 49 12.857 -6.206 -9.934 1100 HZ3 LYS 49 HZ3 LYS 49 13.437 -7.736 -9.510 1101 H GLN 50 H GLN 50 8.908 -12.858 -10.126 1102 HA GLN 50 HA GLN 50 9.169 -14.667 -8.798 1103 HB2 GLN 50 HB2 GLN 50 10.660 -15.651 -11.230 1104 HB3 GLN 50 HB3 GLN 50 10.218 -16.671 -9.869 1105 HG2 GLN 50 HG2 GLN 50 7.815 -15.887 -10.330 1106 HG3 GLN 50 HG3 GLN 50 8.446 -15.361 -11.890 1107 HE21 GLN 50 HE21 GLN 50 7.694 -18.071 -9.872 1108 HE22 GLN 50 HE22 GLN 50 7.856 -19.285 -11.093 1109 HA PRO 51 HA PRO 51 13.469 -13.430 -7.509 1110 HB2 PRO 51 HB2 PRO 51 12.772 -12.596 -5.002 1111 HB3 PRO 51 HB3 PRO 51 12.819 -11.531 -6.409 1112 HG2 PRO 51 HG2 PRO 51 10.485 -12.825 -5.080 1113 HG3 PRO 51 HG3 PRO 51 10.612 -11.217 -5.813 1114 HD2 PRO 51 HD2 PRO 51 9.412 -13.348 -7.032 1115 HD3 PRO 51 HD3 PRO 51 10.160 -12.006 -7.917 1116 H MET 52 H MET 52 10.939 -14.918 -5.470 1117 HA MET 52 HA MET 52 12.947 -16.897 -4.627 1118 HB2 MET 52 HB2 MET 52 11.805 -17.116 -2.519 1119 HB3 MET 52 HB3 MET 52 12.166 -15.419 -2.801 1120 HG2 MET 52 HG2 MET 52 9.497 -16.625 -3.444 1121 HG3 MET 52 HG3 MET 52 9.887 -15.978 -1.853 1122 HE1 MET 52 HE1 MET 52 11.697 -13.432 -2.541 1123 HE2 MET 52 HE2 MET 52 10.394 -13.473 -1.354 1124 HE3 MET 52 HE3 MET 52 10.438 -12.198 -2.571 1125 H LEU 53 H LEU 53 10.431 -16.591 -6.649 1126 HA LEU 53 HA LEU 53 8.914 -17.966 -7.621 1127 HB2 LEU 53 HB2 LEU 53 11.057 -19.852 -6.722 1128 HB3 LEU 53 HB3 LEU 53 9.592 -20.492 -7.438 1129 HG LEU 53 HG LEU 53 10.096 -18.893 -9.404 1130 HD11 LEU 53 HD11 LEU 53 12.472 -18.397 -9.723 1131 HD12 LEU 53 HD12 LEU 53 12.816 -19.021 -8.107 1132 HD13 LEU 53 HD13 LEU 53 11.824 -17.577 -8.303 1133 HD21 LEU 53 HD21 LEU 53 11.536 -20.562 -10.449 1134 HD22 LEU 53 HD22 LEU 53 10.238 -21.326 -9.532 1135 HD23 LEU 53 HD23 LEU 53 11.873 -21.271 -8.870 1136 H ASP 54 H ASP 54 7.839 -17.086 -5.419 1137 HA ASP 54 HA ASP 54 6.369 -19.380 -4.390 1138 HB2 ASP 54 HB2 ASP 54 8.128 -19.072 -2.738 1139 HB3 ASP 54 HB3 ASP 54 7.744 -17.359 -2.605 1140 H VAL 55 H VAL 55 4.266 -18.950 -3.902 1141 HA VAL 55 HA VAL 55 3.135 -16.610 -5.035 1142 HB VAL 55 HB VAL 55 1.739 -18.680 -3.348 1143 HG11 VAL 55 HG11 VAL 55 -0.278 -17.953 -4.479 1144 HG12 VAL 55 HG12 VAL 55 0.639 -16.758 -5.396 1145 HG13 VAL 55 HG13 VAL 55 0.478 -16.594 -3.648 1146 HG21 VAL 55 HG21 VAL 55 2.912 -19.695 -5.238 1147 HG22 VAL 55 HG22 VAL 55 2.111 -18.575 -6.340 1148 HG23 VAL 55 HG23 VAL 55 1.163 -19.768 -5.448 1149 HA PRO 56 HA PRO 56 1.677 -15.420 -0.524 1150 HB2 PRO 56 HB2 PRO 56 3.391 -16.420 1.440 1151 HB3 PRO 56 HB3 PRO 56 1.741 -16.960 1.128 1152 HG2 PRO 56 HG2 PRO 56 4.326 -18.151 0.282 1153 HG3 PRO 56 HG3 PRO 56 2.800 -18.947 0.702 1154 HD2 PRO 56 HD2 PRO 56 3.644 -18.702 -1.839 1155 HD3 PRO 56 HD3 PRO 56 1.924 -18.650 -1.412 1156 H LYS 57 H LYS 57 5.149 -16.063 -0.957 1157 HA LYS 57 HA LYS 57 5.991 -13.695 0.361 1158 HB2 LYS 57 HB2 LYS 57 7.281 -15.728 -1.388 1159 HB3 LYS 57 HB3 LYS 57 8.108 -14.194 -1.176 1160 HG2 LYS 57 HG2 LYS 57 8.639 -16.200 0.396 1161 HG3 LYS 57 HG3 LYS 57 8.526 -14.570 1.057 1162 HD2 LYS 57 HD2 LYS 57 6.724 -15.078 2.302 1163 HD3 LYS 57 HD3 LYS 57 5.969 -15.997 1.000 1164 HE2 LYS 57 HE2 LYS 57 8.145 -16.969 2.841 1165 HE3 LYS 57 HE3 LYS 57 6.444 -17.418 2.912 1166 HZ1 LYS 57 HZ1 LYS 57 6.807 -18.208 0.522 1167 HZ2 LYS 57 HZ2 LYS 57 7.435 -19.155 1.780 1168 HZ3 LYS 57 HZ3 LYS 57 8.461 -18.150 0.894 1169 H LEU 58 H LEU 58 4.943 -14.388 -2.871 1170 HA LEU 58 HA LEU 58 5.959 -11.995 -4.063 1171 HB2 LEU 58 HB2 LEU 58 5.167 -14.273 -5.135 1172 HB3 LEU 58 HB3 LEU 58 3.598 -13.503 -5.135 1173 HG LEU 58 HG LEU 58 4.776 -13.382 -7.308 1174 HD11 LEU 58 HD11 LEU 58 4.335 -10.679 -6.061 1175 HD12 LEU 58 HD12 LEU 58 3.068 -11.733 -6.690 1176 HD13 LEU 58 HD13 LEU 58 4.289 -11.077 -7.778 1177 HD21 LEU 58 HD21 LEU 58 7.054 -13.014 -6.077 1178 HD22 LEU 58 HD22 LEU 58 6.621 -11.309 -6.224 1179 HD23 LEU 58 HD23 LEU 58 6.762 -12.309 -7.665 1180 H ALA 59 H ALA 59 2.901 -13.022 -2.666 1181 HA ALA 59 HA ALA 59 1.347 -10.785 -3.350 1182 HB1 ALA 59 HB1 ALA 59 1.135 -12.814 -1.151 1183 HB2 ALA 59 HB2 ALA 59 0.190 -12.691 -2.636 1184 HB3 ALA 59 HB3 ALA 59 -0.041 -11.513 -1.343 1185 H VAL 60 H VAL 60 3.331 -11.426 -0.483 1186 HA VAL 60 HA VAL 60 2.607 -8.950 0.765 1187 HB VAL 60 HB VAL 60 3.325 -11.001 2.031 1188 HG11 VAL 60 HG11 VAL 60 5.258 -11.564 0.597 1189 HG12 VAL 60 HG12 VAL 60 5.663 -11.475 2.310 1190 HG13 VAL 60 HG13 VAL 60 6.098 -10.151 1.229 1191 HG21 VAL 60 HG21 VAL 60 4.854 -8.467 2.591 1192 HG22 VAL 60 HG22 VAL 60 4.531 -9.759 3.748 1193 HG23 VAL 60 HG23 VAL 60 3.196 -8.812 3.088 1194 H LEU 61 H LEU 61 5.021 -9.967 -1.481 1195 HA LEU 61 HA LEU 61 6.979 -8.001 -1.074 1196 HB2 LEU 61 HB2 LEU 61 7.341 -9.984 -2.444 1197 HB3 LEU 61 HB3 LEU 61 6.147 -9.434 -3.597 1198 HG LEU 61 HG LEU 61 7.647 -7.442 -4.032 1199 HD11 LEU 61 HD11 LEU 61 8.987 -7.583 -1.997 1200 HD12 LEU 61 HD12 LEU 61 9.998 -7.680 -3.440 1201 HD13 LEU 61 HD13 LEU 61 9.625 -9.140 -2.523 1202 HD21 LEU 61 HD21 LEU 61 8.616 -10.223 -4.660 1203 HD22 LEU 61 HD22 LEU 61 9.188 -8.759 -5.456 1204 HD23 LEU 61 HD23 LEU 61 7.501 -9.244 -5.612 1205 H THR 62 H THR 62 4.029 -8.010 -2.998 1206 HA THR 62 HA THR 62 4.507 -5.427 -4.139 1207 HB THR 62 HB THR 62 1.922 -5.723 -4.608 1208 HG1 THR 62 HG1 THR 62 1.662 -7.549 -3.238 1209 HG21 THR 62 HG21 THR 62 3.722 -5.769 -6.280 1210 HG22 THR 62 HG22 THR 62 2.500 -6.997 -6.607 1211 HG23 THR 62 HG23 THR 62 4.040 -7.457 -5.881 1212 H ALA 63 H ALA 63 2.976 -6.607 -1.249 1213 HA ALA 63 HA ALA 63 1.342 -4.393 -0.653 1214 HB1 ALA 63 HB1 ALA 63 1.244 -6.632 0.457 1215 HB2 ALA 63 HB2 ALA 63 1.219 -5.262 1.569 1216 HB3 ALA 63 HB3 ALA 63 2.703 -6.193 1.344 1217 H VAL 64 H VAL 64 4.680 -5.166 0.248 1218 HA VAL 64 HA VAL 64 5.034 -2.764 1.744 1219 HB VAL 64 HB VAL 64 6.303 -4.889 2.129 1220 HG11 VAL 64 HG11 VAL 64 7.743 -4.033 -0.368 1221 HG12 VAL 64 HG12 VAL 64 6.877 -5.543 -0.088 1222 HG13 VAL 64 HG13 VAL 64 8.372 -5.212 0.784 1223 HG21 VAL 64 HG21 VAL 64 8.429 -3.760 2.673 1224 HG22 VAL 64 HG22 VAL 64 7.010 -2.845 3.180 1225 HG23 VAL 64 HG23 VAL 64 7.895 -2.361 1.737 1226 H GLN 65 H GLN 65 5.479 -3.657 -1.598 1227 HA GLN 65 HA GLN 65 7.162 -1.499 -2.338 1228 HB2 GLN 65 HB2 GLN 65 6.706 -3.621 -3.669 1229 HB3 GLN 65 HB3 GLN 65 5.177 -2.889 -4.139 1230 HG2 GLN 65 HG2 GLN 65 7.549 -1.202 -4.585 1231 HG3 GLN 65 HG3 GLN 65 7.479 -2.668 -5.560 1232 HE21 GLN 65 HE21 GLN 65 7.278 0.085 -6.414 1233 HE22 GLN 65 HE22 GLN 65 5.746 0.253 -7.197 1234 H ILE 66 H ILE 66 3.655 -1.980 -2.448 1235 HA ILE 66 HA ILE 66 2.952 0.507 -3.538 1236 HB ILE 66 HB ILE 66 1.439 -1.346 -1.690 1237 HG12 ILE 66 HG12 ILE 66 0.976 -0.777 -4.615 1238 HG13 ILE 66 HG13 ILE 66 2.067 -2.045 -4.065 1239 HG21 ILE 66 HG21 ILE 66 -0.589 -0.073 -2.351 1240 HG22 ILE 66 HG22 ILE 66 0.458 1.134 -3.097 1241 HG23 ILE 66 HG23 ILE 66 0.532 0.856 -1.358 1242 HD11 ILE 66 HD11 ILE 66 -0.001 -3.064 -4.588 1243 HD12 ILE 66 HD12 ILE 66 -0.907 -1.871 -3.661 1244 HD13 ILE 66 HD13 ILE 66 0.122 -3.038 -2.829 1245 H ALA 67 H ALA 67 3.379 -0.545 -0.190 1246 HA ALA 67 HA ALA 67 2.539 1.754 1.126 1247 HB1 ALA 67 HB1 ALA 67 3.835 0.967 3.020 1248 HB2 ALA 67 HB2 ALA 67 4.735 -0.131 1.973 1249 HB3 ALA 67 HB3 ALA 67 3.008 -0.382 2.240 1250 H SER 68 H SER 68 5.836 0.891 0.069 1251 HA SER 68 HA SER 68 7.067 3.245 0.987 1252 HB2 SER 68 HB2 SER 68 8.286 1.169 0.354 1253 HB3 SER 68 HB3 SER 68 7.935 1.513 -1.340 1254 HG SER 68 HG SER 68 9.482 3.078 0.456 1255 H GLU 69 H GLU 69 5.443 2.499 -2.046 1256 HA GLU 69 HA GLU 69 6.319 4.804 -3.442 1257 HB2 GLU 69 HB2 GLU 69 3.999 2.926 -3.828 1258 HB3 GLU 69 HB3 GLU 69 4.248 4.314 -4.877 1259 HG2 GLU 69 HG2 GLU 69 6.194 2.057 -4.442 1260 HG3 GLU 69 HG3 GLU 69 5.160 2.284 -5.853 1261 H TYR 70 H TYR 70 3.364 4.117 -1.592 1262 HA TYR 70 HA TYR 70 2.284 6.722 -2.065 1263 HB2 TYR 70 HB2 TYR 70 1.498 4.386 -0.375 1264 HB3 TYR 70 HB3 TYR 70 0.730 5.946 -0.108 1265 HD1 TYR 70 HD2 TYR 70 1.361 3.355 -2.678 1266 HD2 TYR 70 HD1 TYR 70 -0.990 6.701 -1.519 1267 HE1 TYR 70 HE2 TYR 70 -0.176 2.913 -4.542 1268 HE2 TYR 70 HE1 TYR 70 -2.537 6.268 -3.378 1269 HH TYR 70 HH TYR 70 -2.561 3.389 -5.119 1270 H LEU 71 H LEU 71 4.235 5.286 0.469 1271 HA LEU 71 HA LEU 71 3.839 7.254 2.440 1272 HB2 LEU 71 HB2 LEU 71 5.834 5.142 1.922 1273 HB3 LEU 71 HB3 LEU 71 6.391 6.470 2.922 1274 HG LEU 71 HG LEU 71 3.808 5.058 3.561 1275 HD11 LEU 71 HD11 LEU 71 5.528 3.306 3.435 1276 HD12 LEU 71 HD12 LEU 71 4.970 3.585 5.083 1277 HD13 LEU 71 HD13 LEU 71 6.523 4.229 4.564 1278 HD21 LEU 71 HD21 LEU 71 4.643 7.280 4.596 1279 HD22 LEU 71 HD22 LEU 71 5.734 6.240 5.511 1280 HD23 LEU 71 HD23 LEU 71 3.989 6.020 5.644 1281 H LYS 72 H LYS 72 6.105 7.081 -0.263 1282 HA LYS 72 HA LYS 72 7.649 9.333 0.371 1283 HB2 LYS 72 HB2 LYS 72 6.969 7.981 -2.234 1284 HB3 LYS 72 HB3 LYS 72 7.959 9.430 -2.198 1285 HG2 LYS 72 HG2 LYS 72 9.510 8.235 -0.659 1286 HG3 LYS 72 HG3 LYS 72 8.569 6.770 -0.939 1287 HD2 LYS 72 HD2 LYS 72 9.842 8.389 -3.140 1288 HD3 LYS 72 HD3 LYS 72 10.624 7.012 -2.366 1289 HE2 LYS 72 HE2 LYS 72 7.956 6.904 -3.773 1290 HE3 LYS 72 HE3 LYS 72 9.492 6.440 -4.502 1291 HZ1 LYS 72 HZ1 LYS 72 8.231 5.175 -2.124 1292 HZ2 LYS 72 HZ2 LYS 72 9.733 4.746 -2.779 1293 HZ3 LYS 72 HZ3 LYS 72 8.322 4.512 -3.686 1294 H LEU 73 H LEU 73 4.651 8.969 -1.418 1295 HA LEU 73 HA LEU 73 4.454 11.682 -2.227 1296 HB2 LEU 73 HB2 LEU 73 3.345 9.837 -3.408 1297 HB3 LEU 73 HB3 LEU 73 2.326 9.553 -2.012 1298 HG LEU 73 HG LEU 73 1.220 11.689 -2.327 1299 HD11 LEU 73 HD11 LEU 73 3.249 12.065 -4.507 1300 HD12 LEU 73 HD12 LEU 73 2.891 13.125 -3.144 1301 HD13 LEU 73 HD13 LEU 73 1.732 12.963 -4.461 1302 HD21 LEU 73 HD21 LEU 73 0.361 9.762 -3.538 1303 HD22 LEU 73 HD22 LEU 73 1.420 10.135 -4.899 1304 HD23 LEU 73 HD23 LEU 73 0.124 11.247 -4.460 1305 H LYS 74 H LYS 74 3.192 9.839 0.519 1306 HA LYS 74 HA LYS 74 1.507 11.877 1.508 1307 HB2 LYS 74 HB2 LYS 74 1.095 10.503 3.281 1308 HB3 LYS 74 HB3 LYS 74 1.787 9.317 2.186 1309 HG2 LYS 74 HG2 LYS 74 3.719 9.126 3.401 1310 HG3 LYS 74 HG3 LYS 74 3.612 10.761 4.035 1311 HD2 LYS 74 HD2 LYS 74 1.521 8.808 4.849 1312 HD3 LYS 74 HD3 LYS 74 3.128 8.658 5.559 1313 HE2 LYS 74 HE2 LYS 74 1.612 11.242 5.500 1314 HE3 LYS 74 HE3 LYS 74 1.476 10.089 6.826 1315 HZ1 LYS 74 HZ1 LYS 74 3.774 10.336 7.312 1316 HZ2 LYS 74 HZ2 LYS 74 3.127 11.891 7.193 1317 HZ3 LYS 74 HZ3 LYS 74 4.056 11.263 5.925 1318 H GLU 75 H GLU 75 4.918 11.203 1.912 1319 HA GLU 75 HA GLU 75 5.334 13.114 3.995 1320 HB2 GLU 75 HB2 GLU 75 6.849 11.089 2.877 1321 HB3 GLU 75 HB3 GLU 75 7.655 12.541 2.300 1322 HG2 GLU 75 HG2 GLU 75 8.694 11.873 4.330 1323 HG3 GLU 75 HG3 GLU 75 7.769 13.340 4.646 1324 H GLU 76 H GLU 76 5.690 13.094 0.499 1325 HA GLU 76 HA GLU 76 6.765 15.651 0.125 1326 HB2 GLU 76 HB2 GLU 76 6.662 13.965 -1.651 1327 HB3 GLU 76 HB3 GLU 76 4.908 14.052 -1.656 1328 HG2 GLU 76 HG2 GLU 76 5.884 15.264 -3.530 1329 HG3 GLU 76 HG3 GLU 76 4.995 16.338 -2.450 1330 H TYR 77 H TYR 77 3.494 14.511 0.552 1331 HA TYR 77 HA TYR 77 2.041 16.795 -0.096 1332 HB2 TYR 77 HB2 TYR 77 0.874 14.763 0.191 1333 HB3 TYR 77 HB3 TYR 77 1.570 14.491 1.780 1334 HD1 TYR 77 HD1 TYR 77 -0.441 17.197 0.149 1335 HD2 TYR 77 HD2 TYR 77 0.062 14.621 3.491 1336 HE1 TYR 77 HE1 TYR 77 -2.456 18.162 1.173 1337 HE2 TYR 77 HE2 TYR 77 -1.948 15.568 4.531 1338 HH TYR 77 HH TYR 77 -4.138 16.759 3.568 1339 H GLN 78 H GLN 78 3.771 15.951 2.835 1340 HA GLN 78 HA GLN 78 2.736 18.236 4.288 1341 HB2 GLN 78 HB2 GLN 78 4.822 16.161 4.968 1342 HB3 GLN 78 HB3 GLN 78 4.371 17.477 6.042 1343 HG2 GLN 78 HG2 GLN 78 2.482 15.376 5.010 1344 HG3 GLN 78 HG3 GLN 78 3.259 15.352 6.590 1345 HE21 GLN 78 HE21 GLN 78 0.439 15.423 5.917 1346 HE22 GLN 78 HE22 GLN 78 -0.206 16.840 6.670 1347 H ARG 79 H ARG 79 5.637 17.282 2.585 1348 HA ARG 79 HA ARG 79 7.475 19.151 3.435 1349 HB2 ARG 79 HB2 ARG 79 7.081 17.854 0.753 1350 HB3 ARG 79 HB3 ARG 79 8.430 18.933 1.076 1351 HG2 ARG 79 HG2 ARG 79 8.054 16.782 3.041 1352 HG3 ARG 79 HG3 ARG 79 8.498 16.257 1.416 1353 HD2 ARG 79 HD2 ARG 79 10.540 16.557 2.531 1354 HD3 ARG 79 HD3 ARG 79 10.354 17.999 1.536 1355 HE ARG 79 HE ARG 79 9.290 18.451 4.123 1356 HH11 ARG 79 HH11 ARG 79 12.348 18.113 2.446 1357 HH12 ARG 79 HH12 ARG 79 13.225 19.071 3.595 1358 HH21 ARG 79 HH21 ARG 79 10.421 19.708 5.623 1359 HH22 ARG 79 HH22 ARG 79 12.126 20.001 5.406 1360 H LEU 80 H LEU 80 5.312 19.534 0.607 1361 HA LEU 80 HA LEU 80 6.183 22.169 0.051 1362 HB2 LEU 80 HB2 LEU 80 4.579 22.239 -1.609 1363 HB3 LEU 80 HB3 LEU 80 4.925 20.527 -1.474 1364 HG LEU 80 HG LEU 80 2.706 21.365 0.237 1365 HD11 LEU 80 HD11 LEU 80 2.292 22.956 -1.551 1366 HD12 LEU 80 HD12 LEU 80 1.093 21.665 -1.587 1367 HD13 LEU 80 HD13 LEU 80 2.414 21.669 -2.752 1368 HD21 LEU 80 HD21 LEU 80 3.328 19.027 -0.273 1369 HD22 LEU 80 HD22 LEU 80 2.886 19.301 -1.958 1370 HD23 LEU 80 HD23 LEU 80 1.661 19.404 -0.695 1371 H ARG 81 H ARG 81 3.671 20.900 2.128 1372 HA ARG 81 HA ARG 81 2.305 23.365 2.508 1373 HB2 ARG 81 HB2 ARG 81 2.361 20.798 4.087 1374 HB3 ARG 81 HB3 ARG 81 1.397 22.183 4.576 1375 HG2 ARG 81 HG2 ARG 81 0.171 22.078 2.455 1376 HG3 ARG 81 HG3 ARG 81 1.141 20.686 1.974 1377 HD2 ARG 81 HD2 ARG 81 -1.197 20.281 3.008 1378 HD3 ARG 81 HD3 ARG 81 0.158 19.287 3.538 1379 HE ARG 81 HE ARG 81 0.217 21.236 5.353 1380 HH11 ARG 81 HH11 ARG 81 -2.485 19.339 4.152 1381 HH12 ARG 81 HH12 ARG 81 -3.382 19.466 5.628 1382 HH21 ARG 81 HH21 ARG 81 -0.948 21.388 7.275 1383 HH22 ARG 81 HH22 ARG 81 -2.496 20.617 7.422 1384 H GLU 82 H GLU 82 4.684 21.598 4.480 1385 HA GLU 82 HA GLU 82 4.812 23.571 6.501 1386 HB2 GLU 82 HB2 GLU 82 6.712 22.371 7.366 1387 HB3 GLU 82 HB3 GLU 82 5.473 21.231 6.869 1388 HG2 GLU 82 HG2 GLU 82 6.780 21.005 4.697 1389 HG3 GLU 82 HG3 GLU 82 8.080 21.857 5.528 1390 H GLN 83 H GLN 83 6.350 23.290 3.428 1391 HA GLN 83 HA GLN 83 8.515 25.080 3.990 1392 HB2 GLN 83 HB2 GLN 83 8.269 23.288 2.097 1393 HB3 GLN 83 HB3 GLN 83 7.464 24.584 1.225 1394 HG2 GLN 83 HG2 GLN 83 9.457 25.986 1.505 1395 HG3 GLN 83 HG3 GLN 83 10.267 24.652 2.320 1396 HE21 GLN 83 HE21 GLN 83 9.110 25.890 -0.698 1397 HE22 GLN 83 HE22 GLN 83 9.915 24.746 -1.714 1398 H LEU 84 H LEU 84 5.297 25.384 2.577 1399 HA LEU 84 HA LEU 84 5.553 28.054 1.700 1400 HB2 LEU 84 HB2 LEU 84 3.794 26.526 0.932 1401 HB3 LEU 84 HB3 LEU 84 3.090 26.528 2.535 1402 HG LEU 84 HG LEU 84 2.694 29.002 2.279 1403 HD11 LEU 84 HD11 LEU 84 2.693 29.932 0.013 1404 HD12 LEU 84 HD12 LEU 84 3.447 28.457 -0.590 1405 HD13 LEU 84 HD13 LEU 84 4.313 29.491 0.547 1406 HD21 LEU 84 HD21 LEU 84 0.831 27.525 1.992 1407 HD22 LEU 84 HD22 LEU 84 1.336 27.117 0.350 1408 HD23 LEU 84 HD23 LEU 84 0.763 28.744 0.720 1409 H LYS 85 H LYS 85 4.348 26.666 4.722 1410 HA LYS 85 HA LYS 85 3.801 29.280 5.841 1411 HB2 LYS 85 HB2 LYS 85 2.915 28.115 7.734 1412 HB3 LYS 85 HB3 LYS 85 2.369 27.277 6.287 1413 HG2 LYS 85 HG2 LYS 85 4.240 25.650 6.634 1414 HG3 LYS 85 HG3 LYS 85 4.549 26.430 8.180 1415 HD2 LYS 85 HD2 LYS 85 2.144 25.952 8.772 1416 HD3 LYS 85 HD3 LYS 85 2.073 24.948 7.324 1417 HE2 LYS 85 HE2 LYS 85 2.529 23.508 9.161 1418 HE3 LYS 85 HE3 LYS 85 4.015 23.656 8.230 1419 HZ1 LYS 85 HZ1 LYS 85 4.740 25.358 9.850 1420 HZ2 LYS 85 HZ2 LYS 85 4.530 23.826 10.535 1421 HZ3 LYS 85 HZ3 LYS 85 3.364 25.023 10.775 1422 H LYS 86 H LYS 86 6.565 28.680 5.126 1423 HA LYS 86 HA LYS 86 7.763 29.308 7.708 1424 HB2 LYS 86 HB2 LYS 86 8.010 26.880 7.472 1425 HB3 LYS 86 HB3 LYS 86 8.777 27.103 5.908 1426 HG2 LYS 86 HG2 LYS 86 10.507 28.506 7.202 1427 HG3 LYS 86 HG3 LYS 86 9.844 27.712 8.633 1428 HD2 LYS 86 HD2 LYS 86 11.799 26.520 7.774 1429 HD3 LYS 86 HD3 LYS 86 10.343 25.531 7.667 1430 HE2 LYS 86 HE2 LYS 86 11.829 25.441 5.655 1431 HE3 LYS 86 HE3 LYS 86 10.164 25.913 5.319 1432 HZ1 LYS 86 HZ1 LYS 86 12.484 27.758 5.564 1433 HZ2 LYS 86 HZ2 LYS 86 10.884 28.235 5.272 1434 HZ3 LYS 86 HZ3 LYS 86 11.716 27.313 4.126 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 37.706 9.727 -10.865 2 H2 GLY 1 H2 GLY 1 38.455 8.224 -10.666 3 H3 GLY 1 H3 GLY 1 36.832 8.425 -10.233 4 HA2 GLY 1 HA3 GLY 1 36.258 8.856 -12.554 5 HA3 GLY 1 HA2 GLY 1 37.938 8.578 -12.981 6 H SER 2 H SER 2 35.282 7.010 -11.211 7 HA SER 2 HA SER 2 36.022 4.493 -12.534 8 HB2 SER 2 HB2 SER 2 36.761 4.690 -10.074 9 HB3 SER 2 HB3 SER 2 35.044 4.598 -9.680 10 HG SER 2 HG SER 2 36.642 2.663 -11.012 11 H HIS 3 H HIS 3 33.960 2.982 -11.300 12 HA HIS 3 HA HIS 3 31.733 3.801 -12.934 13 HB2 HIS 3 HB2 HIS 3 32.673 1.383 -12.154 14 HB3 HIS 3 HB3 HIS 3 31.374 1.600 -10.986 15 HD1 HIS 3 HD1 HIS 3 31.032 -0.659 -12.899 16 HD2 HIS 3 HD2 HIS 3 29.777 3.206 -13.784 17 HE1 HIS 3 HE1 HIS 3 29.287 -0.907 -14.698 18 HE2 HIS 3 HE2 HIS 3 28.658 1.454 -15.321 19 H MET 4 H MET 4 31.388 5.834 -11.805 20 HA MET 4 HA MET 4 30.204 5.679 -9.149 21 HB2 MET 4 HB2 MET 4 30.145 8.140 -9.272 22 HB3 MET 4 HB3 MET 4 31.756 7.503 -9.574 23 HG2 MET 4 HG2 MET 4 31.308 7.748 -12.016 24 HG3 MET 4 HG3 MET 4 29.803 8.565 -11.603 25 HE1 MET 4 HE1 MET 4 29.608 10.902 -10.569 26 HE2 MET 4 HE2 MET 4 30.956 11.850 -9.950 27 HE3 MET 4 HE3 MET 4 30.474 10.365 -9.132 28 H THR 5 H THR 5 28.138 6.794 -8.728 29 HA THR 5 HA THR 5 26.306 7.133 -10.936 30 HB THR 5 HB THR 5 25.433 5.141 -8.865 31 HG1 THR 5 HG1 THR 5 27.234 4.734 -10.938 32 HG21 THR 5 HG21 THR 5 23.698 6.074 -10.247 33 HG22 THR 5 HG22 THR 5 23.979 4.411 -10.768 34 HG23 THR 5 HG23 THR 5 24.628 5.752 -11.710 35 H GLU 6 H GLU 6 24.856 8.688 -10.433 36 HA GLU 6 HA GLU 6 24.978 9.899 -7.833 37 HB2 GLU 6 HB2 GLU 6 24.751 11.169 -10.001 38 HB3 GLU 6 HB3 GLU 6 23.089 10.605 -10.075 39 HG2 GLU 6 HG2 GLU 6 22.899 11.630 -7.707 40 HG3 GLU 6 HG3 GLU 6 24.349 12.521 -8.162 41 H GLN 7 H GLN 7 24.149 8.306 -6.465 42 HA GLN 7 HA GLN 7 22.591 7.152 -5.284 43 HB2 GLN 7 HB2 GLN 7 21.916 9.585 -4.977 44 HB3 GLN 7 HB3 GLN 7 20.659 9.285 -6.168 45 HG2 GLN 7 HG2 GLN 7 19.711 9.094 -3.985 46 HG3 GLN 7 HG3 GLN 7 19.768 7.492 -4.718 47 HE21 GLN 7 HE21 GLN 7 19.670 6.501 -2.702 48 HE22 GLN 7 HE22 GLN 7 21.022 6.468 -1.625 49 HA PRO 8 HA PRO 8 20.592 5.127 -8.889 50 HB2 PRO 8 HB2 PRO 8 21.657 2.692 -8.565 51 HB3 PRO 8 HB3 PRO 8 22.564 3.997 -9.339 52 HG2 PRO 8 HG2 PRO 8 22.760 2.949 -6.547 53 HG3 PRO 8 HG3 PRO 8 24.054 3.445 -7.652 54 HD2 PRO 8 HD2 PRO 8 23.041 5.020 -5.630 55 HD3 PRO 8 HD3 PRO 8 23.865 5.644 -7.071 56 H LYS 9 H LYS 9 19.065 3.301 -8.897 57 HA LYS 9 HA LYS 9 17.592 3.181 -6.431 58 HB2 LYS 9 HB2 LYS 9 17.137 1.856 -9.111 59 HB3 LYS 9 HB3 LYS 9 16.031 1.725 -7.749 60 HG2 LYS 9 HG2 LYS 9 16.038 4.314 -7.806 61 HG3 LYS 9 HG3 LYS 9 16.685 4.111 -9.431 62 HD2 LYS 9 HD2 LYS 9 14.735 2.827 -10.089 63 HD3 LYS 9 HD3 LYS 9 14.097 2.899 -8.445 64 HE2 LYS 9 HE2 LYS 9 13.921 5.333 -8.617 65 HE3 LYS 9 HE3 LYS 9 14.576 5.272 -10.249 66 HZ1 LYS 9 HZ1 LYS 9 12.259 5.436 -10.469 67 HZ2 LYS 9 HZ2 LYS 9 11.965 4.249 -9.304 68 HZ3 LYS 9 HZ3 LYS 9 12.620 3.817 -10.803 69 H THR 10 H THR 10 19.123 2.210 -5.107 70 HA THR 10 HA THR 10 20.218 -0.368 -5.620 71 HB THR 10 HB THR 10 21.233 1.427 -4.144 72 HG1 THR 10 HG1 THR 10 22.262 -0.443 -3.889 73 HG21 THR 10 HG21 THR 10 20.550 1.490 -1.801 74 HG22 THR 10 HG22 THR 10 19.233 0.367 -2.145 75 HG23 THR 10 HG23 THR 10 19.223 1.982 -2.853 76 H ARG 11 H ARG 11 19.929 -2.141 -3.964 77 HA ARG 11 HA ARG 11 17.053 -2.534 -3.507 78 HB2 ARG 11 HB2 ARG 11 17.416 -4.895 -3.700 79 HB3 ARG 11 HB3 ARG 11 18.189 -4.125 -5.075 80 HG2 ARG 11 HG2 ARG 11 20.353 -4.269 -3.796 81 HG3 ARG 11 HG3 ARG 11 19.499 -5.280 -2.631 82 HD2 ARG 11 HD2 ARG 11 20.559 -6.769 -4.127 83 HD3 ARG 11 HD3 ARG 11 18.854 -6.760 -4.576 84 HE ARG 11 HE ARG 11 20.220 -4.833 -6.103 85 HH11 ARG 11 HH11 ARG 11 19.948 -8.309 -5.781 86 HH12 ARG 11 HH12 ARG 11 20.378 -8.627 -7.428 87 HH21 ARG 11 HH21 ARG 11 20.796 -5.243 -8.275 88 HH22 ARG 11 HH22 ARG 11 20.848 -6.877 -8.859 89 H VAL 12 H VAL 12 16.319 -3.209 -1.523 90 HA VAL 12 HA VAL 12 18.322 -3.364 0.633 91 HB VAL 12 HB VAL 12 17.198 -1.160 0.677 92 HG11 VAL 12 HG11 VAL 12 15.079 -1.566 -0.261 93 HG12 VAL 12 HG12 VAL 12 14.776 -1.138 1.423 94 HG13 VAL 12 HG13 VAL 12 14.710 -2.825 0.917 95 HG21 VAL 12 HG21 VAL 12 16.426 -1.254 3.046 96 HG22 VAL 12 HG22 VAL 12 17.993 -2.015 2.767 97 HG23 VAL 12 HG23 VAL 12 16.552 -3.014 2.969 98 H SER 13 H SER 13 18.074 -5.011 2.034 99 HA SER 13 HA SER 13 15.751 -6.761 1.638 100 HB2 SER 13 HB2 SER 13 18.460 -7.353 2.864 101 HB3 SER 13 HB3 SER 13 17.144 -8.518 2.707 102 HG SER 13 HG SER 13 17.265 -8.233 0.434 103 H VAL 14 H VAL 14 14.195 -6.599 3.110 104 HA VAL 14 HA VAL 14 14.938 -5.806 5.851 105 HB VAL 14 HB VAL 14 12.682 -4.899 6.122 106 HG11 VAL 14 HG11 VAL 14 14.381 -3.348 5.478 107 HG12 VAL 14 HG12 VAL 14 12.911 -2.949 4.584 108 HG13 VAL 14 HG13 VAL 14 14.230 -3.807 3.781 109 HG21 VAL 14 HG21 VAL 14 12.262 -5.301 3.166 110 HG22 VAL 14 HG22 VAL 14 11.103 -4.724 4.364 111 HG23 VAL 14 HG23 VAL 14 11.632 -6.404 4.387 112 H ARG 15 H ARG 15 13.170 -6.551 7.466 113 HA ARG 15 HA ARG 15 12.573 -9.369 6.854 114 HB2 ARG 15 HB2 ARG 15 14.311 -8.940 8.607 115 HB3 ARG 15 HB3 ARG 15 13.071 -8.152 9.572 116 HG2 ARG 15 HG2 ARG 15 11.801 -10.257 9.627 117 HG3 ARG 15 HG3 ARG 15 13.096 -11.039 8.715 118 HD2 ARG 15 HD2 ARG 15 13.357 -9.756 11.434 119 HD3 ARG 15 HD3 ARG 15 13.303 -11.487 11.107 120 HE ARG 15 HE ARG 15 15.389 -10.762 9.625 121 HH11 ARG 15 HH11 ARG 15 14.561 -9.876 12.913 122 HH12 ARG 15 HH12 ARG 15 16.211 -9.736 13.426 123 HH21 ARG 15 HH21 ARG 15 17.569 -10.539 10.295 124 HH22 ARG 15 HH22 ARG 15 17.915 -10.105 11.941 125 H ILE 16 H ILE 16 10.473 -9.811 6.677 126 HA ILE 16 HA ILE 16 8.550 -8.332 8.356 127 HB ILE 16 HB ILE 16 8.113 -9.037 5.441 128 HG12 ILE 16 HG12 ILE 16 8.260 -6.287 6.687 129 HG13 ILE 16 HG13 ILE 16 9.636 -7.070 5.913 130 HG21 ILE 16 HG21 ILE 16 5.965 -7.995 5.636 131 HG22 ILE 16 HG22 ILE 16 6.297 -7.505 7.295 132 HG23 ILE 16 HG23 ILE 16 6.100 -9.211 6.904 133 HD11 ILE 16 HD11 ILE 16 8.227 -7.236 3.838 134 HD12 ILE 16 HD12 ILE 16 8.698 -5.608 4.323 135 HD13 ILE 16 HD13 ILE 16 7.063 -6.185 4.646 136 H TYR 17 H TYR 17 7.253 -9.638 9.471 137 HA TYR 17 HA TYR 17 6.232 -11.493 10.267 138 HB2 TYR 17 HB2 TYR 17 5.593 -11.347 7.538 139 HB3 TYR 17 HB3 TYR 17 5.972 -13.039 7.842 140 HD1 TYR 17 HD2 TYR 17 4.272 -10.431 9.912 141 HD2 TYR 17 HD1 TYR 17 3.999 -14.231 8.015 142 HE1 TYR 17 HE2 TYR 17 2.037 -10.752 10.886 143 HE2 TYR 17 HE1 TYR 17 1.759 -14.559 8.986 144 HH TYR 17 HH TYR 17 -0.033 -12.078 10.359 145 H GLY 18 H GLY 18 9.123 -11.481 10.110 146 HA2 GLY 18 HA2 GLY 18 10.728 -12.975 10.856 147 HA3 GLY 18 HA3 GLY 18 9.553 -14.268 10.696 148 H GLN 19 H GLN 19 9.815 -12.445 7.856 149 HA GLN 19 HA GLN 19 11.809 -14.314 6.761 150 HB2 GLN 19 HB2 GLN 19 9.207 -13.452 5.474 151 HB3 GLN 19 HB3 GLN 19 10.470 -14.357 4.649 152 HG2 GLN 19 HG2 GLN 19 9.903 -16.297 5.632 153 HG3 GLN 19 HG3 GLN 19 9.560 -15.530 7.183 154 HE21 GLN 19 HE21 GLN 19 7.513 -14.555 7.490 155 HE22 GLN 19 HE22 GLN 19 6.147 -15.061 6.558 156 H ASP 20 H ASP 20 13.073 -13.499 5.012 157 HA ASP 20 HA ASP 20 13.344 -10.599 5.137 158 HB2 ASP 20 HB2 ASP 20 15.534 -10.886 4.166 159 HB3 ASP 20 HB3 ASP 20 15.350 -12.030 5.488 160 H TYR 21 H TYR 21 13.101 -9.242 3.445 161 HA TYR 21 HA TYR 21 12.420 -10.370 0.823 162 HB2 TYR 21 HB2 TYR 21 10.810 -8.251 2.265 163 HB3 TYR 21 HB3 TYR 21 10.544 -8.777 0.605 164 HD1 TYR 21 HD1 TYR 21 10.017 -11.262 0.243 165 HD2 TYR 21 HD2 TYR 21 9.744 -9.341 4.021 166 HE1 TYR 21 HE1 TYR 21 8.569 -13.071 1.049 167 HE2 TYR 21 HE2 TYR 21 8.289 -11.145 4.844 168 HH TYR 21 HH TYR 21 6.892 -12.884 4.075 169 H THR 22 H THR 22 13.324 -9.300 -0.835 170 HA THR 22 HA THR 22 14.816 -6.857 -0.196 171 HB THR 22 HB THR 22 15.229 -8.710 -2.543 172 HG1 THR 22 HG1 THR 22 15.866 -9.955 -0.882 173 HG21 THR 22 HG21 THR 22 16.082 -6.414 -2.832 174 HG22 THR 22 HG22 THR 22 17.389 -7.593 -2.739 175 HG23 THR 22 HG23 THR 22 17.011 -6.585 -1.343 176 H ILE 23 H ILE 23 14.148 -4.994 -1.011 177 HA ILE 23 HA ILE 23 12.574 -4.983 -3.494 178 HB ILE 23 HB ILE 23 11.294 -3.016 -2.563 179 HG12 ILE 23 HG12 ILE 23 12.957 -2.862 -0.553 180 HG13 ILE 23 HG13 ILE 23 11.261 -2.481 -0.311 181 HG21 ILE 23 HG21 ILE 23 10.161 -5.047 -2.913 182 HG22 ILE 23 HG22 ILE 23 9.691 -4.482 -1.311 183 HG23 ILE 23 HG23 ILE 23 10.871 -5.784 -1.478 184 HD11 ILE 23 HD11 ILE 23 12.407 -3.863 1.467 185 HD12 ILE 23 HD12 ILE 23 12.395 -5.189 0.308 186 HD13 ILE 23 HD13 ILE 23 10.877 -4.482 0.854 187 H VAL 24 H VAL 24 12.298 -2.438 -4.063 188 HA VAL 24 HA VAL 24 15.042 -1.514 -4.402 189 HB VAL 24 HB VAL 24 12.508 -0.432 -5.647 190 HG11 VAL 24 HG11 VAL 24 15.410 -0.020 -6.356 191 HG12 VAL 24 HG12 VAL 24 14.326 1.175 -5.643 192 HG13 VAL 24 HG13 VAL 24 14.034 0.582 -7.279 193 HG21 VAL 24 HG21 VAL 24 12.809 -2.736 -6.309 194 HG22 VAL 24 HG22 VAL 24 14.495 -2.428 -6.721 195 HG23 VAL 24 HG23 VAL 24 13.207 -1.676 -7.659 196 H GLY 25 H GLY 25 15.867 0.047 -3.151 197 HA2 GLY 25 HA2 GLY 25 14.006 1.729 -1.597 198 HA3 GLY 25 HA3 GLY 25 15.671 1.380 -1.155 199 H ALA 26 H ALA 26 13.642 3.106 -3.460 200 HA ALA 26 HA ALA 26 15.931 4.737 -4.261 201 HB1 ALA 26 HB1 ALA 26 14.530 5.545 -6.059 202 HB2 ALA 26 HB2 ALA 26 13.141 4.684 -5.396 203 HB3 ALA 26 HB3 ALA 26 14.522 3.782 -6.021 204 H GLU 27 H GLU 27 13.189 4.926 -2.192 205 HA GLU 27 HA GLU 27 12.917 7.777 -2.321 206 HB2 GLU 27 HB2 GLU 27 11.024 6.342 -1.690 207 HB3 GLU 27 HB3 GLU 27 11.879 5.832 -0.245 208 HG2 GLU 27 HG2 GLU 27 11.940 8.334 0.347 209 HG3 GLU 27 HG3 GLU 27 10.691 8.502 -0.884 210 H SER 28 H SER 28 13.867 5.724 0.453 211 HA SER 28 HA SER 28 16.297 7.036 0.968 212 HB2 SER 28 HB2 SER 28 15.418 8.078 3.214 213 HB3 SER 28 HB3 SER 28 15.244 8.987 1.713 214 HG SER 28 HG SER 28 13.096 7.900 1.611 215 HA PRO 29 HA PRO 29 16.788 3.301 3.252 216 HB2 PRO 29 HB2 PRO 29 18.574 4.164 5.176 217 HB3 PRO 29 HB3 PRO 29 19.011 3.669 3.537 218 HG2 PRO 29 HG2 PRO 29 18.588 6.416 4.641 219 HG3 PRO 29 HG3 PRO 29 19.833 5.840 3.518 220 HD2 PRO 29 HD2 PRO 29 17.715 7.223 2.651 221 HD3 PRO 29 HD3 PRO 29 18.380 5.877 1.700 222 H ALA 30 H ALA 30 16.259 6.243 5.171 223 HA ALA 30 HA ALA 30 15.473 4.887 7.536 224 HB1 ALA 30 HB1 ALA 30 14.687 7.061 8.302 225 HB2 ALA 30 HB2 ALA 30 14.855 7.707 6.668 226 HB3 ALA 30 HB3 ALA 30 16.286 7.186 7.561 227 H HIS 31 H HIS 31 13.636 6.308 4.857 228 HA HIS 31 HA HIS 31 11.079 5.879 5.974 229 HB2 HIS 31 HB2 HIS 31 12.125 6.525 3.269 230 HB3 HIS 31 HB3 HIS 31 10.493 5.878 3.372 231 HD1 HIS 31 HD1 HIS 31 12.357 8.958 3.592 232 HD2 HIS 31 HD2 HIS 31 8.765 7.527 5.107 233 HE1 HIS 31 HE1 HIS 31 11.060 10.992 4.280 234 HE2 HIS 31 HE2 HIS 31 8.803 10.115 4.961 235 H ILE 32 H ILE 32 12.879 4.034 3.519 236 HA ILE 32 HA ILE 32 10.979 1.976 3.254 237 HB ILE 32 HB ILE 32 12.688 0.697 2.110 238 HG12 ILE 32 HG12 ILE 32 14.606 2.771 3.207 239 HG13 ILE 32 HG13 ILE 32 14.591 1.052 3.568 240 HG21 ILE 32 HG21 ILE 32 13.021 2.153 0.294 241 HG22 ILE 32 HG22 ILE 32 13.099 3.572 1.337 242 HG23 ILE 32 HG23 ILE 32 11.561 2.745 1.091 243 HD11 ILE 32 HD11 ILE 32 16.334 1.251 2.084 244 HD12 ILE 32 HD12 ILE 32 15.505 2.462 1.105 245 HD13 ILE 32 HD13 ILE 32 15.003 0.772 1.030 246 H ARG 33 H ARG 33 13.164 2.607 5.778 247 HA ARG 33 HA ARG 33 13.517 -0.103 6.643 248 HB2 ARG 33 HB2 ARG 33 14.960 2.047 7.132 249 HB3 ARG 33 HB3 ARG 33 13.846 2.241 8.477 250 HG2 ARG 33 HG2 ARG 33 15.621 1.080 9.406 251 HG3 ARG 33 HG3 ARG 33 14.446 -0.189 9.054 252 HD2 ARG 33 HD2 ARG 33 15.662 -0.541 6.869 253 HD3 ARG 33 HD3 ARG 33 16.918 0.529 7.488 254 HE ARG 33 HE ARG 33 16.747 -1.275 9.449 255 HH11 ARG 33 HH11 ARG 33 16.991 -1.649 5.979 256 HH12 ARG 33 HH12 ARG 33 17.782 -3.189 6.065 257 HH21 ARG 33 HH21 ARG 33 17.808 -3.294 9.574 258 HH22 ARG 33 HH22 ARG 33 18.237 -4.134 8.116 259 H LEU 34 H LEU 34 11.392 2.593 7.531 260 HA LEU 34 HA LEU 34 10.150 1.116 9.661 261 HB2 LEU 34 HB2 LEU 34 8.674 2.999 9.913 262 HB3 LEU 34 HB3 LEU 34 10.322 3.565 9.732 263 HG LEU 34 HG LEU 34 9.446 3.700 7.155 264 HD11 LEU 34 HD11 LEU 34 7.098 4.477 8.882 265 HD12 LEU 34 HD12 LEU 34 7.163 3.062 7.830 266 HD13 LEU 34 HD13 LEU 34 7.235 4.682 7.136 267 HD21 LEU 34 HD21 LEU 34 10.654 5.439 8.333 268 HD22 LEU 34 HD22 LEU 34 9.228 5.805 9.304 269 HD23 LEU 34 HD23 LEU 34 9.217 6.115 7.568 270 H VAL 35 H VAL 35 9.739 1.329 6.283 271 HA VAL 35 HA VAL 35 7.008 0.796 5.986 272 HB VAL 35 HB VAL 35 9.324 -0.061 4.241 273 HG11 VAL 35 HG11 VAL 35 7.728 -0.439 2.481 274 HG12 VAL 35 HG12 VAL 35 6.400 0.069 3.524 275 HG13 VAL 35 HG13 VAL 35 7.278 -1.418 3.877 276 HG21 VAL 35 HG21 VAL 35 7.396 2.220 3.896 277 HG22 VAL 35 HG22 VAL 35 8.803 1.856 2.901 278 HG23 VAL 35 HG23 VAL 35 9.015 2.383 4.571 279 H ALA 36 H ALA 36 9.751 -1.348 6.510 280 HA ALA 36 HA ALA 36 8.488 -3.802 6.102 281 HB1 ALA 36 HB1 ALA 36 10.933 -3.443 6.347 282 HB2 ALA 36 HB2 ALA 36 10.306 -4.786 7.306 283 HB3 ALA 36 HB3 ALA 36 10.684 -3.249 8.085 284 H ALA 37 H ALA 37 8.902 -1.936 9.092 285 HA ALA 37 HA ALA 37 7.537 -3.772 10.767 286 HB1 ALA 37 HB1 ALA 37 8.051 -0.824 11.162 287 HB2 ALA 37 HB2 ALA 37 9.123 -2.137 11.644 288 HB3 ALA 37 HB3 ALA 37 7.547 -1.958 12.415 289 H PHE 38 H PHE 38 6.511 -1.187 8.694 290 HA PHE 38 HA PHE 38 3.950 -0.743 9.808 291 HB2 PHE 38 HB2 PHE 38 4.938 0.891 8.320 292 HB3 PHE 38 HB3 PHE 38 5.020 -0.281 7.013 293 HD1 PHE 38 HD1 PHE 38 2.186 0.463 9.318 294 HD2 PHE 38 HD2 PHE 38 3.711 0.633 5.348 295 HE1 PHE 38 HE1 PHE 38 -0.014 1.206 8.511 296 HE2 PHE 38 HE2 PHE 38 1.510 1.371 4.533 297 HZ PHE 38 HZ PHE 38 -0.357 1.660 6.114 298 H VAL 39 H VAL 39 5.099 -2.829 7.181 299 HA VAL 39 HA VAL 39 2.482 -3.914 6.686 300 HB VAL 39 HB VAL 39 5.153 -4.971 5.743 301 HG11 VAL 39 HG11 VAL 39 3.861 -6.051 3.979 302 HG12 VAL 39 HG12 VAL 39 2.369 -5.413 4.672 303 HG13 VAL 39 HG13 VAL 39 3.324 -6.593 5.571 304 HG21 VAL 39 HG21 VAL 39 3.551 -2.666 4.928 305 HG22 VAL 39 HG22 VAL 39 3.989 -3.742 3.605 306 HG23 VAL 39 HG23 VAL 39 5.247 -3.033 4.616 307 H ASP 40 H ASP 40 5.379 -4.953 8.416 308 HA ASP 40 HA ASP 40 4.704 -7.588 8.984 309 HB2 ASP 40 HB2 ASP 40 6.909 -6.667 9.470 310 HB3 ASP 40 HB3 ASP 40 6.225 -5.600 10.691 311 H ASP 41 H ASP 41 3.989 -4.681 10.903 312 HA ASP 41 HA ASP 41 2.544 -6.000 12.934 313 HB2 ASP 41 HB2 ASP 41 3.382 -3.812 13.387 314 HB3 ASP 41 HB3 ASP 41 2.560 -3.132 11.988 315 H LYS 42 H LYS 42 1.522 -4.410 9.944 316 HA LYS 42 HA LYS 42 -1.244 -4.597 10.350 317 HB2 LYS 42 HB2 LYS 42 -0.018 -3.231 8.599 318 HB3 LYS 42 HB3 LYS 42 0.122 -4.714 7.665 319 HG2 LYS 42 HG2 LYS 42 -2.058 -4.712 7.073 320 HG3 LYS 42 HG3 LYS 42 -2.586 -4.009 8.601 321 HD2 LYS 42 HD2 LYS 42 -1.108 -2.449 6.491 322 HD3 LYS 42 HD3 LYS 42 -2.867 -2.548 6.567 323 HE2 LYS 42 HE2 LYS 42 -1.068 -1.506 8.757 324 HE3 LYS 42 HE3 LYS 42 -2.008 -0.514 7.646 325 HZ1 LYS 42 HZ1 LYS 42 -4.022 -1.647 8.539 326 HZ2 LYS 42 HZ2 LYS 42 -3.211 -0.686 9.663 327 HZ3 LYS 42 HZ3 LYS 42 -3.046 -2.370 9.724 328 H MET 43 H MET 43 1.055 -6.865 8.913 329 HA MET 43 HA MET 43 -0.925 -8.721 8.044 330 HB2 MET 43 HB2 MET 43 2.043 -8.982 8.501 331 HB3 MET 43 HB3 MET 43 1.050 -10.312 7.921 332 HG2 MET 43 HG2 MET 43 0.409 -8.968 5.973 333 HG3 MET 43 HG3 MET 43 1.438 -7.659 6.550 334 HE1 MET 43 HE1 MET 43 1.231 -11.171 4.927 335 HE2 MET 43 HE2 MET 43 1.996 -11.601 6.457 336 HE3 MET 43 HE3 MET 43 2.905 -11.730 4.951 337 H HIS 44 H HIS 44 0.430 -8.008 11.084 338 HA HIS 44 HA HIS 44 -0.214 -10.638 12.176 339 HB2 HIS 44 HB2 HIS 44 1.916 -9.578 12.814 340 HB3 HIS 44 HB3 HIS 44 1.037 -8.211 13.486 341 HD1 HIS 44 HD1 HIS 44 1.062 -8.326 15.937 342 HD2 HIS 44 HD2 HIS 44 0.774 -12.109 14.237 343 HE1 HIS 44 HE1 HIS 44 0.926 -9.931 17.869 344 HE2 HIS 44 HE2 HIS 44 0.544 -12.177 16.810 345 H GLU 45 H GLU 45 -1.791 -7.734 11.632 346 HA GLU 45 HA GLU 45 -3.513 -8.045 13.989 347 HB2 GLU 45 HB2 GLU 45 -4.201 -5.816 13.708 348 HB3 GLU 45 HB3 GLU 45 -2.481 -5.795 13.344 349 HG2 GLU 45 HG2 GLU 45 -2.960 -5.798 10.962 350 HG3 GLU 45 HG3 GLU 45 -4.687 -5.894 11.292 351 H PHE 46 H PHE 46 -3.462 -8.651 10.611 352 HA PHE 46 HA PHE 46 -6.386 -8.937 10.604 353 HB2 PHE 46 HB2 PHE 46 -4.444 -8.479 8.341 354 HB3 PHE 46 HB3 PHE 46 -6.114 -8.964 8.076 355 HD1 PHE 46 HD1 PHE 46 -7.745 -7.441 9.747 356 HD2 PHE 46 HD2 PHE 46 -4.095 -6.259 7.911 357 HE1 PHE 46 HE1 PHE 46 -8.442 -5.086 9.883 358 HE2 PHE 46 HE2 PHE 46 -4.784 -3.904 8.042 359 HZ PHE 46 HZ PHE 46 -6.959 -3.312 9.030 360 H SER 47 H SER 47 -3.727 -10.782 11.043 361 HA SER 47 HA SER 47 -4.172 -13.001 9.350 362 HB2 SER 47 HB2 SER 47 -2.919 -14.098 11.476 363 HB3 SER 47 HB3 SER 47 -2.083 -13.133 10.258 364 HG SER 47 HG SER 47 -2.462 -12.612 12.882 365 H GLU 48 H GLU 48 -5.561 -11.968 12.349 366 HA GLU 48 HA GLU 48 -6.733 -14.435 13.122 367 HB2 GLU 48 HB2 GLU 48 -8.087 -13.012 14.657 368 HB3 GLU 48 HB3 GLU 48 -6.355 -12.739 14.780 369 HG2 GLU 48 HG2 GLU 48 -6.500 -10.616 14.047 370 HG3 GLU 48 HG3 GLU 48 -7.771 -10.992 12.885 371 H LYS 49 H LYS 49 -7.572 -12.175 10.710 372 HA LYS 49 HA LYS 49 -10.408 -12.540 10.817 373 HB2 LYS 49 HB2 LYS 49 -8.714 -11.556 8.519 374 HB3 LYS 49 HB3 LYS 49 -10.453 -11.375 8.676 375 HG2 LYS 49 HG2 LYS 49 -8.350 -10.099 10.414 376 HG3 LYS 49 HG3 LYS 49 -9.354 -9.296 9.204 377 HD2 LYS 49 HD2 LYS 49 -11.360 -9.915 10.527 378 HD3 LYS 49 HD3 LYS 49 -10.296 -10.589 11.762 379 HE2 LYS 49 HE2 LYS 49 -9.202 -8.279 11.820 380 HE3 LYS 49 HE3 LYS 49 -10.624 -7.725 10.933 381 HZ1 LYS 49 HZ1 LYS 49 -12.021 -8.499 12.725 382 HZ2 LYS 49 HZ2 LYS 49 -10.855 -7.436 13.332 383 HZ3 LYS 49 HZ3 LYS 49 -10.677 -9.104 13.564 384 H GLN 50 H GLN 50 -7.795 -13.935 8.890 385 HA GLN 50 HA GLN 50 -7.690 -15.734 7.497 386 HB2 GLN 50 HB2 GLN 50 -9.893 -16.753 9.294 387 HB3 GLN 50 HB3 GLN 50 -8.892 -17.735 8.237 388 HG2 GLN 50 HG2 GLN 50 -7.129 -17.697 9.636 389 HG3 GLN 50 HG3 GLN 50 -7.458 -16.053 10.181 390 HE21 GLN 50 HE21 GLN 50 -6.816 -18.471 11.707 391 HE22 GLN 50 HE22 GLN 50 -8.119 -18.685 12.823 392 HA PRO 51 HA PRO 51 -11.329 -14.040 5.050 393 HB2 PRO 51 HB2 PRO 51 -9.785 -14.087 2.714 394 HB3 PRO 51 HB3 PRO 51 -10.109 -12.672 3.719 395 HG2 PRO 51 HG2 PRO 51 -7.716 -14.448 3.649 396 HG3 PRO 51 HG3 PRO 51 -7.820 -12.702 3.938 397 HD2 PRO 51 HD2 PRO 51 -7.398 -14.447 5.939 398 HD3 PRO 51 HD3 PRO 51 -8.370 -12.980 6.171 399 H MET 52 H MET 52 -9.019 -16.163 3.331 400 HA MET 52 HA MET 52 -11.285 -17.950 2.763 401 HB2 MET 52 HB2 MET 52 -8.725 -17.612 1.197 402 HB3 MET 52 HB3 MET 52 -10.080 -18.644 0.757 403 HG2 MET 52 HG2 MET 52 -10.066 -15.639 0.912 404 HG3 MET 52 HG3 MET 52 -10.166 -16.631 -0.544 405 HE1 MET 52 HE1 MET 52 -12.076 -14.215 0.951 406 HE2 MET 52 HE2 MET 52 -13.677 -14.684 0.389 407 HE3 MET 52 HE3 MET 52 -12.326 -14.620 -0.742 408 H LEU 53 H LEU 53 -8.751 -17.762 4.769 409 HA LEU 53 HA LEU 53 -7.514 -19.201 6.002 410 HB2 LEU 53 HB2 LEU 53 -9.750 -21.059 5.204 411 HB3 LEU 53 HB3 LEU 53 -8.546 -21.439 6.423 412 HG LEU 53 HG LEU 53 -9.825 -18.889 6.956 413 HD11 LEU 53 HD11 LEU 53 -11.732 -19.874 5.836 414 HD12 LEU 53 HD12 LEU 53 -12.011 -19.806 7.575 415 HD13 LEU 53 HD13 LEU 53 -11.574 -21.336 6.811 416 HD21 LEU 53 HD21 LEU 53 -9.652 -21.476 8.491 417 HD22 LEU 53 HD22 LEU 53 -10.136 -19.913 9.150 418 HD23 LEU 53 HD23 LEU 53 -8.489 -20.152 8.562 419 H ASP 54 H ASP 54 -5.800 -19.055 4.388 420 HA ASP 54 HA ASP 54 -5.087 -21.706 3.420 421 HB2 ASP 54 HB2 ASP 54 -5.397 -19.304 1.641 422 HB3 ASP 54 HB3 ASP 54 -4.216 -20.551 1.245 423 H VAL 55 H VAL 55 -3.405 -18.859 2.301 424 HA VAL 55 HA VAL 55 -1.561 -18.627 4.429 425 HB VAL 55 HB VAL 55 -0.658 -20.182 1.994 426 HG11 VAL 55 HG11 VAL 55 0.847 -18.263 2.179 427 HG12 VAL 55 HG12 VAL 55 1.668 -19.759 2.626 428 HG13 VAL 55 HG13 VAL 55 1.130 -18.640 3.879 429 HG21 VAL 55 HG21 VAL 55 -0.054 -20.558 4.925 430 HG22 VAL 55 HG22 VAL 55 0.407 -21.634 3.605 431 HG23 VAL 55 HG23 VAL 55 -1.292 -21.433 4.026 432 HA PRO 56 HA PRO 56 -0.286 -15.539 1.011 433 HB2 PRO 56 HB2 PRO 56 -1.089 -15.801 -1.539 434 HB3 PRO 56 HB3 PRO 56 0.318 -16.672 -0.918 435 HG2 PRO 56 HG2 PRO 56 -2.491 -17.646 -1.284 436 HG3 PRO 56 HG3 PRO 56 -0.968 -18.430 -1.748 437 HD2 PRO 56 HD2 PRO 56 -2.290 -19.093 0.500 438 HD3 PRO 56 HD3 PRO 56 -0.522 -19.129 0.399 439 H LYS 57 H LYS 57 -3.427 -16.725 1.340 440 HA LYS 57 HA LYS 57 -4.886 -14.653 0.067 441 HB2 LYS 57 HB2 LYS 57 -5.858 -16.357 2.358 442 HB3 LYS 57 HB3 LYS 57 -6.831 -15.559 1.130 443 HG2 LYS 57 HG2 LYS 57 -4.888 -17.793 0.577 444 HG3 LYS 57 HG3 LYS 57 -6.621 -18.012 0.818 445 HD2 LYS 57 HD2 LYS 57 -6.139 -15.982 -1.158 446 HD3 LYS 57 HD3 LYS 57 -5.268 -17.457 -1.574 447 HE2 LYS 57 HE2 LYS 57 -8.182 -17.409 -0.821 448 HE3 LYS 57 HE3 LYS 57 -7.613 -17.272 -2.482 449 HZ1 LYS 57 HZ1 LYS 57 -6.457 -19.434 -2.126 450 HZ2 LYS 57 HZ2 LYS 57 -8.143 -19.528 -2.085 451 HZ3 LYS 57 HZ3 LYS 57 -7.261 -19.579 -0.640 452 H LEU 58 H LEU 58 -3.071 -14.736 2.905 453 HA LEU 58 HA LEU 58 -4.575 -12.612 4.205 454 HB2 LEU 58 HB2 LEU 58 -3.633 -14.497 5.527 455 HB3 LEU 58 HB3 LEU 58 -2.026 -14.015 5.045 456 HG LEU 58 HG LEU 58 -2.881 -13.406 7.407 457 HD11 LEU 58 HD11 LEU 58 -1.570 -11.337 7.422 458 HD12 LEU 58 HD12 LEU 58 -1.570 -11.340 5.658 459 HD13 LEU 58 HD13 LEU 58 -0.768 -12.637 6.543 460 HD21 LEU 58 HD21 LEU 58 -4.079 -11.372 7.667 461 HD22 LEU 58 HD22 LEU 58 -5.017 -12.397 6.584 462 HD23 LEU 58 HD23 LEU 58 -4.061 -11.063 5.933 463 H ALA 59 H ALA 59 -1.512 -13.173 2.583 464 HA ALA 59 HA ALA 59 -0.330 -10.672 3.085 465 HB1 ALA 59 HB1 ALA 59 0.128 -12.595 0.813 466 HB2 ALA 59 HB2 ALA 59 0.971 -12.577 2.363 467 HB3 ALA 59 HB3 ALA 59 1.176 -11.239 1.231 468 H VAL 60 H VAL 60 -2.549 -11.760 0.576 469 HA VAL 60 HA VAL 60 -2.296 -9.334 -0.959 470 HB VAL 60 HB VAL 60 -4.257 -10.096 -2.236 471 HG11 VAL 60 HG11 VAL 60 -2.228 -12.288 -1.827 472 HG12 VAL 60 HG12 VAL 60 -2.028 -10.875 -2.863 473 HG13 VAL 60 HG13 VAL 60 -3.267 -12.071 -3.238 474 HG21 VAL 60 HG21 VAL 60 -4.284 -12.641 -0.672 475 HG22 VAL 60 HG22 VAL 60 -5.511 -11.980 -1.750 476 HG23 VAL 60 HG23 VAL 60 -5.255 -11.263 -0.158 477 H LEU 61 H LEU 61 -4.211 -10.472 1.674 478 HA LEU 61 HA LEU 61 -6.374 -8.671 1.517 479 HB2 LEU 61 HB2 LEU 61 -6.310 -10.736 2.909 480 HB3 LEU 61 HB3 LEU 61 -5.164 -9.946 3.975 481 HG LEU 61 HG LEU 61 -6.997 -8.164 4.301 482 HD11 LEU 61 HD11 LEU 61 -8.657 -10.439 3.231 483 HD12 LEU 61 HD12 LEU 61 -8.429 -8.870 2.459 484 HD13 LEU 61 HD13 LEU 61 -9.278 -8.979 4.003 485 HD21 LEU 61 HD21 LEU 61 -8.030 -9.483 6.078 486 HD22 LEU 61 HD22 LEU 61 -6.285 -9.738 6.028 487 HD23 LEU 61 HD23 LEU 61 -7.376 -10.960 5.372 488 H THR 62 H THR 62 -3.229 -8.520 3.111 489 HA THR 62 HA THR 62 -3.728 -5.975 4.307 490 HB THR 62 HB THR 62 -1.152 -6.045 4.581 491 HG1 THR 62 HG1 THR 62 -0.357 -7.582 3.317 492 HG21 THR 62 HG21 THR 62 -1.652 -6.826 6.613 493 HG22 THR 62 HG22 THR 62 -1.986 -8.430 5.964 494 HG23 THR 62 HG23 THR 62 -3.263 -7.220 6.017 495 H ALA 63 H ALA 63 -2.178 -7.105 1.357 496 HA ALA 63 HA ALA 63 -0.935 -4.724 0.569 497 HB1 ALA 63 HB1 ALA 63 -0.571 -6.975 -0.440 498 HB2 ALA 63 HB2 ALA 63 -0.786 -5.681 -1.618 499 HB3 ALA 63 HB3 ALA 63 -2.114 -6.792 -1.277 500 H VAL 64 H VAL 64 -4.163 -5.969 -0.208 501 HA VAL 64 HA VAL 64 -4.878 -3.763 -1.830 502 HB VAL 64 HB VAL 64 -5.935 -6.004 -1.970 503 HG11 VAL 64 HG11 VAL 64 -7.843 -6.467 -0.432 504 HG12 VAL 64 HG12 VAL 64 -7.255 -5.158 0.593 505 HG13 VAL 64 HG13 VAL 64 -6.251 -6.580 0.316 506 HG21 VAL 64 HG21 VAL 64 -6.986 -4.152 -3.077 507 HG22 VAL 64 HG22 VAL 64 -7.775 -3.652 -1.581 508 HG23 VAL 64 HG23 VAL 64 -8.233 -5.168 -2.357 509 H GLN 65 H GLN 65 -5.099 -4.319 1.628 510 HA GLN 65 HA GLN 65 -6.915 -2.132 2.062 511 HB2 GLN 65 HB2 GLN 65 -5.258 -3.803 3.952 512 HB3 GLN 65 HB3 GLN 65 -6.295 -2.489 4.492 513 HG2 GLN 65 HG2 GLN 65 -8.194 -3.691 3.292 514 HG3 GLN 65 HG3 GLN 65 -7.100 -5.073 3.184 515 HE21 GLN 65 HE21 GLN 65 -8.193 -6.425 4.523 516 HE22 GLN 65 HE22 GLN 65 -8.403 -6.138 6.213 517 H ILE 66 H ILE 66 -3.433 -2.604 2.161 518 HA ILE 66 HA ILE 66 -2.748 -0.162 3.401 519 HB ILE 66 HB ILE 66 -1.235 -1.998 1.549 520 HG12 ILE 66 HG12 ILE 66 -0.741 -1.237 4.434 521 HG13 ILE 66 HG13 ILE 66 -1.703 -2.626 3.943 522 HG21 ILE 66 HG21 ILE 66 -0.548 0.406 1.206 523 HG22 ILE 66 HG22 ILE 66 0.733 -0.689 1.724 524 HG23 ILE 66 HG23 ILE 66 -0.015 0.407 2.888 525 HD11 ILE 66 HD11 ILE 66 0.460 -3.414 4.497 526 HD12 ILE 66 HD12 ILE 66 1.236 -2.183 3.501 527 HD13 ILE 66 HD13 ILE 66 0.318 -3.482 2.740 528 H ALA 67 H ALA 67 -3.313 -1.065 0.047 529 HA ALA 67 HA ALA 67 -2.520 1.338 -1.164 530 HB1 ALA 67 HB1 ALA 67 -4.535 -0.717 -2.047 531 HB2 ALA 67 HB2 ALA 67 -2.829 -0.657 -2.474 532 HB3 ALA 67 HB3 ALA 67 -3.928 0.588 -3.068 533 H SER 68 H SER 68 -5.707 0.282 0.043 534 HA SER 68 HA SER 68 -7.068 2.624 -0.809 535 HB2 SER 68 HB2 SER 68 -8.563 1.626 1.288 536 HB3 SER 68 HB3 SER 68 -8.705 1.132 -0.400 537 HG SER 68 HG SER 68 -7.598 -0.670 0.005 538 H GLU 69 H GLU 69 -5.489 1.675 2.198 539 HA GLU 69 HA GLU 69 -6.325 3.827 3.793 540 HB2 GLU 69 HB2 GLU 69 -3.993 1.946 3.876 541 HB3 GLU 69 HB3 GLU 69 -4.028 3.324 4.967 542 HG2 GLU 69 HG2 GLU 69 -6.262 1.319 4.777 543 HG3 GLU 69 HG3 GLU 69 -4.907 1.166 5.898 544 H TYR 70 H TYR 70 -3.933 3.619 1.292 545 HA TYR 70 HA TYR 70 -2.767 6.184 2.034 546 HB2 TYR 70 HB2 TYR 70 -2.009 3.974 0.198 547 HB3 TYR 70 HB3 TYR 70 -1.469 5.599 -0.222 548 HD1 TYR 70 HD1 TYR 70 -0.635 6.879 2.110 549 HD2 TYR 70 HD2 TYR 70 -0.364 2.728 1.219 550 HE1 TYR 70 HE1 TYR 70 1.238 6.669 3.684 551 HE2 TYR 70 HE2 TYR 70 1.510 2.509 2.797 552 HH TYR 70 HH TYR 70 3.279 4.021 3.770 553 H LEU 71 H LEU 71 -4.950 4.806 -0.304 554 HA LEU 71 HA LEU 71 -4.879 6.924 -2.179 555 HB2 LEU 71 HB2 LEU 71 -6.487 4.541 -1.755 556 HB3 LEU 71 HB3 LEU 71 -7.451 5.890 -2.317 557 HG LEU 71 HG LEU 71 -5.944 6.163 -4.258 558 HD11 LEU 71 HD11 LEU 71 -4.322 4.402 -4.790 559 HD12 LEU 71 HD12 LEU 71 -4.598 3.680 -3.205 560 HD13 LEU 71 HD13 LEU 71 -3.890 5.289 -3.333 561 HD21 LEU 71 HD21 LEU 71 -7.940 4.798 -4.530 562 HD22 LEU 71 HD22 LEU 71 -7.060 3.376 -3.966 563 HD23 LEU 71 HD23 LEU 71 -6.604 4.151 -5.479 564 H LYS 72 H LYS 72 -6.642 6.488 0.816 565 HA LYS 72 HA LYS 72 -8.471 8.615 0.399 566 HB2 LYS 72 HB2 LYS 72 -8.916 8.492 2.785 567 HB3 LYS 72 HB3 LYS 72 -8.816 6.872 2.112 568 HG2 LYS 72 HG2 LYS 72 -6.578 6.608 3.001 569 HG3 LYS 72 HG3 LYS 72 -6.607 8.262 3.611 570 HD2 LYS 72 HD2 LYS 72 -7.062 6.606 5.375 571 HD3 LYS 72 HD3 LYS 72 -8.418 7.708 5.123 572 HE2 LYS 72 HE2 LYS 72 -9.669 6.058 3.976 573 HE3 LYS 72 HE3 LYS 72 -8.260 5.012 3.801 574 HZ1 LYS 72 HZ1 LYS 72 -8.348 4.375 6.006 575 HZ2 LYS 72 HZ2 LYS 72 -9.989 4.471 5.597 576 HZ3 LYS 72 HZ3 LYS 72 -9.267 5.720 6.478 577 H LEU 73 H LEU 73 -5.147 8.474 1.270 578 HA LEU 73 HA LEU 73 -4.985 11.057 2.476 579 HB2 LEU 73 HB2 LEU 73 -3.370 9.039 2.702 580 HB3 LEU 73 HB3 LEU 73 -2.693 9.594 1.188 581 HG LEU 73 HG LEU 73 -1.421 10.284 3.224 582 HD11 LEU 73 HD11 LEU 73 -1.135 11.489 1.150 583 HD12 LEU 73 HD12 LEU 73 -1.060 12.596 2.522 584 HD13 LEU 73 HD13 LEU 73 -2.516 12.518 1.531 585 HD21 LEU 73 HD21 LEU 73 -3.576 12.301 3.738 586 HD22 LEU 73 HD22 LEU 73 -2.216 11.838 4.756 587 HD23 LEU 73 HD23 LEU 73 -3.573 10.732 4.547 588 H LYS 74 H LYS 74 -4.272 9.723 -0.742 589 HA LYS 74 HA LYS 74 -3.398 12.156 -1.868 590 HB2 LYS 74 HB2 LYS 74 -3.358 11.074 -3.924 591 HB3 LYS 74 HB3 LYS 74 -3.134 9.756 -2.786 592 HG2 LYS 74 HG2 LYS 74 -5.490 9.159 -2.995 593 HG3 LYS 74 HG3 LYS 74 -5.730 10.498 -4.118 594 HD2 LYS 74 HD2 LYS 74 -3.802 8.227 -4.589 595 HD3 LYS 74 HD3 LYS 74 -5.457 8.254 -5.197 596 HE2 LYS 74 HE2 LYS 74 -4.753 10.562 -6.193 597 HE3 LYS 74 HE3 LYS 74 -3.116 9.938 -5.983 598 HZ1 LYS 74 HZ1 LYS 74 -3.874 7.939 -7.266 599 HZ2 LYS 74 HZ2 LYS 74 -3.788 9.369 -8.157 600 HZ3 LYS 74 HZ3 LYS 74 -5.289 8.789 -7.644 601 H GLU 75 H GLU 75 -6.520 10.839 -1.232 602 HA GLU 75 HA GLU 75 -8.059 12.452 -2.972 603 HB2 GLU 75 HB2 GLU 75 -8.982 10.444 -1.971 604 HB3 GLU 75 HB3 GLU 75 -8.736 11.090 -0.358 605 HG2 GLU 75 HG2 GLU 75 -11.030 11.289 -0.805 606 HG3 GLU 75 HG3 GLU 75 -10.360 12.912 -0.956 607 H GLU 76 H GLU 76 -7.187 12.771 0.455 608 HA GLU 76 HA GLU 76 -8.436 15.296 0.820 609 HB2 GLU 76 HB2 GLU 76 -7.868 13.745 2.676 610 HB3 GLU 76 HB3 GLU 76 -6.162 14.065 2.393 611 HG2 GLU 76 HG2 GLU 76 -6.305 16.240 3.188 612 HG3 GLU 76 HG3 GLU 76 -8.057 16.299 2.989 613 H TYR 77 H TYR 77 -5.296 14.249 -0.236 614 HA TYR 77 HA TYR 77 -3.778 16.552 -0.014 615 HB2 TYR 77 HB2 TYR 77 -2.804 14.423 -0.625 616 HB3 TYR 77 HB3 TYR 77 -3.742 14.375 -2.110 617 HD1 TYR 77 HD1 TYR 77 -1.723 17.172 -0.693 618 HD2 TYR 77 HD2 TYR 77 -2.147 14.306 -3.802 619 HE1 TYR 77 HE1 TYR 77 0.172 18.192 -1.873 620 HE2 TYR 77 HE2 TYR 77 -0.250 15.316 -5.000 621 HH TYR 77 HH TYR 77 1.938 17.286 -3.644 622 H GLN 78 H GLN 78 -6.176 15.711 -2.436 623 HA GLN 78 HA GLN 78 -5.524 18.082 -3.987 624 HB2 GLN 78 HB2 GLN 78 -7.512 15.853 -4.375 625 HB3 GLN 78 HB3 GLN 78 -7.452 17.263 -5.425 626 HG2 GLN 78 HG2 GLN 78 -5.256 15.249 -4.990 627 HG3 GLN 78 HG3 GLN 78 -6.252 15.436 -6.432 628 HE21 GLN 78 HE21 GLN 78 -3.378 15.561 -6.207 629 HE22 GLN 78 HE22 GLN 78 -2.904 17.130 -6.761 630 H ARG 79 H ARG 79 -7.995 16.899 -1.824 631 HA ARG 79 HA ARG 79 -9.971 18.824 -2.283 632 HB2 ARG 79 HB2 ARG 79 -9.314 17.066 0.052 633 HB3 ARG 79 HB3 ARG 79 -10.625 18.231 0.144 634 HG2 ARG 79 HG2 ARG 79 -11.657 17.172 -1.837 635 HG3 ARG 79 HG3 ARG 79 -10.375 15.958 -1.814 636 HD2 ARG 79 HD2 ARG 79 -12.385 15.123 -0.725 637 HD3 ARG 79 HD3 ARG 79 -11.057 15.269 0.424 638 HE ARG 79 HE ARG 79 -12.246 17.561 0.888 639 HH11 ARG 79 HH11 ARG 79 -13.745 14.455 0.271 640 HH12 ARG 79 HH12 ARG 79 -15.138 14.790 1.246 641 HH21 ARG 79 HH21 ARG 79 -14.098 18.007 2.171 642 HH22 ARG 79 HH22 ARG 79 -15.341 16.806 2.324 643 H LEU 80 H LEU 80 -7.404 18.816 0.233 644 HA LEU 80 HA LEU 80 -8.288 21.343 1.223 645 HB2 LEU 80 HB2 LEU 80 -6.712 21.186 2.879 646 HB3 LEU 80 HB3 LEU 80 -7.061 19.517 2.523 647 HG LEU 80 HG LEU 80 -4.792 19.475 2.836 648 HD11 LEU 80 HD11 LEU 80 -5.016 18.360 0.817 649 HD12 LEU 80 HD12 LEU 80 -3.651 19.448 0.581 650 HD13 LEU 80 HD13 LEU 80 -5.230 19.855 -0.091 651 HD21 LEU 80 HD21 LEU 80 -3.208 21.177 2.012 652 HD22 LEU 80 HD22 LEU 80 -4.397 21.812 3.150 653 HD23 LEU 80 HD23 LEU 80 -4.578 22.120 1.423 654 H ARG 81 H ARG 81 -6.712 20.611 -1.559 655 HA ARG 81 HA ARG 81 -5.063 23.019 -1.599 656 HB2 ARG 81 HB2 ARG 81 -5.345 20.637 -3.394 657 HB3 ARG 81 HB3 ARG 81 -4.656 22.125 -4.028 658 HG2 ARG 81 HG2 ARG 81 -2.973 22.044 -2.187 659 HG3 ARG 81 HG3 ARG 81 -3.611 20.459 -1.754 660 HD2 ARG 81 HD2 ARG 81 -1.691 20.134 -3.147 661 HD3 ARG 81 HD3 ARG 81 -3.125 19.697 -4.070 662 HE ARG 81 HE ARG 81 -1.504 22.121 -4.446 663 HH11 ARG 81 HH11 ARG 81 -3.969 19.908 -5.593 664 HH12 ARG 81 HH12 ARG 81 -4.014 20.592 -7.184 665 HH21 ARG 81 HH21 ARG 81 -1.576 23.012 -6.554 666 HH22 ARG 81 HH22 ARG 81 -2.670 22.353 -7.727 667 H GLU 82 H GLU 82 -7.732 21.561 -3.457 668 HA GLU 82 HA GLU 82 -8.104 23.835 -5.105 669 HB2 GLU 82 HB2 GLU 82 -10.112 22.749 -5.892 670 HB3 GLU 82 HB3 GLU 82 -8.803 21.584 -5.777 671 HG2 GLU 82 HG2 GLU 82 -9.793 20.425 -4.088 672 HG3 GLU 82 HG3 GLU 82 -10.636 21.842 -3.461 673 H GLN 83 H GLN 83 -9.357 22.974 -1.960 674 HA GLN 83 HA GLN 83 -11.562 24.786 -2.009 675 HB2 GLN 83 HB2 GLN 83 -11.773 24.360 0.358 676 HB3 GLN 83 HB3 GLN 83 -11.423 22.847 -0.464 677 HG2 GLN 83 HG2 GLN 83 -9.150 22.899 0.267 678 HG3 GLN 83 HG3 GLN 83 -9.352 24.520 0.928 679 HE21 GLN 83 HE21 GLN 83 -10.414 24.796 2.870 680 HE22 GLN 83 HE22 GLN 83 -10.782 23.477 3.926 681 H LEU 84 H LEU 84 -8.189 25.182 -1.534 682 HA LEU 84 HA LEU 84 -8.479 27.705 -0.122 683 HB2 LEU 84 HB2 LEU 84 -6.469 25.779 -0.296 684 HB3 LEU 84 HB3 LEU 84 -5.829 27.161 -1.168 685 HG LEU 84 HG LEU 84 -6.893 27.269 1.661 686 HD11 LEU 84 HD11 LEU 84 -4.044 27.118 0.677 687 HD12 LEU 84 HD12 LEU 84 -4.894 25.926 1.665 688 HD13 LEU 84 HD13 LEU 84 -4.522 27.518 2.324 689 HD21 LEU 84 HD21 LEU 84 -7.007 29.381 0.341 690 HD22 LEU 84 HD22 LEU 84 -5.253 29.311 0.172 691 HD23 LEU 84 HD23 LEU 84 -5.979 29.469 1.769 692 H LYS 85 H LYS 85 -7.485 26.523 -3.294 693 HA LYS 85 HA LYS 85 -6.868 29.091 -4.352 694 HB2 LYS 85 HB2 LYS 85 -6.400 28.005 -6.345 695 HB3 LYS 85 HB3 LYS 85 -6.185 26.694 -5.189 696 HG2 LYS 85 HG2 LYS 85 -8.437 25.893 -5.673 697 HG3 LYS 85 HG3 LYS 85 -8.666 27.216 -6.808 698 HD2 LYS 85 HD2 LYS 85 -6.799 26.343 -8.161 699 HD3 LYS 85 HD3 LYS 85 -6.658 24.980 -7.046 700 HE2 LYS 85 HE2 LYS 85 -7.970 24.451 -9.086 701 HE3 LYS 85 HE3 LYS 85 -8.875 24.231 -7.590 702 HZ1 LYS 85 HZ1 LYS 85 -10.173 25.345 -9.317 703 HZ2 LYS 85 HZ2 LYS 85 -9.061 26.617 -9.348 704 HZ3 LYS 85 HZ3 LYS 85 -9.979 26.332 -7.954 705 H LYS 86 H LYS 86 -9.751 27.158 -4.088 706 HA LYS 86 HA LYS 86 -11.943 27.572 -4.471 707 HB2 LYS 86 HB2 LYS 86 -11.084 30.410 -5.068 708 HB3 LYS 86 HB3 LYS 86 -12.734 29.870 -4.792 709 HG2 LYS 86 HG2 LYS 86 -12.287 29.390 -2.513 710 HG3 LYS 86 HG3 LYS 86 -10.550 29.603 -2.742 711 HD2 LYS 86 HD2 LYS 86 -12.641 31.761 -3.017 712 HD3 LYS 86 HD3 LYS 86 -11.577 31.534 -1.628 713 HE2 LYS 86 HE2 LYS 86 -10.806 32.296 -4.440 714 HE3 LYS 86 HE3 LYS 86 -10.652 33.272 -2.982 715 HZ1 LYS 86 HZ1 LYS 86 -8.521 32.432 -3.474 716 HZ2 LYS 86 HZ2 LYS 86 -9.096 30.863 -3.723 717 HZ3 LYS 86 HZ3 LYS 86 -9.075 31.515 -2.161 718 H1 GLY 1 H1 GLY 1 -36.648 3.119 10.213 719 H2 GLY 1 H2 GLY 1 -37.702 4.069 11.129 720 H3 GLY 1 H3 GLY 1 -38.318 2.955 10.020 721 HA2 GLY 1 HA3 GLY 1 -38.531 2.125 12.270 722 HA3 GLY 1 HA2 GLY 1 -37.464 1.119 11.303 723 H SER 2 H SER 2 -36.442 0.331 13.197 724 HA SER 2 HA SER 2 -35.032 2.268 14.854 725 HB2 SER 2 HB2 SER 2 -35.015 -0.729 15.194 726 HB3 SER 2 HB3 SER 2 -34.717 0.513 16.412 727 HG SER 2 HG SER 2 -37.072 1.088 15.570 728 H HIS 3 H HIS 3 -34.412 0.020 12.303 729 HA HIS 3 HA HIS 3 -31.548 -0.042 12.795 730 HB2 HIS 3 HB2 HIS 3 -33.417 -1.408 10.939 731 HB3 HIS 3 HB3 HIS 3 -31.778 -1.153 10.355 732 HD1 HIS 3 HD1 HIS 3 -33.759 -3.492 12.225 733 HD2 HIS 3 HD2 HIS 3 -29.786 -2.269 12.275 734 HE1 HIS 3 HE1 HIS 3 -32.511 -5.299 13.450 735 HE2 HIS 3 HE2 HIS 3 -30.095 -4.596 13.367 736 H MET 4 H MET 4 -30.681 1.929 12.484 737 HA MET 4 HA MET 4 -30.703 2.945 9.759 738 HB2 MET 4 HB2 MET 4 -31.067 5.288 10.588 739 HB3 MET 4 HB3 MET 4 -32.477 4.245 10.663 740 HG2 MET 4 HG2 MET 4 -31.851 3.847 13.100 741 HG3 MET 4 HG3 MET 4 -30.746 5.209 12.913 742 HE1 MET 4 HE1 MET 4 -31.951 6.570 14.872 743 HE2 MET 4 HE2 MET 4 -32.961 5.145 15.109 744 HE3 MET 4 HE3 MET 4 -33.702 6.742 14.975 745 H THR 5 H THR 5 -28.689 3.263 9.167 746 HA THR 5 HA THR 5 -26.727 4.080 11.198 747 HB THR 5 HB THR 5 -25.201 2.791 9.341 748 HG1 THR 5 HG1 THR 5 -26.309 0.796 8.937 749 HG21 THR 5 HG21 THR 5 -25.085 0.944 10.973 750 HG22 THR 5 HG22 THR 5 -26.498 1.608 11.797 751 HG23 THR 5 HG23 THR 5 -24.990 2.525 11.746 752 H GLU 6 H GLU 6 -25.424 5.744 10.689 753 HA GLU 6 HA GLU 6 -25.904 7.088 8.146 754 HB2 GLU 6 HB2 GLU 6 -24.373 7.983 10.600 755 HB3 GLU 6 HB3 GLU 6 -24.663 8.972 9.173 756 HG2 GLU 6 HG2 GLU 6 -27.038 8.939 9.583 757 HG3 GLU 6 HG3 GLU 6 -26.818 7.836 10.939 758 H GLN 7 H GLN 7 -24.754 5.773 6.728 759 HA GLN 7 HA GLN 7 -22.991 4.932 5.575 760 HB2 GLN 7 HB2 GLN 7 -21.623 7.382 6.701 761 HB3 GLN 7 HB3 GLN 7 -21.011 6.401 5.375 762 HG2 GLN 7 HG2 GLN 7 -23.319 6.915 4.290 763 HG3 GLN 7 HG3 GLN 7 -23.347 8.251 5.439 764 HE21 GLN 7 HE21 GLN 7 -23.203 9.838 3.906 765 HE22 GLN 7 HE22 GLN 7 -21.782 10.112 2.958 766 HA PRO 8 HA PRO 8 -20.974 2.950 9.199 767 HB2 PRO 8 HB2 PRO 8 -21.824 0.449 8.769 768 HB3 PRO 8 HB3 PRO 8 -22.863 1.655 9.538 769 HG2 PRO 8 HG2 PRO 8 -22.878 0.665 6.721 770 HG3 PRO 8 HG3 PRO 8 -24.244 1.047 7.783 771 HD2 PRO 8 HD2 PRO 8 -23.245 2.728 5.823 772 HD3 PRO 8 HD3 PRO 8 -24.203 3.255 7.219 773 H LYS 9 H LYS 9 -19.285 1.305 9.245 774 HA LYS 9 HA LYS 9 -17.726 1.337 6.831 775 HB2 LYS 9 HB2 LYS 9 -17.238 0.163 9.565 776 HB3 LYS 9 HB3 LYS 9 -16.104 -0.029 8.234 777 HG2 LYS 9 HG2 LYS 9 -16.297 2.592 8.136 778 HG3 LYS 9 HG3 LYS 9 -16.800 2.389 9.812 779 HD2 LYS 9 HD2 LYS 9 -14.737 1.128 10.267 780 HD3 LYS 9 HD3 LYS 9 -14.219 1.387 8.600 781 HE2 LYS 9 HE2 LYS 9 -14.587 3.909 9.196 782 HE3 LYS 9 HE3 LYS 9 -14.438 3.332 10.853 783 HZ1 LYS 9 HZ1 LYS 9 -12.423 2.924 8.712 784 HZ2 LYS 9 HZ2 LYS 9 -12.277 2.422 10.319 785 HZ3 LYS 9 HZ3 LYS 9 -12.319 4.070 9.951 786 H THR 10 H THR 10 -19.000 0.158 5.414 787 HA THR 10 HA THR 10 -19.604 -2.608 5.985 788 HB THR 10 HB THR 10 -21.139 -1.095 4.668 789 HG1 THR 10 HG1 THR 10 -20.848 -3.050 2.845 790 HG21 THR 10 HG21 THR 10 -20.652 -0.896 2.234 791 HG22 THR 10 HG22 THR 10 -19.019 -1.478 2.554 792 HG23 THR 10 HG23 THR 10 -19.562 0.048 3.250 793 H ARG 11 H ARG 11 -19.053 -4.233 4.207 794 HA ARG 11 HA ARG 11 -16.207 -3.912 3.542 795 HB2 ARG 11 HB2 ARG 11 -15.948 -6.294 3.736 796 HB3 ARG 11 HB3 ARG 11 -16.743 -5.708 5.189 797 HG2 ARG 11 HG2 ARG 11 -18.929 -6.389 4.070 798 HG3 ARG 11 HG3 ARG 11 -17.925 -7.259 2.911 799 HD2 ARG 11 HD2 ARG 11 -18.402 -8.882 4.490 800 HD3 ARG 11 HD3 ARG 11 -16.823 -8.296 5.004 801 HE ARG 11 HE ARG 11 -18.037 -6.928 6.674 802 HH11 ARG 11 HH11 ARG 11 -19.583 -9.760 5.306 803 HH12 ARG 11 HH12 ARG 11 -20.650 -9.983 6.655 804 HH21 ARG 11 HH21 ARG 11 -19.461 -7.218 8.445 805 HH22 ARG 11 HH22 ARG 11 -20.577 -8.551 8.434 806 H VAL 12 H VAL 12 -15.474 -4.451 1.523 807 HA VAL 12 HA VAL 12 -17.552 -4.900 -0.518 808 HB VAL 12 HB VAL 12 -16.509 -2.661 -0.642 809 HG11 VAL 12 HG11 VAL 12 -14.143 -2.537 -1.506 810 HG12 VAL 12 HG12 VAL 12 -13.967 -4.225 -1.020 811 HG13 VAL 12 HG13 VAL 12 -14.322 -2.992 0.190 812 HG21 VAL 12 HG21 VAL 12 -15.882 -4.499 -2.943 813 HG22 VAL 12 HG22 VAL 12 -15.905 -2.736 -3.036 814 HG23 VAL 12 HG23 VAL 12 -17.385 -3.622 -2.664 815 H SER 13 H SER 13 -17.197 -6.438 -2.075 816 HA SER 13 HA SER 13 -14.882 -8.188 -1.647 817 HB2 SER 13 HB2 SER 13 -17.172 -9.152 -3.261 818 HB3 SER 13 HB3 SER 13 -16.232 -9.989 -2.024 819 HG SER 13 HG SER 13 -18.437 -9.510 -1.418 820 H VAL 14 H VAL 14 -13.345 -8.143 -3.175 821 HA VAL 14 HA VAL 14 -14.126 -7.549 -5.947 822 HB VAL 14 HB VAL 14 -11.868 -6.302 -6.112 823 HG11 VAL 14 HG11 VAL 14 -13.981 -5.195 -6.447 824 HG12 VAL 14 HG12 VAL 14 -12.948 -4.171 -5.445 825 HG13 VAL 14 HG13 VAL 14 -14.252 -5.103 -4.707 826 HG21 VAL 14 HG21 VAL 14 -12.394 -6.022 -3.154 827 HG22 VAL 14 HG22 VAL 14 -11.170 -5.150 -4.076 828 HG23 VAL 14 HG23 VAL 14 -11.049 -6.900 -3.882 829 H ARG 15 H ARG 15 -12.560 -8.266 -7.555 830 HA ARG 15 HA ARG 15 -11.274 -10.738 -6.701 831 HB2 ARG 15 HB2 ARG 15 -12.761 -10.965 -8.563 832 HB3 ARG 15 HB3 ARG 15 -11.972 -9.650 -9.422 833 HG2 ARG 15 HG2 ARG 15 -10.036 -10.954 -9.822 834 HG3 ARG 15 HG3 ARG 15 -10.568 -12.207 -8.699 835 HD2 ARG 15 HD2 ARG 15 -12.232 -11.497 -11.078 836 HD3 ARG 15 HD3 ARG 15 -10.848 -12.577 -11.248 837 HE ARG 15 HE ARG 15 -12.287 -13.581 -9.140 838 HH11 ARG 15 HH11 ARG 15 -12.994 -12.851 -12.491 839 HH12 ARG 15 HH12 ARG 15 -14.139 -14.142 -12.661 840 HH21 ARG 15 HH21 ARG 15 -13.798 -15.267 -9.352 841 HH22 ARG 15 HH22 ARG 15 -14.600 -15.512 -10.872 842 H ILE 16 H ILE 16 -9.159 -10.949 -6.476 843 HA ILE 16 HA ILE 16 -7.348 -9.110 -7.891 844 HB ILE 16 HB ILE 16 -6.841 -10.048 -5.065 845 HG12 ILE 16 HG12 ILE 16 -7.826 -7.292 -5.808 846 HG13 ILE 16 HG13 ILE 16 -8.920 -8.572 -5.297 847 HG21 ILE 16 HG21 ILE 16 -4.938 -9.343 -6.527 848 HG22 ILE 16 HG22 ILE 16 -5.113 -8.396 -5.052 849 HG23 ILE 16 HG23 ILE 16 -5.658 -7.736 -6.596 850 HD11 ILE 16 HD11 ILE 16 -6.699 -7.335 -3.692 851 HD12 ILE 16 HD12 ILE 16 -7.638 -8.735 -3.177 852 HD13 ILE 16 HD13 ILE 16 -8.435 -7.180 -3.422 853 H TYR 17 H TYR 17 -6.003 -10.276 -9.124 854 HA TYR 17 HA TYR 17 -4.647 -11.929 -9.888 855 HB2 TYR 17 HB2 TYR 17 -3.980 -11.744 -7.259 856 HB3 TYR 17 HB3 TYR 17 -4.489 -13.426 -7.342 857 HD1 TYR 17 HD2 TYR 17 -2.239 -10.972 -9.015 858 HD2 TYR 17 HD1 TYR 17 -2.988 -15.055 -8.079 859 HE1 TYR 17 HE2 TYR 17 -0.043 -11.582 -9.937 860 HE2 TYR 17 HE1 TYR 17 -0.791 -15.671 -8.999 861 HH TYR 17 HH TYR 17 0.834 -14.726 -10.671 862 H GLY 18 H GLY 18 -7.570 -12.242 -9.807 863 HA2 GLY 18 HA2 GLY 18 -8.854 -13.906 -10.850 864 HA3 GLY 18 HA3 GLY 18 -7.618 -15.085 -10.444 865 H GLN 19 H GLN 19 -7.924 -13.693 -7.603 866 HA GLN 19 HA GLN 19 -10.184 -15.405 -6.808 867 HB2 GLN 19 HB2 GLN 19 -7.674 -14.716 -5.266 868 HB3 GLN 19 HB3 GLN 19 -9.012 -15.672 -4.638 869 HG2 GLN 19 HG2 GLN 19 -8.543 -17.477 -5.999 870 HG3 GLN 19 HG3 GLN 19 -7.661 -16.496 -7.166 871 HE21 GLN 19 HE21 GLN 19 -5.522 -15.932 -6.739 872 HE22 GLN 19 HE22 GLN 19 -4.580 -16.760 -5.552 873 H ASP 20 H ASP 20 -11.733 -14.568 -5.450 874 HA ASP 20 HA ASP 20 -11.689 -11.669 -5.180 875 HB2 ASP 20 HB2 ASP 20 -14.054 -11.793 -4.749 876 HB3 ASP 20 HB3 ASP 20 -13.688 -12.794 -6.149 877 H TYR 21 H TYR 21 -11.774 -10.550 -3.315 878 HA TYR 21 HA TYR 21 -11.724 -12.061 -0.793 879 HB2 TYR 21 HB2 TYR 21 -9.823 -9.809 -1.502 880 HB3 TYR 21 HB3 TYR 21 -9.894 -10.650 0.042 881 HD1 TYR 21 HD2 TYR 21 -9.215 -13.043 0.169 882 HD2 TYR 21 HD1 TYR 21 -8.640 -10.721 -3.345 883 HE1 TYR 21 HE2 TYR 21 -7.608 -14.704 -0.657 884 HE2 TYR 21 HE1 TYR 21 -7.027 -12.378 -4.184 885 HH TYR 21 HH TYR 21 -5.674 -14.136 -3.496 886 H THR 22 H THR 22 -12.161 -10.684 1.095 887 HA THR 22 HA THR 22 -13.947 -8.449 0.408 888 HB THR 22 HB THR 22 -14.420 -9.530 3.036 889 HG1 THR 22 HG1 THR 22 -15.324 -11.579 1.987 890 HG21 THR 22 HG21 THR 22 -16.023 -8.203 1.733 891 HG22 THR 22 HG22 THR 22 -16.699 -9.768 2.181 892 HG23 THR 22 HG23 THR 22 -16.119 -9.495 0.538 893 H ILE 23 H ILE 23 -13.431 -6.503 1.219 894 HA ILE 23 HA ILE 23 -11.814 -6.335 3.657 895 HB ILE 23 HB ILE 23 -10.405 -4.550 2.713 896 HG12 ILE 23 HG12 ILE 23 -12.064 -4.116 0.770 897 HG13 ILE 23 HG13 ILE 23 -10.343 -3.933 0.472 898 HG21 ILE 23 HG21 ILE 23 -10.210 -7.270 1.464 899 HG22 ILE 23 HG22 ILE 23 -9.409 -6.663 2.913 900 HG23 ILE 23 HG23 ILE 23 -8.947 -6.044 1.332 901 HD11 ILE 23 HD11 ILE 23 -11.799 -6.468 -0.196 902 HD12 ILE 23 HD12 ILE 23 -10.245 -5.893 -0.801 903 HD13 ILE 23 HD13 ILE 23 -11.734 -5.097 -1.300 904 H VAL 24 H VAL 24 -11.610 -3.877 4.259 905 HA VAL 24 HA VAL 24 -14.338 -2.880 4.314 906 HB VAL 24 HB VAL 24 -11.897 -1.746 5.693 907 HG11 VAL 24 HG11 VAL 24 -14.848 -1.361 6.196 908 HG12 VAL 24 HG12 VAL 24 -13.735 -0.171 5.518 909 HG13 VAL 24 HG13 VAL 24 -13.546 -0.705 7.190 910 HG21 VAL 24 HG21 VAL 24 -12.247 -4.052 6.399 911 HG22 VAL 24 HG22 VAL 24 -13.936 -3.702 6.756 912 HG23 VAL 24 HG23 VAL 24 -12.659 -2.934 7.696 913 H GLY 25 H GLY 25 -15.054 -1.178 3.151 914 HA2 GLY 25 HA2 GLY 25 -13.033 0.530 1.843 915 HA3 GLY 25 HA3 GLY 25 -14.381 -0.134 0.934 916 H ALA 26 H ALA 26 -13.959 1.586 4.036 917 HA ALA 26 HA ALA 26 -16.425 3.047 3.533 918 HB1 ALA 26 HB1 ALA 26 -14.617 3.214 5.932 919 HB2 ALA 26 HB2 ALA 26 -15.919 2.040 5.755 920 HB3 ALA 26 HB3 ALA 26 -16.289 3.764 5.810 921 H GLU 27 H GLU 27 -14.852 3.887 1.637 922 HA GLU 27 HA GLU 27 -14.023 6.561 2.507 923 HB2 GLU 27 HB2 GLU 27 -12.006 5.134 2.231 924 HB3 GLU 27 HB3 GLU 27 -12.466 4.838 0.562 925 HG2 GLU 27 HG2 GLU 27 -12.415 7.652 1.055 926 HG3 GLU 27 HG3 GLU 27 -10.897 6.926 1.581 927 H SER 28 H SER 28 -14.355 4.611 -0.454 928 HA SER 28 HA SER 28 -16.528 6.147 -1.436 929 HB2 SER 28 HB2 SER 28 -15.011 7.844 -2.044 930 HB3 SER 28 HB3 SER 28 -13.756 6.693 -2.488 931 HG SER 28 HG SER 28 -15.291 7.874 -4.135 932 HA PRO 29 HA PRO 29 -16.989 2.125 -3.261 933 HB2 PRO 29 HB2 PRO 29 -18.922 2.840 -5.098 934 HB3 PRO 29 HB3 PRO 29 -19.236 2.422 -3.412 935 HG2 PRO 29 HG2 PRO 29 -18.997 5.112 -4.685 936 HG3 PRO 29 HG3 PRO 29 -20.119 4.564 -3.429 937 HD2 PRO 29 HD2 PRO 29 -17.972 6.060 -2.843 938 HD3 PRO 29 HD3 PRO 29 -18.546 4.785 -1.747 939 H ALA 30 H ALA 30 -16.219 5.006 -5.042 940 HA ALA 30 HA ALA 30 -15.618 3.583 -7.498 941 HB1 ALA 30 HB1 ALA 30 -14.965 5.765 -8.365 942 HB2 ALA 30 HB2 ALA 30 -15.123 6.466 -6.753 943 HB3 ALA 30 HB3 ALA 30 -16.547 5.849 -7.589 944 H HIS 31 H HIS 31 -13.873 5.209 -4.889 945 HA HIS 31 HA HIS 31 -11.266 4.933 -5.914 946 HB2 HIS 31 HB2 HIS 31 -12.463 5.522 -3.285 947 HB3 HIS 31 HB3 HIS 31 -10.884 4.762 -3.208 948 HD1 HIS 31 HD1 HIS 31 -8.924 6.253 -3.473 949 HD2 HIS 31 HD2 HIS 31 -12.436 8.048 -4.750 950 HE1 HIS 31 HE1 HIS 31 -8.317 8.641 -3.949 951 HE2 HIS 31 HE2 HIS 31 -10.526 9.763 -4.397 952 H ILE 32 H ILE 32 -13.019 2.920 -3.574 953 HA ILE 32 HA ILE 32 -11.010 0.979 -3.267 954 HB ILE 32 HB ILE 32 -12.680 -0.403 -2.194 955 HG12 ILE 32 HG12 ILE 32 -14.707 1.595 -3.244 956 HG13 ILE 32 HG13 ILE 32 -14.534 -0.070 -3.775 957 HG21 ILE 32 HG21 ILE 32 -13.283 2.432 -1.414 958 HG22 ILE 32 HG22 ILE 32 -11.711 1.691 -1.125 959 HG23 ILE 32 HG23 ILE 32 -13.156 1.008 -0.383 960 HD11 ILE 32 HD11 ILE 32 -15.042 -0.715 -1.369 961 HD12 ILE 32 HD12 ILE 32 -16.368 -0.057 -2.329 962 HD13 ILE 32 HD13 ILE 32 -15.544 0.961 -1.149 963 H ARG 33 H ARG 33 -13.151 1.491 -5.871 964 HA ARG 33 HA ARG 33 -13.329 -1.234 -6.722 965 HB2 ARG 33 HB2 ARG 33 -14.880 0.770 -7.315 966 HB3 ARG 33 HB3 ARG 33 -13.679 1.116 -8.554 967 HG2 ARG 33 HG2 ARG 33 -15.262 -0.161 -9.666 968 HG3 ARG 33 HG3 ARG 33 -14.005 -1.332 -9.261 969 HD2 ARG 33 HD2 ARG 33 -15.328 -1.923 -7.228 970 HD3 ARG 33 HD3 ARG 33 -16.612 -0.877 -7.825 971 HE ARG 33 HE ARG 33 -15.842 -2.804 -9.774 972 HH11 ARG 33 HH11 ARG 33 -17.694 -2.379 -6.840 973 HH12 ARG 33 HH12 ARG 33 -18.772 -3.695 -7.172 974 HH21 ARG 33 HH21 ARG 33 -17.281 -4.532 -10.238 975 HH22 ARG 33 HH22 ARG 33 -18.538 -4.917 -9.106 976 H LEU 34 H LEU 34 -11.337 1.550 -7.618 977 HA LEU 34 HA LEU 34 -9.923 0.058 -9.628 978 HB2 LEU 34 HB2 LEU 34 -8.717 2.033 -10.068 979 HB3 LEU 34 HB3 LEU 34 -10.354 2.536 -9.706 980 HG LEU 34 HG LEU 34 -9.066 2.685 -7.254 981 HD11 LEU 34 HD11 LEU 34 -7.100 4.125 -7.777 982 HD12 LEU 34 HD12 LEU 34 -7.250 3.638 -9.464 983 HD13 LEU 34 HD13 LEU 34 -6.888 2.435 -8.227 984 HD21 LEU 34 HD21 LEU 34 -9.301 5.101 -7.573 985 HD22 LEU 34 HD22 LEU 34 -10.734 4.234 -8.127 986 HD23 LEU 34 HD23 LEU 34 -9.567 4.845 -9.297 987 H VAL 35 H VAL 35 -9.681 0.398 -6.265 988 HA VAL 35 HA VAL 35 -6.937 0.186 -5.805 989 HB VAL 35 HB VAL 35 -9.292 -0.820 -4.204 990 HG11 VAL 35 HG11 VAL 35 -7.675 -1.020 -2.308 991 HG12 VAL 35 HG12 VAL 35 -6.369 -0.858 -3.482 992 HG13 VAL 35 HG13 VAL 35 -7.471 -2.231 -3.572 993 HG21 VAL 35 HG21 VAL 35 -8.978 1.629 -4.470 994 HG22 VAL 35 HG22 VAL 35 -7.401 1.469 -3.699 995 HG23 VAL 35 HG23 VAL 35 -8.865 1.078 -2.801 996 H ALA 36 H ALA 36 -9.367 -2.332 -6.336 997 HA ALA 36 HA ALA 36 -7.718 -4.559 -5.903 998 HB1 ALA 36 HB1 ALA 36 -10.221 -4.556 -6.072 999 HB2 ALA 36 HB2 ALA 36 -9.413 -5.853 -6.950 1000 HB3 ALA 36 HB3 ALA 36 -10.033 -4.451 -7.821 1001 H ALA 37 H ALA 37 -8.512 -2.817 -8.890 1002 HA ALA 37 HA ALA 37 -7.087 -4.467 -10.654 1003 HB1 ALA 37 HB1 ALA 37 -8.786 -2.842 -11.360 1004 HB2 ALA 37 HB2 ALA 37 -7.269 -2.638 -12.236 1005 HB3 ALA 37 HB3 ALA 37 -7.693 -1.527 -10.931 1006 H PHE 38 H PHE 38 -6.097 -1.714 -8.711 1007 HA PHE 38 HA PHE 38 -3.572 -1.303 -9.905 1008 HB2 PHE 38 HB2 PHE 38 -4.661 0.368 -8.463 1009 HB3 PHE 38 HB3 PHE 38 -4.479 -0.705 -7.080 1010 HD1 PHE 38 HD2 PHE 38 -2.340 0.771 -9.760 1011 HD2 PHE 38 HD1 PHE 38 -2.762 -0.238 -5.648 1012 HE1 PHE 38 HE2 PHE 38 -0.131 1.748 -9.299 1013 HE2 PHE 38 HE1 PHE 38 -0.553 0.735 -5.180 1014 HZ PHE 38 HZ PHE 38 0.766 1.729 -7.004 1015 H VAL 39 H VAL 39 -4.557 -3.179 -7.051 1016 HA VAL 39 HA VAL 39 -1.932 -4.134 -6.475 1017 HB VAL 39 HB VAL 39 -4.586 -5.326 -5.639 1018 HG11 VAL 39 HG11 VAL 39 -3.297 -6.289 -3.777 1019 HG12 VAL 39 HG12 VAL 39 -1.814 -5.651 -4.486 1020 HG13 VAL 39 HG13 VAL 39 -2.743 -6.880 -5.342 1021 HG21 VAL 39 HG21 VAL 39 -4.853 -3.597 -4.274 1022 HG22 VAL 39 HG22 VAL 39 -3.417 -2.842 -4.965 1023 HG23 VAL 39 HG23 VAL 39 -3.268 -3.892 -3.557 1024 H ASP 40 H ASP 40 -4.706 -5.425 -8.225 1025 HA ASP 40 HA ASP 40 -3.800 -8.001 -8.762 1026 HB2 ASP 40 HB2 ASP 40 -6.088 -7.213 -9.245 1027 HB3 ASP 40 HB3 ASP 40 -5.464 -6.181 -10.526 1028 H ASP 41 H ASP 41 -3.218 -4.974 -10.460 1029 HA ASP 41 HA ASP 41 -1.706 -6.123 -12.582 1030 HB2 ASP 41 HB2 ASP 41 -2.779 -4.014 -12.957 1031 HB3 ASP 41 HB3 ASP 41 -1.975 -3.293 -11.569 1032 H LYS 42 H LYS 42 -0.862 -4.500 -9.546 1033 HA LYS 42 HA LYS 42 1.904 -4.390 -9.940 1034 HB2 LYS 42 HB2 LYS 42 0.468 -3.305 -8.090 1035 HB3 LYS 42 HB3 LYS 42 0.675 -4.827 -7.232 1036 HG2 LYS 42 HG2 LYS 42 2.720 -4.274 -6.579 1037 HG3 LYS 42 HG3 LYS 42 3.197 -3.830 -8.217 1038 HD2 LYS 42 HD2 LYS 42 1.566 -2.046 -6.422 1039 HD3 LYS 42 HD3 LYS 42 3.326 -1.988 -6.508 1040 HE2 LYS 42 HE2 LYS 42 1.665 -1.751 -8.993 1041 HE3 LYS 42 HE3 LYS 42 1.934 -0.351 -7.955 1042 HZ1 LYS 42 HZ1 LYS 42 4.365 -0.823 -8.187 1043 HZ2 LYS 42 HZ2 LYS 42 3.590 -0.318 -9.605 1044 HZ3 LYS 42 HZ3 LYS 42 3.970 -1.955 -9.399 1045 H MET 43 H MET 43 -0.102 -6.932 -8.486 1046 HA MET 43 HA MET 43 2.101 -8.638 -7.868 1047 HB2 MET 43 HB2 MET 43 -0.859 -9.136 -8.116 1048 HB3 MET 43 HB3 MET 43 0.280 -10.416 -7.725 1049 HG2 MET 43 HG2 MET 43 0.994 -9.118 -5.747 1050 HG3 MET 43 HG3 MET 43 -0.253 -7.929 -6.123 1051 HE1 MET 43 HE1 MET 43 -1.023 -12.275 -4.799 1052 HE2 MET 43 HE2 MET 43 0.565 -11.547 -5.055 1053 HE3 MET 43 HE3 MET 43 -0.476 -11.906 -6.436 1054 H HIS 44 H HIS 44 0.192 -8.045 -10.671 1055 HA HIS 44 HA HIS 44 0.864 -10.462 -12.048 1056 HB2 HIS 44 HB2 HIS 44 -1.173 -8.985 -12.433 1057 HB3 HIS 44 HB3 HIS 44 -0.100 -7.883 -13.281 1058 HD1 HIS 44 HD1 HIS 44 -0.577 -8.144 -15.684 1059 HD2 HIS 44 HD2 HIS 44 -0.502 -11.807 -13.723 1060 HE1 HIS 44 HE1 HIS 44 -0.918 -9.873 -17.472 1061 HE2 HIS 44 HE2 HIS 44 -1.071 -12.058 -16.232 1062 H GLU 45 H GLU 45 2.331 -7.319 -11.698 1063 HA GLU 45 HA GLU 45 4.122 -7.771 -13.945 1064 HB2 GLU 45 HB2 GLU 45 4.850 -5.546 -13.669 1065 HB3 GLU 45 HB3 GLU 45 3.114 -5.516 -13.374 1066 HG2 GLU 45 HG2 GLU 45 3.487 -5.451 -10.981 1067 HG3 GLU 45 HG3 GLU 45 5.225 -5.605 -11.218 1068 H PHE 46 H PHE 46 4.223 -7.899 -10.436 1069 HA PHE 46 HA PHE 46 7.120 -8.152 -10.473 1070 HB2 PHE 46 HB2 PHE 46 5.096 -7.879 -8.275 1071 HB3 PHE 46 HB3 PHE 46 6.758 -8.349 -7.931 1072 HD1 PHE 46 HD2 PHE 46 8.499 -6.757 -9.337 1073 HD2 PHE 46 HD1 PHE 46 4.636 -5.669 -7.921 1074 HE1 PHE 46 HE2 PHE 46 9.165 -4.390 -9.350 1075 HE2 PHE 46 HE1 PHE 46 5.297 -3.299 -7.930 1076 HZ PHE 46 HZ PHE 46 7.565 -2.657 -8.645 1077 H SER 47 H SER 47 4.771 -10.292 -11.094 1078 HA SER 47 HA SER 47 5.365 -12.472 -9.388 1079 HB2 SER 47 HB2 SER 47 4.401 -13.759 -11.496 1080 HB3 SER 47 HB3 SER 47 3.351 -12.772 -10.475 1081 HG SER 47 HG SER 47 2.904 -11.878 -12.339 1082 H GLU 48 H GLU 48 7.032 -11.089 -12.001 1083 HA GLU 48 HA GLU 48 8.498 -13.443 -12.791 1084 HB2 GLU 48 HB2 GLU 48 9.724 -11.897 -14.259 1085 HB3 GLU 48 HB3 GLU 48 7.982 -11.734 -14.441 1086 HG2 GLU 48 HG2 GLU 48 7.932 -9.657 -13.488 1087 HG3 GLU 48 HG3 GLU 48 9.386 -9.942 -12.528 1088 H LYS 49 H LYS 49 8.827 -11.136 -10.301 1089 HA LYS 49 HA LYS 49 11.689 -11.055 -10.230 1090 HB2 LYS 49 HB2 LYS 49 9.793 -10.422 -7.966 1091 HB3 LYS 49 HB3 LYS 49 11.463 -9.900 -8.128 1092 HG2 LYS 49 HG2 LYS 49 9.111 -9.020 -9.793 1093 HG3 LYS 49 HG3 LYS 49 10.031 -8.055 -8.640 1094 HD2 LYS 49 HD2 LYS 49 12.031 -8.300 -10.085 1095 HD3 LYS 49 HD3 LYS 49 11.047 -9.183 -11.254 1096 HE2 LYS 49 HE2 LYS 49 9.556 -7.162 -11.367 1097 HE3 LYS 49 HE3 LYS 49 10.765 -6.303 -10.414 1098 HZ1 LYS 49 HZ1 LYS 49 11.265 -7.594 -13.045 1099 HZ2 LYS 49 HZ2 LYS 49 12.376 -6.684 -12.146 1100 HZ3 LYS 49 HZ3 LYS 49 11.013 -5.935 -12.806 1101 H GLN 50 H GLN 50 9.263 -12.662 -8.194 1102 HA GLN 50 HA GLN 50 9.367 -14.450 -6.800 1103 HB2 GLN 50 HB2 GLN 50 11.378 -15.435 -8.832 1104 HB3 GLN 50 HB3 GLN 50 10.483 -16.429 -7.691 1105 HG2 GLN 50 HG2 GLN 50 8.523 -16.233 -8.836 1106 HG3 GLN 50 HG3 GLN 50 8.971 -14.692 -9.564 1107 HE21 GLN 50 HE21 GLN 50 7.906 -17.093 -10.804 1108 HE22 GLN 50 HE22 GLN 50 9.054 -17.562 -12.006 1109 HA PRO 51 HA PRO 51 13.229 -12.944 -4.693 1110 HB2 PRO 51 HB2 PRO 51 12.016 -12.696 -2.244 1111 HB3 PRO 51 HB3 PRO 51 12.117 -11.396 -3.434 1112 HG2 PRO 51 HG2 PRO 51 9.844 -13.221 -2.809 1113 HG3 PRO 51 HG3 PRO 51 9.818 -11.498 -3.217 1114 HD2 PRO 51 HD2 PRO 51 9.181 -13.437 -4.998 1115 HD3 PRO 51 HD3 PRO 51 9.931 -11.901 -5.480 1116 H MET 52 H MET 52 10.761 -15.147 -3.328 1117 HA MET 52 HA MET 52 12.972 -16.892 -2.465 1118 HB2 MET 52 HB2 MET 52 10.334 -16.283 -1.164 1119 HB3 MET 52 HB3 MET 52 11.261 -17.717 -0.740 1120 HG2 MET 52 HG2 MET 52 12.300 -14.896 -0.570 1121 HG3 MET 52 HG3 MET 52 11.612 -15.794 0.782 1122 HE1 MET 52 HE1 MET 52 14.687 -14.718 -0.927 1123 HE2 MET 52 HE2 MET 52 15.853 -15.466 0.158 1124 HE3 MET 52 HE3 MET 52 14.566 -14.455 0.811 1125 H LEU 53 H LEU 53 10.667 -16.694 -4.763 1126 HA LEU 53 HA LEU 53 9.487 -18.137 -6.061 1127 HB2 LEU 53 HB2 LEU 53 11.934 -19.654 -5.272 1128 HB3 LEU 53 HB3 LEU 53 10.681 -20.481 -6.180 1129 HG LEU 53 HG LEU 53 11.846 -17.895 -7.163 1130 HD11 LEU 53 HD11 LEU 53 13.450 -19.147 -8.469 1131 HD12 LEU 53 HD12 LEU 53 12.877 -20.663 -7.775 1132 HD13 LEU 53 HD13 LEU 53 13.696 -19.481 -6.756 1133 HD21 LEU 53 HD21 LEU 53 11.144 -18.808 -9.335 1134 HD22 LEU 53 HD22 LEU 53 9.792 -18.650 -8.214 1135 HD23 LEU 53 HD23 LEU 53 10.507 -20.234 -8.518 1136 H ASP 54 H ASP 54 8.166 -17.920 -3.748 1137 HA ASP 54 HA ASP 54 7.496 -20.687 -2.996 1138 HB2 ASP 54 HB2 ASP 54 7.403 -18.127 -1.429 1139 HB3 ASP 54 HB3 ASP 54 6.360 -19.474 -0.983 1140 H VAL 55 H VAL 55 5.732 -17.642 -2.701 1141 HA VAL 55 HA VAL 55 3.947 -17.578 -4.661 1142 HB VAL 55 HB VAL 55 3.193 -19.861 -2.949 1143 HG11 VAL 55 HG11 VAL 55 1.044 -17.896 -3.753 1144 HG12 VAL 55 HG12 VAL 55 1.582 -18.187 -2.099 1145 HG13 VAL 55 HG13 VAL 55 0.797 -19.476 -3.012 1146 HG21 VAL 55 HG21 VAL 55 3.579 -20.095 -5.332 1147 HG22 VAL 55 HG22 VAL 55 2.319 -18.912 -5.675 1148 HG23 VAL 55 HG23 VAL 55 1.896 -20.465 -4.955 1149 HA PRO 56 HA PRO 56 2.008 -15.296 -0.909 1150 HB2 PRO 56 HB2 PRO 56 2.925 -15.721 1.589 1151 HB3 PRO 56 HB3 PRO 56 1.675 -16.744 0.871 1152 HG2 PRO 56 HG2 PRO 56 4.610 -17.252 1.149 1153 HG3 PRO 56 HG3 PRO 56 3.250 -18.358 1.419 1154 HD2 PRO 56 HD2 PRO 56 4.741 -18.347 -0.860 1155 HD3 PRO 56 HD3 PRO 56 3.042 -18.842 -0.814 1156 H LYS 57 H LYS 57 5.361 -15.948 -1.112 1157 HA LYS 57 HA LYS 57 6.325 -13.624 0.218 1158 HB2 LYS 57 HB2 LYS 57 7.769 -15.213 -1.896 1159 HB3 LYS 57 HB3 LYS 57 8.478 -14.253 -0.608 1160 HG2 LYS 57 HG2 LYS 57 6.851 -16.751 -0.176 1161 HG3 LYS 57 HG3 LYS 57 8.612 -16.697 -0.225 1162 HD2 LYS 57 HD2 LYS 57 7.754 -14.712 1.597 1163 HD3 LYS 57 HD3 LYS 57 6.863 -16.188 1.967 1164 HE2 LYS 57 HE2 LYS 57 9.853 -16.058 1.629 1165 HE3 LYS 57 HE3 LYS 57 9.037 -15.942 3.184 1166 HZ1 LYS 57 HZ1 LYS 57 9.052 -18.257 1.322 1167 HZ2 LYS 57 HZ2 LYS 57 8.032 -18.146 2.671 1168 HZ3 LYS 57 HZ3 LYS 57 9.705 -18.178 2.885 1169 H LEU 58 H LEU 58 4.845 -14.147 -2.775 1170 HA LEU 58 HA LEU 58 6.094 -11.905 -4.118 1171 HB2 LEU 58 HB2 LEU 58 5.000 -14.186 -5.053 1172 HB3 LEU 58 HB3 LEU 58 3.608 -13.131 -5.175 1173 HG LEU 58 HG LEU 58 4.825 -13.278 -7.294 1174 HD11 LEU 58 HD11 LEU 58 4.827 -10.611 -5.913 1175 HD12 LEU 58 HD12 LEU 58 3.629 -11.270 -7.029 1176 HD13 LEU 58 HD13 LEU 58 5.223 -10.804 -7.619 1177 HD21 LEU 58 HD21 LEU 58 7.094 -13.435 -5.907 1178 HD22 LEU 58 HD22 LEU 58 7.117 -11.706 -6.264 1179 HD23 LEU 58 HD23 LEU 58 7.040 -12.877 -7.577 1180 H ALA 59 H ALA 59 3.006 -12.739 -2.645 1181 HA ALA 59 HA ALA 59 1.611 -10.394 -3.288 1182 HB1 ALA 59 HB1 ALA 59 1.291 -12.337 -1.012 1183 HB2 ALA 59 HB2 ALA 59 0.397 -12.296 -2.535 1184 HB3 ALA 59 HB3 ALA 59 0.167 -11.018 -1.338 1185 H VAL 60 H VAL 60 3.383 -11.264 -0.312 1186 HA VAL 60 HA VAL 60 3.009 -8.779 0.963 1187 HB VAL 60 HB VAL 60 3.744 -10.851 2.135 1188 HG11 VAL 60 HG11 VAL 60 6.021 -11.564 2.109 1189 HG12 VAL 60 HG12 VAL 60 6.480 -10.227 1.054 1190 HG13 VAL 60 HG13 VAL 60 5.447 -11.513 0.442 1191 HG21 VAL 60 HG21 VAL 60 3.920 -8.719 3.259 1192 HG22 VAL 60 HG22 VAL 60 5.491 -8.421 2.513 1193 HG23 VAL 60 HG23 VAL 60 5.304 -9.730 3.681 1194 H LEU 61 H LEU 61 5.258 -9.848 -1.460 1195 HA LEU 61 HA LEU 61 7.224 -7.856 -1.195 1196 HB2 LEU 61 HB2 LEU 61 7.473 -9.925 -2.544 1197 HB3 LEU 61 HB3 LEU 61 6.335 -9.278 -3.708 1198 HG LEU 61 HG LEU 61 7.994 -7.318 -3.945 1199 HD11 LEU 61 HD11 LEU 61 9.810 -9.384 -2.712 1200 HD12 LEU 61 HD12 LEU 61 9.338 -7.856 -1.973 1201 HD13 LEU 61 HD13 LEU 61 10.311 -7.861 -3.443 1202 HD21 LEU 61 HD21 LEU 61 9.300 -8.562 -5.600 1203 HD22 LEU 61 HD22 LEU 61 7.589 -8.977 -5.684 1204 HD23 LEU 61 HD23 LEU 61 8.727 -10.080 -4.910 1205 H THR 62 H THR 62 4.173 -7.970 -2.983 1206 HA THR 62 HA THR 62 4.601 -5.399 -4.177 1207 HB THR 62 HB THR 62 2.200 -5.556 -4.854 1208 HG1 THR 62 HG1 THR 62 2.278 -7.647 -3.047 1209 HG21 THR 62 HG21 THR 62 2.752 -6.840 -6.622 1210 HG22 THR 62 HG22 THR 62 3.294 -8.181 -5.615 1211 HG23 THR 62 HG23 THR 62 4.356 -6.803 -5.892 1212 H ALA 63 H ALA 63 3.028 -6.620 -1.302 1213 HA ALA 63 HA ALA 63 1.536 -4.339 -0.613 1214 HB1 ALA 63 HB1 ALA 63 1.219 -6.541 0.428 1215 HB2 ALA 63 HB2 ALA 63 1.468 -5.276 1.630 1216 HB3 ALA 63 HB3 ALA 63 2.782 -6.381 1.227 1217 H VAL 64 H VAL 64 4.810 -5.353 0.319 1218 HA VAL 64 HA VAL 64 5.344 -3.068 1.907 1219 HB VAL 64 HB VAL 64 6.566 -5.228 2.109 1220 HG11 VAL 64 HG11 VAL 64 7.800 -4.351 -0.489 1221 HG12 VAL 64 HG12 VAL 64 6.947 -5.856 -0.142 1222 HG13 VAL 64 HG13 VAL 64 8.528 -5.551 0.579 1223 HG21 VAL 64 HG21 VAL 64 8.815 -4.225 2.458 1224 HG22 VAL 64 HG22 VAL 64 7.500 -3.305 3.187 1225 HG23 VAL 64 HG23 VAL 64 8.233 -2.752 1.680 1226 H GLN 65 H GLN 65 5.446 -3.633 -1.486 1227 HA GLN 65 HA GLN 65 7.165 -1.367 -2.022 1228 HB2 GLN 65 HB2 GLN 65 6.090 -3.595 -3.557 1229 HB3 GLN 65 HB3 GLN 65 5.975 -2.071 -4.431 1230 HG2 GLN 65 HG2 GLN 65 8.300 -1.736 -4.395 1231 HG3 GLN 65 HG3 GLN 65 8.537 -2.916 -3.108 1232 HE21 GLN 65 HE21 GLN 65 6.931 -4.975 -4.221 1233 HE22 GLN 65 HE22 GLN 65 7.759 -5.585 -5.609 1234 H ILE 66 H ILE 66 3.718 -2.136 -2.209 1235 HA ILE 66 HA ILE 66 2.891 0.261 -3.443 1236 HB ILE 66 HB ILE 66 1.449 -1.654 -1.611 1237 HG12 ILE 66 HG12 ILE 66 0.979 -1.058 -4.534 1238 HG13 ILE 66 HG13 ILE 66 2.107 -2.292 -3.985 1239 HG21 ILE 66 HG21 ILE 66 -0.614 -0.504 -2.027 1240 HG22 ILE 66 HG22 ILE 66 0.192 0.649 -3.091 1241 HG23 ILE 66 HG23 ILE 66 0.539 0.652 -1.364 1242 HD11 ILE 66 HD11 ILE 66 0.065 -3.368 -4.544 1243 HD12 ILE 66 HD12 ILE 66 -0.872 -2.224 -3.584 1244 HD13 ILE 66 HD13 ILE 66 0.199 -3.375 -2.787 1245 H ALA 67 H ALA 67 3.460 -0.646 -0.109 1246 HA ALA 67 HA ALA 67 2.448 1.639 1.151 1247 HB1 ALA 67 HB1 ALA 67 4.005 0.969 3.019 1248 HB2 ALA 67 HB2 ALA 67 4.573 -0.329 1.965 1249 HB3 ALA 67 HB3 ALA 67 2.887 -0.277 2.471 1250 H SER 68 H SER 68 5.612 0.973 -0.295 1251 HA SER 68 HA SER 68 6.728 3.447 0.679 1252 HB2 SER 68 HB2 SER 68 8.463 2.584 -1.253 1253 HB3 SER 68 HB3 SER 68 8.513 2.084 0.437 1254 HG SER 68 HG SER 68 7.648 0.187 -0.070 1255 H GLU 69 H GLU 69 5.385 2.217 -2.345 1256 HA GLU 69 HA GLU 69 6.093 4.310 -4.052 1257 HB2 GLU 69 HB2 GLU 69 3.818 2.355 -4.022 1258 HB3 GLU 69 HB3 GLU 69 3.844 3.642 -5.220 1259 HG2 GLU 69 HG2 GLU 69 6.166 2.814 -5.839 1260 HG3 GLU 69 HG3 GLU 69 5.802 1.392 -4.862 1261 H TYR 70 H TYR 70 3.546 4.086 -1.665 1262 HA TYR 70 HA TYR 70 2.502 6.686 -2.513 1263 HB2 TYR 70 HB2 TYR 70 1.384 4.429 -0.907 1264 HB3 TYR 70 HB3 TYR 70 0.729 6.052 -0.693 1265 HD1 TYR 70 HD2 TYR 70 1.237 3.324 -3.126 1266 HD2 TYR 70 HD1 TYR 70 -0.646 7.057 -2.354 1267 HE1 TYR 70 HE2 TYR 70 -0.129 3.044 -5.148 1268 HE2 TYR 70 HE1 TYR 70 -2.016 6.790 -4.375 1269 HH TYR 70 HH TYR 70 -2.449 3.962 -5.954 1270 H LEU 71 H LEU 71 4.598 5.377 -0.205 1271 HA LEU 71 HA LEU 71 4.044 7.103 1.981 1272 HB2 LEU 71 HB2 LEU 71 5.388 4.977 2.077 1273 HB3 LEU 71 HB3 LEU 71 6.680 5.828 1.258 1274 HG LEU 71 HG LEU 71 6.894 7.379 3.148 1275 HD11 LEU 71 HD11 LEU 71 4.572 5.821 4.234 1276 HD12 LEU 71 HD12 LEU 71 4.798 7.569 4.126 1277 HD13 LEU 71 HD13 LEU 71 5.710 6.637 5.307 1278 HD21 LEU 71 HD21 LEU 71 7.826 5.832 4.778 1279 HD22 LEU 71 HD22 LEU 71 8.254 5.348 3.138 1280 HD23 LEU 71 HD23 LEU 71 6.982 4.491 4.011 1281 H LYS 72 H LYS 72 6.349 7.218 -0.690 1282 HA LYS 72 HA LYS 72 7.548 9.663 -0.019 1283 HB2 LYS 72 HB2 LYS 72 8.297 9.742 -2.381 1284 HB3 LYS 72 HB3 LYS 72 8.609 8.196 -1.617 1285 HG2 LYS 72 HG2 LYS 72 7.836 7.504 -3.653 1286 HG3 LYS 72 HG3 LYS 72 6.326 7.529 -2.749 1287 HD2 LYS 72 HD2 LYS 72 5.851 8.583 -4.797 1288 HD3 LYS 72 HD3 LYS 72 6.000 9.888 -3.619 1289 HE2 LYS 72 HE2 LYS 72 8.354 10.202 -4.369 1290 HE3 LYS 72 HE3 LYS 72 8.064 9.008 -5.635 1291 HZ1 LYS 72 HZ1 LYS 72 7.776 11.200 -6.519 1292 HZ2 LYS 72 HZ2 LYS 72 6.668 11.610 -5.301 1293 HZ3 LYS 72 HZ3 LYS 72 6.264 10.442 -6.459 1294 H LEU 73 H LEU 73 4.522 8.951 -1.542 1295 HA LEU 73 HA LEU 73 4.110 11.430 -2.839 1296 HB2 LEU 73 HB2 LEU 73 2.891 9.208 -3.199 1297 HB3 LEU 73 HB3 LEU 73 1.954 9.606 -1.777 1298 HG LEU 73 HG LEU 73 0.873 10.061 -4.020 1299 HD11 LEU 73 HD11 LEU 73 -0.136 12.176 -3.311 1300 HD12 LEU 73 HD12 LEU 73 1.129 12.363 -2.097 1301 HD13 LEU 73 HD13 LEU 73 -0.012 11.022 -1.982 1302 HD21 LEU 73 HD21 LEU 73 3.005 11.069 -4.982 1303 HD22 LEU 73 HD22 LEU 73 2.569 12.533 -4.095 1304 HD23 LEU 73 HD23 LEU 73 1.486 11.895 -5.328 1305 H LYS 74 H LYS 74 3.129 10.184 0.339 1306 HA LYS 74 HA LYS 74 1.862 12.660 1.052 1307 HB2 LYS 74 HB2 LYS 74 1.441 11.680 3.208 1308 HB3 LYS 74 HB3 LYS 74 1.105 10.485 1.967 1309 HG2 LYS 74 HG2 LYS 74 3.364 9.507 2.418 1310 HG3 LYS 74 HG3 LYS 74 3.493 10.610 3.785 1311 HD2 LYS 74 HD2 LYS 74 1.139 8.776 3.488 1312 HD3 LYS 74 HD3 LYS 74 2.642 8.219 4.218 1313 HE2 LYS 74 HE2 LYS 74 1.052 10.605 5.146 1314 HE3 LYS 74 HE3 LYS 74 0.975 9.002 5.871 1315 HZ1 LYS 74 HZ1 LYS 74 3.500 10.534 5.650 1316 HZ2 LYS 74 HZ2 LYS 74 3.191 9.168 6.599 1317 HZ3 LYS 74 HZ3 LYS 74 2.476 10.649 6.990 1318 H GLU 75 H GLU 75 5.048 11.638 0.916 1319 HA GLU 75 HA GLU 75 6.041 13.209 3.116 1320 HB2 GLU 75 HB2 GLU 75 7.128 11.112 2.074 1321 HB3 GLU 75 HB3 GLU 75 7.689 12.197 0.808 1322 HG2 GLU 75 HG2 GLU 75 9.357 11.782 2.577 1323 HG3 GLU 75 HG3 GLU 75 8.946 13.484 2.380 1324 H GLU 76 H GLU 76 6.061 13.459 -0.440 1325 HA GLU 76 HA GLU 76 7.230 16.048 -0.466 1326 HB2 GLU 76 HB2 GLU 76 6.646 16.143 -2.824 1327 HB3 GLU 76 HB3 GLU 76 7.328 14.575 -2.432 1328 HG2 GLU 76 HG2 GLU 76 4.865 13.812 -2.236 1329 HG3 GLU 76 HG3 GLU 76 4.508 15.291 -3.119 1330 H TYR 77 H TYR 77 4.092 14.870 0.087 1331 HA TYR 77 HA TYR 77 2.400 16.934 -0.618 1332 HB2 TYR 77 HB2 TYR 77 1.537 14.849 0.169 1333 HB3 TYR 77 HB3 TYR 77 2.373 15.004 1.703 1334 HD1 TYR 77 HD1 TYR 77 0.473 17.808 0.232 1335 HD2 TYR 77 HD2 TYR 77 0.410 14.586 3.011 1336 HE1 TYR 77 HE1 TYR 77 -1.589 18.705 1.221 1337 HE2 TYR 77 HE2 TYR 77 -1.649 15.485 4.010 1338 HH TYR 77 HH TYR 77 -3.551 17.789 2.542 1339 H GLN 78 H GLN 78 4.161 16.525 2.461 1340 HA GLN 78 HA GLN 78 3.267 19.083 3.421 1341 HB2 GLN 78 HB2 GLN 78 5.253 17.081 4.478 1342 HB3 GLN 78 HB3 GLN 78 4.941 18.619 5.272 1343 HG2 GLN 78 HG2 GLN 78 3.005 16.368 4.818 1344 HG3 GLN 78 HG3 GLN 78 3.641 16.946 6.359 1345 HE21 GLN 78 HE21 GLN 78 0.892 16.665 5.483 1346 HE22 GLN 78 HE22 GLN 78 0.173 18.236 5.610 1347 H ARG 79 H ARG 79 6.123 17.808 1.874 1348 HA ARG 79 HA ARG 79 7.972 19.801 2.374 1349 HB2 ARG 79 HB2 ARG 79 7.555 17.929 0.087 1350 HB3 ARG 79 HB3 ARG 79 8.793 19.170 -0.028 1351 HG2 ARG 79 HG2 ARG 79 10.001 18.290 1.777 1352 HG3 ARG 79 HG3 ARG 79 8.648 17.287 2.297 1353 HD2 ARG 79 HD2 ARG 79 10.527 16.085 1.124 1354 HD3 ARG 79 HD3 ARG 79 8.915 15.812 0.477 1355 HE ARG 79 HE ARG 79 9.574 17.585 -1.221 1356 HH11 ARG 79 HH11 ARG 79 11.905 15.461 0.318 1357 HH12 ARG 79 HH12 ARG 79 13.003 15.497 -1.025 1358 HH21 ARG 79 HH21 ARG 79 11.019 17.608 -2.994 1359 HH22 ARG 79 HH22 ARG 79 12.500 16.705 -2.904 1360 H LEU 80 H LEU 80 5.694 19.655 -0.373 1361 HA LEU 80 HA LEU 80 6.520 22.159 -1.431 1362 HB2 LEU 80 HB2 LEU 80 4.754 21.943 -2.991 1363 HB3 LEU 80 HB3 LEU 80 5.412 20.341 -2.730 1364 HG LEU 80 HG LEU 80 3.348 20.472 -0.893 1365 HD11 LEU 80 HD11 LEU 80 1.395 21.238 -2.099 1366 HD12 LEU 80 HD12 LEU 80 2.395 21.726 -3.465 1367 HD13 LEU 80 HD13 LEU 80 2.548 22.561 -1.919 1368 HD21 LEU 80 HD21 LEU 80 3.437 19.336 -3.680 1369 HD22 LEU 80 HD22 LEU 80 2.175 18.981 -2.504 1370 HD23 LEU 80 HD23 LEU 80 3.841 18.521 -2.166 1371 H ARG 81 H ARG 81 4.370 21.316 1.110 1372 HA ARG 81 HA ARG 81 2.855 23.771 0.944 1373 HB2 ARG 81 HB2 ARG 81 2.884 21.559 3.000 1374 HB3 ARG 81 HB3 ARG 81 1.832 22.965 3.086 1375 HG2 ARG 81 HG2 ARG 81 0.942 22.294 0.829 1376 HG3 ARG 81 HG3 ARG 81 1.828 20.781 1.026 1377 HD2 ARG 81 HD2 ARG 81 -0.497 20.544 1.716 1378 HD3 ARG 81 HD3 ARG 81 0.601 20.310 3.072 1379 HE ARG 81 HE ARG 81 -1.013 22.733 2.593 1380 HH11 ARG 81 HH11 ARG 81 0.686 20.580 4.795 1381 HH12 ARG 81 HH12 ARG 81 0.110 21.394 6.211 1382 HH21 ARG 81 HH21 ARG 81 -1.734 23.800 4.456 1383 HH22 ARG 81 HH22 ARG 81 -1.247 23.233 6.022 1384 H GLU 82 H GLU 82 5.318 22.364 3.066 1385 HA GLU 82 HA GLU 82 5.420 24.565 4.850 1386 HB2 GLU 82 HB2 GLU 82 7.500 23.543 5.683 1387 HB3 GLU 82 HB3 GLU 82 6.178 22.391 5.569 1388 HG2 GLU 82 HG2 GLU 82 7.144 21.239 3.853 1389 HG3 GLU 82 HG3 GLU 82 8.061 22.634 3.283 1390 H GLN 83 H GLN 83 6.930 23.955 1.781 1391 HA GLN 83 HA GLN 83 8.988 25.940 2.152 1392 HB2 GLN 83 HB2 GLN 83 9.666 25.463 -0.074 1393 HB3 GLN 83 HB3 GLN 83 9.198 23.928 0.643 1394 HG2 GLN 83 HG2 GLN 83 7.032 24.074 -0.494 1395 HG3 GLN 83 HG3 GLN 83 7.541 25.591 -1.236 1396 HE21 GLN 83 HE21 GLN 83 9.192 25.545 -2.796 1397 HE22 GLN 83 HE22 GLN 83 9.597 24.093 -3.640 1398 H LEU 84 H LEU 84 5.700 25.992 1.322 1399 HA LEU 84 HA LEU 84 5.867 28.466 -0.188 1400 HB2 LEU 84 HB2 LEU 84 4.217 26.520 -0.599 1401 HB3 LEU 84 HB3 LEU 84 3.353 27.127 0.793 1402 HG LEU 84 HG LEU 84 2.421 27.829 -1.432 1403 HD11 LEU 84 HD11 LEU 84 2.109 30.216 -0.794 1404 HD12 LEU 84 HD12 LEU 84 3.290 29.975 0.493 1405 HD13 LEU 84 HD13 LEU 84 1.775 29.071 0.505 1406 HD21 LEU 84 HD21 LEU 84 4.682 29.791 -1.599 1407 HD22 LEU 84 HD22 LEU 84 3.491 29.361 -2.822 1408 HD23 LEU 84 HD23 LEU 84 4.768 28.223 -2.401 1409 H LYS 85 H LYS 85 4.252 27.344 2.772 1410 HA LYS 85 HA LYS 85 3.601 29.950 3.680 1411 HB2 LYS 85 HB2 LYS 85 2.952 28.874 5.755 1412 HB3 LYS 85 HB3 LYS 85 2.399 27.905 4.395 1413 HG2 LYS 85 HG2 LYS 85 4.094 26.295 4.723 1414 HG3 LYS 85 HG3 LYS 85 4.970 27.335 5.843 1415 HD2 LYS 85 HD2 LYS 85 2.736 27.166 7.229 1416 HD3 LYS 85 HD3 LYS 85 2.519 25.692 6.282 1417 HE2 LYS 85 HE2 LYS 85 3.620 25.060 8.280 1418 HE3 LYS 85 HE3 LYS 85 4.829 25.015 7.001 1419 HZ1 LYS 85 HZ1 LYS 85 4.465 27.253 8.922 1420 HZ2 LYS 85 HZ2 LYS 85 5.666 27.151 7.730 1421 HZ3 LYS 85 HZ3 LYS 85 5.662 26.065 9.027 1422 H LYS 86 H LYS 86 6.446 28.012 3.892 1423 HA LYS 86 HA LYS 86 8.479 28.292 4.844 1424 HB2 LYS 86 HB2 LYS 86 7.581 31.178 4.954 1425 HB3 LYS 86 HB3 LYS 86 9.221 30.634 5.282 1426 HG2 LYS 86 HG2 LYS 86 9.467 29.855 3.020 1427 HG3 LYS 86 HG3 LYS 86 7.778 30.225 2.671 1428 HD2 LYS 86 HD2 LYS 86 9.704 32.332 3.599 1429 HD3 LYS 86 HD3 LYS 86 9.536 31.909 1.894 1430 HE2 LYS 86 HE2 LYS 86 7.309 32.862 3.702 1431 HE3 LYS 86 HE3 LYS 86 8.151 33.847 2.507 1432 HZ1 LYS 86 HZ1 LYS 86 7.373 32.168 0.822 1433 HZ2 LYS 86 HZ2 LYS 86 6.170 33.139 1.503 1434 HZ3 LYS 86 HZ3 LYS 86 6.354 31.541 2.018 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 35.780 1.303 -20.664 2 H2 GLY 1 H2 GLY 1 34.654 0.310 -21.436 3 H3 GLY 1 H3 GLY 1 36.207 -0.266 -21.115 4 HA2 GLY 1 HA3 GLY 1 34.605 -1.180 -19.555 5 HA3 GLY 1 HA2 GLY 1 35.816 -0.189 -18.756 6 H SER 2 H SER 2 32.530 -0.165 -20.047 7 HA SER 2 HA SER 2 31.921 2.209 -18.469 8 HB2 SER 2 HB2 SER 2 30.181 0.682 -20.416 9 HB3 SER 2 HB3 SER 2 29.800 2.240 -19.688 10 HG SER 2 HG SER 2 31.064 1.844 -21.925 11 H HIS 3 H HIS 3 31.900 1.446 -16.377 12 HA HIS 3 HA HIS 3 29.680 -0.379 -15.732 13 HB2 HIS 3 HB2 HIS 3 32.193 -1.191 -15.469 14 HB3 HIS 3 HB3 HIS 3 32.084 -0.283 -13.966 15 HD1 HIS 3 HD1 HIS 3 31.170 -3.488 -15.511 16 HD2 HIS 3 HD2 HIS 3 30.054 -1.292 -12.157 17 HE1 HIS 3 HE1 HIS 3 29.900 -5.085 -14.043 18 HE2 HIS 3 HE2 HIS 3 29.231 -3.740 -12.021 19 H MET 4 H MET 4 30.928 2.675 -15.451 20 HA MET 4 HA MET 4 30.116 3.200 -12.732 21 HB2 MET 4 HB2 MET 4 32.025 4.381 -13.799 22 HB3 MET 4 HB3 MET 4 30.897 5.139 -14.915 23 HG2 MET 4 HG2 MET 4 29.764 6.210 -13.030 24 HG3 MET 4 HG3 MET 4 30.925 5.473 -11.929 25 HE1 MET 4 HE1 MET 4 31.469 7.972 -10.941 26 HE2 MET 4 HE2 MET 4 30.234 8.548 -12.059 27 HE3 MET 4 HE3 MET 4 31.811 9.335 -12.008 28 H THR 5 H THR 5 28.035 3.276 -12.256 29 HA THR 5 HA THR 5 26.044 3.988 -14.214 30 HB THR 5 HB THR 5 24.668 3.785 -11.884 31 HG1 THR 5 HG1 THR 5 26.142 3.162 -10.450 32 HG21 THR 5 HG21 THR 5 25.625 1.557 -13.681 33 HG22 THR 5 HG22 THR 5 24.152 2.509 -13.862 34 HG23 THR 5 HG23 THR 5 24.321 1.392 -12.507 35 H GLU 6 H GLU 6 24.338 5.611 -13.673 36 HA GLU 6 HA GLU 6 25.599 8.009 -12.542 37 HB2 GLU 6 HB2 GLU 6 24.569 7.787 -14.965 38 HB3 GLU 6 HB3 GLU 6 23.064 8.110 -14.117 39 HG2 GLU 6 HG2 GLU 6 23.993 10.156 -14.995 40 HG3 GLU 6 HG3 GLU 6 24.016 10.184 -13.230 41 H GLN 7 H GLN 7 24.773 6.341 -10.627 42 HA GLN 7 HA GLN 7 23.507 6.133 -8.762 43 HB2 GLN 7 HB2 GLN 7 22.911 8.991 -9.500 44 HB3 GLN 7 HB3 GLN 7 22.252 8.244 -8.051 45 HG2 GLN 7 HG2 GLN 7 25.172 8.531 -8.713 46 HG3 GLN 7 HG3 GLN 7 24.269 9.522 -7.568 47 HE21 GLN 7 HE21 GLN 7 23.643 8.627 -5.596 48 HE22 GLN 7 HE22 GLN 7 24.338 7.166 -4.991 49 HA PRO 8 HA PRO 8 19.591 5.244 -10.991 50 HB2 PRO 8 HB2 PRO 8 19.722 2.579 -11.018 51 HB3 PRO 8 HB3 PRO 8 20.662 3.543 -12.165 52 HG2 PRO 8 HG2 PRO 8 21.552 2.143 -9.688 53 HG3 PRO 8 HG3 PRO 8 22.406 2.356 -11.225 54 HD2 PRO 8 HD2 PRO 8 22.769 3.889 -8.904 55 HD3 PRO 8 HD3 PRO 8 23.337 4.307 -10.531 56 H LYS 9 H LYS 9 17.857 3.490 -10.227 57 HA LYS 9 HA LYS 9 17.252 4.140 -7.530 58 HB2 LYS 9 HB2 LYS 9 15.254 2.766 -7.807 59 HB3 LYS 9 HB3 LYS 9 15.473 3.821 -9.191 60 HG2 LYS 9 HG2 LYS 9 16.372 1.927 -10.476 61 HG3 LYS 9 HG3 LYS 9 16.124 0.880 -9.083 62 HD2 LYS 9 HD2 LYS 9 14.286 0.556 -10.567 63 HD3 LYS 9 HD3 LYS 9 13.694 1.471 -9.177 64 HE2 LYS 9 HE2 LYS 9 13.465 3.419 -10.391 65 HE3 LYS 9 HE3 LYS 9 14.663 2.935 -11.591 66 HZ1 LYS 9 HZ1 LYS 9 13.072 1.282 -12.416 67 HZ2 LYS 9 HZ2 LYS 9 12.471 2.857 -12.541 68 HZ3 LYS 9 HZ3 LYS 9 11.916 1.838 -11.312 69 H THR 10 H THR 10 18.193 3.248 -5.818 70 HA THR 10 HA THR 10 19.528 0.707 -6.026 71 HB THR 10 HB THR 10 20.488 2.655 -4.758 72 HG1 THR 10 HG1 THR 10 21.412 1.300 -3.269 73 HG21 THR 10 HG21 THR 10 19.704 2.988 -2.434 74 HG22 THR 10 HG22 THR 10 18.337 1.924 -2.765 75 HG23 THR 10 HG23 THR 10 18.491 3.454 -3.628 76 H ARG 11 H ARG 11 19.216 -0.999 -4.431 77 HA ARG 11 HA ARG 11 16.404 -1.234 -3.606 78 HB2 ARG 11 HB2 ARG 11 16.642 -3.698 -4.008 79 HB3 ARG 11 HB3 ARG 11 16.721 -2.715 -5.462 80 HG2 ARG 11 HG2 ARG 11 19.145 -2.914 -5.486 81 HG3 ARG 11 HG3 ARG 11 19.090 -3.869 -4.005 82 HD2 ARG 11 HD2 ARG 11 17.609 -5.490 -5.259 83 HD3 ARG 11 HD3 ARG 11 18.032 -4.601 -6.725 84 HE ARG 11 HE ARG 11 20.438 -5.140 -5.968 85 HH11 ARG 11 HH11 ARG 11 17.664 -7.245 -5.570 86 HH12 ARG 11 HH12 ARG 11 18.601 -8.700 -5.582 87 HH21 ARG 11 HH21 ARG 11 21.680 -7.062 -5.988 88 HH22 ARG 11 HH22 ARG 11 20.889 -8.597 -5.822 89 H VAL 12 H VAL 12 16.044 -1.740 -1.540 90 HA VAL 12 HA VAL 12 18.378 -2.422 0.131 91 HB VAL 12 HB VAL 12 17.504 -0.209 0.663 92 HG11 VAL 12 HG11 VAL 12 15.141 -0.217 1.779 93 HG12 VAL 12 HG12 VAL 12 14.894 -1.646 0.777 94 HG13 VAL 12 HG13 VAL 12 15.295 -0.104 0.027 95 HG21 VAL 12 HG21 VAL 12 16.829 -2.255 2.775 96 HG22 VAL 12 HG22 VAL 12 17.042 -0.529 3.063 97 HG23 VAL 12 HG23 VAL 12 18.400 -1.503 2.505 98 H SER 13 H SER 13 18.230 -4.137 1.504 99 HA SER 13 HA SER 13 15.974 -5.928 1.113 100 HB2 SER 13 HB2 SER 13 18.242 -6.645 2.902 101 HB3 SER 13 HB3 SER 13 17.418 -7.616 1.679 102 HG SER 13 HG SER 13 19.692 -6.206 1.462 103 H VAL 14 H VAL 14 14.262 -5.512 2.388 104 HA VAL 14 HA VAL 14 14.776 -4.870 5.216 105 HB VAL 14 HB VAL 14 12.481 -3.974 5.312 106 HG11 VAL 14 HG11 VAL 14 14.166 -2.701 3.166 107 HG12 VAL 14 HG12 VAL 14 14.380 -2.489 4.903 108 HG13 VAL 14 HG13 VAL 14 12.912 -1.906 4.116 109 HG21 VAL 14 HG21 VAL 14 12.394 -4.141 2.308 110 HG22 VAL 14 HG22 VAL 14 11.103 -3.690 3.421 111 HG23 VAL 14 HG23 VAL 14 11.656 -5.360 3.349 112 H ARG 15 H ARG 15 13.586 -5.947 6.832 113 HA ARG 15 HA ARG 15 12.747 -8.621 6.007 114 HB2 ARG 15 HB2 ARG 15 14.509 -8.270 7.775 115 HB3 ARG 15 HB3 ARG 15 13.241 -7.626 8.808 116 HG2 ARG 15 HG2 ARG 15 12.045 -9.777 8.624 117 HG3 ARG 15 HG3 ARG 15 13.392 -10.416 7.680 118 HD2 ARG 15 HD2 ARG 15 13.426 -9.483 10.545 119 HD3 ARG 15 HD3 ARG 15 13.675 -11.122 9.946 120 HE ARG 15 HE ARG 15 15.640 -9.660 8.747 121 HH11 ARG 15 HH11 ARG 15 14.639 -10.155 12.068 122 HH12 ARG 15 HH12 ARG 15 16.238 -9.966 12.708 123 HH21 ARG 15 HH21 ARG 15 17.731 -9.353 9.587 124 HH22 ARG 15 HH22 ARG 15 18.003 -9.509 11.294 125 H ILE 16 H ILE 16 10.693 -9.203 5.951 126 HA ILE 16 HA ILE 16 8.750 -7.845 7.691 127 HB ILE 16 HB ILE 16 8.288 -8.536 4.777 128 HG12 ILE 16 HG12 ILE 16 8.051 -5.791 5.947 129 HG13 ILE 16 HG13 ILE 16 9.641 -6.411 5.509 130 HG21 ILE 16 HG21 ILE 16 6.075 -7.526 5.092 131 HG22 ILE 16 HG22 ILE 16 6.428 -7.290 6.804 132 HG23 ILE 16 HG23 ILE 16 6.301 -8.921 6.148 133 HD11 ILE 16 HD11 ILE 16 7.324 -6.328 3.604 134 HD12 ILE 16 HD12 ILE 16 9.026 -6.614 3.239 135 HD13 ILE 16 HD13 ILE 16 8.495 -5.021 3.775 136 H TYR 17 H TYR 17 7.835 -9.306 8.959 137 HA TYR 17 HA TYR 17 7.015 -11.247 9.782 138 HB2 TYR 17 HB2 TYR 17 5.952 -11.006 7.208 139 HB3 TYR 17 HB3 TYR 17 6.503 -12.675 7.315 140 HD1 TYR 17 HD1 TYR 17 4.613 -10.175 9.354 141 HD2 TYR 17 HD2 TYR 17 5.028 -14.232 8.152 142 HE1 TYR 17 HE1 TYR 17 2.584 -10.751 10.617 143 HE2 TYR 17 HE2 TYR 17 2.999 -14.821 9.409 144 HH TYR 17 HH TYR 17 1.694 -13.937 11.317 145 H GLY 18 H GLY 18 9.861 -11.030 9.155 146 HA2 GLY 18 HA2 GLY 18 11.484 -12.632 9.855 147 HA3 GLY 18 HA3 GLY 18 10.454 -13.907 9.226 148 H GLN 19 H GLN 19 9.975 -12.837 6.647 149 HA GLN 19 HA GLN 19 12.536 -13.507 5.448 150 HB2 GLN 19 HB2 GLN 19 9.778 -13.133 4.283 151 HB3 GLN 19 HB3 GLN 19 11.203 -13.422 3.295 152 HG2 GLN 19 HG2 GLN 19 9.898 -15.259 5.269 153 HG3 GLN 19 HG3 GLN 19 10.195 -15.511 3.548 154 HE21 GLN 19 HE21 GLN 19 12.265 -16.074 2.861 155 HE22 GLN 19 HE22 GLN 19 13.469 -16.663 3.954 156 H ASP 20 H ASP 20 13.728 -12.195 4.092 157 HA ASP 20 HA ASP 20 12.997 -9.356 4.213 158 HB2 ASP 20 HB2 ASP 20 15.313 -8.788 4.081 159 HB3 ASP 20 HB3 ASP 20 15.170 -10.053 5.296 160 H TYR 21 H TYR 21 12.965 -8.120 2.406 161 HA TYR 21 HA TYR 21 13.424 -9.483 -0.165 162 HB2 TYR 21 HB2 TYR 21 11.166 -7.536 0.340 163 HB3 TYR 21 HB3 TYR 21 11.436 -8.515 -1.100 164 HD1 TYR 21 HD2 TYR 21 11.323 -11.069 -0.814 165 HD2 TYR 21 HD1 TYR 21 9.798 -8.317 2.057 166 HE1 TYR 21 HE2 TYR 21 9.928 -12.854 0.141 167 HE2 TYR 21 HE1 TYR 21 8.399 -10.100 3.024 168 HH TYR 21 HH TYR 21 7.494 -12.198 2.535 169 H THR 22 H THR 22 14.333 -8.258 -1.769 170 HA THR 22 HA THR 22 15.547 -5.763 -0.923 171 HB THR 22 HB THR 22 16.083 -6.570 -3.670 172 HG1 THR 22 HG1 THR 22 16.849 -8.403 -1.624 173 HG21 THR 22 HG21 THR 22 17.510 -5.036 -2.436 174 HG22 THR 22 HG22 THR 22 18.417 -6.491 -2.848 175 HG23 THR 22 HG23 THR 22 17.811 -6.264 -1.206 176 H ILE 23 H ILE 23 13.943 -4.267 -0.952 177 HA ILE 23 HA ILE 23 12.341 -3.900 -3.380 178 HB ILE 23 HB ILE 23 10.931 -2.437 -2.078 179 HG12 ILE 23 HG12 ILE 23 12.839 -2.889 0.234 180 HG13 ILE 23 HG13 ILE 23 12.739 -1.407 -0.708 181 HG21 ILE 23 HG21 ILE 23 10.013 -4.022 -0.526 182 HG22 ILE 23 HG22 ILE 23 11.545 -4.892 -0.440 183 HG23 ILE 23 HG23 ILE 23 10.612 -4.893 -1.937 184 HD11 ILE 23 HD11 ILE 23 10.778 -2.552 1.228 185 HD12 ILE 23 HD12 ILE 23 10.282 -1.360 0.022 186 HD13 ILE 23 HD13 ILE 23 11.522 -0.953 1.211 187 H VAL 24 H VAL 24 11.997 -1.641 -4.126 188 HA VAL 24 HA VAL 24 14.521 -0.340 -4.497 189 HB VAL 24 HB VAL 24 11.740 0.519 -5.336 190 HG11 VAL 24 HG11 VAL 24 12.850 2.075 -6.848 191 HG12 VAL 24 HG12 VAL 24 14.420 1.589 -6.212 192 HG13 VAL 24 HG13 VAL 24 13.268 2.425 -5.171 193 HG21 VAL 24 HG21 VAL 24 12.381 -0.292 -7.543 194 HG22 VAL 24 HG22 VAL 24 12.489 -1.588 -6.350 195 HG23 VAL 24 HG23 VAL 24 13.952 -0.787 -6.918 196 H GLY 25 H GLY 25 15.403 1.000 -3.050 197 HA2 GLY 25 HA2 GLY 25 13.580 2.582 -1.338 198 HA3 GLY 25 HA3 GLY 25 15.145 1.985 -0.805 199 H ALA 26 H ALA 26 14.204 3.585 -3.812 200 HA ALA 26 HA ALA 26 16.467 5.376 -3.544 201 HB1 ALA 26 HB1 ALA 26 15.927 4.270 -5.694 202 HB2 ALA 26 HB2 ALA 26 16.001 6.030 -5.811 203 HB3 ALA 26 HB3 ALA 26 14.439 5.214 -5.765 204 H GLU 27 H GLU 27 15.112 6.139 -1.521 205 HA GLU 27 HA GLU 27 14.127 8.740 -2.243 206 HB2 GLU 27 HB2 GLU 27 12.001 8.398 -0.836 207 HB3 GLU 27 HB3 GLU 27 12.018 7.756 -2.470 208 HG2 GLU 27 HG2 GLU 27 11.726 5.663 -1.764 209 HG3 GLU 27 HG3 GLU 27 12.944 5.829 -0.498 210 H SER 28 H SER 28 13.062 7.352 0.766 211 HA SER 28 HA SER 28 15.221 8.828 2.113 212 HB2 SER 28 HB2 SER 28 13.150 9.899 2.596 213 HB3 SER 28 HB3 SER 28 12.339 8.363 2.878 214 HG SER 28 HG SER 28 14.175 9.744 4.517 215 HA PRO 29 HA PRO 29 16.558 4.797 3.479 216 HB2 PRO 29 HB2 PRO 29 18.335 5.715 5.353 217 HB3 PRO 29 HB3 PRO 29 18.686 5.606 3.625 218 HG2 PRO 29 HG2 PRO 29 17.836 7.974 5.242 219 HG3 PRO 29 HG3 PRO 29 19.062 7.869 3.966 220 HD2 PRO 29 HD2 PRO 29 16.622 8.880 3.492 221 HD3 PRO 29 HD3 PRO 29 17.483 7.922 2.269 222 H ALA 30 H ALA 30 15.030 7.216 5.364 223 HA ALA 30 HA ALA 30 14.850 5.532 7.737 224 HB1 ALA 30 HB1 ALA 30 13.778 7.442 8.790 225 HB2 ALA 30 HB2 ALA 30 13.741 8.295 7.246 226 HB3 ALA 30 HB3 ALA 30 15.285 7.934 8.017 227 H HIS 31 H HIS 31 12.816 6.889 5.189 228 HA HIS 31 HA HIS 31 10.340 6.004 6.229 229 HB2 HIS 31 HB2 HIS 31 11.251 6.836 3.492 230 HB3 HIS 31 HB3 HIS 31 9.637 6.180 3.736 231 HD1 HIS 31 HD1 HIS 31 11.797 9.041 5.002 232 HD2 HIS 31 HD2 HIS 31 7.796 8.012 4.522 233 HE1 HIS 31 HE1 HIS 31 10.490 11.087 5.643 234 HE2 HIS 31 HE2 HIS 31 8.091 10.512 5.144 235 H ILE 32 H ILE 32 12.607 4.577 3.922 236 HA ILE 32 HA ILE 32 11.134 2.351 3.171 237 HB ILE 32 HB ILE 32 13.293 1.252 2.655 238 HG12 ILE 32 HG12 ILE 32 14.619 3.769 3.670 239 HG13 ILE 32 HG13 ILE 32 14.466 2.327 4.666 240 HG21 ILE 32 HG21 ILE 32 13.921 2.783 0.922 241 HG22 ILE 32 HG22 ILE 32 13.223 4.144 1.800 242 HG23 ILE 32 HG23 ILE 32 12.176 2.886 1.145 243 HD11 ILE 32 HD11 ILE 32 15.768 1.068 3.052 244 HD12 ILE 32 HD12 ILE 32 16.652 2.481 3.616 245 HD13 ILE 32 HD13 ILE 32 15.897 2.493 2.023 246 H ARG 33 H ARG 33 12.760 2.969 6.179 247 HA ARG 33 HA ARG 33 12.844 0.215 7.004 248 HB2 ARG 33 HB2 ARG 33 13.596 2.803 8.178 249 HB3 ARG 33 HB3 ARG 33 12.945 1.660 9.342 250 HG2 ARG 33 HG2 ARG 33 15.309 1.415 9.311 251 HG3 ARG 33 HG3 ARG 33 14.614 -0.008 8.531 252 HD2 ARG 33 HD2 ARG 33 15.055 1.012 6.334 253 HD3 ARG 33 HD3 ARG 33 15.793 2.396 7.140 254 HE ARG 33 HE ARG 33 16.897 -0.277 7.633 255 HH11 ARG 33 HH11 ARG 33 17.233 2.908 6.200 256 HH12 ARG 33 HH12 ARG 33 18.932 2.719 5.885 257 HH21 ARG 33 HH21 ARG 33 19.130 -0.517 7.217 258 HH22 ARG 33 HH22 ARG 33 20.008 0.775 6.463 259 H LEU 34 H LEU 34 10.702 2.958 7.463 260 HA LEU 34 HA LEU 34 8.953 1.635 9.294 261 HB2 LEU 34 HB2 LEU 34 8.892 4.194 7.756 262 HB3 LEU 34 HB3 LEU 34 7.386 3.580 8.405 263 HG LEU 34 HG LEU 34 8.562 3.497 10.668 264 HD11 LEU 34 HD11 LEU 34 10.460 4.976 10.968 265 HD12 LEU 34 HD12 LEU 34 10.489 5.321 9.239 266 HD13 LEU 34 HD13 LEU 34 10.856 3.697 9.821 267 HD21 LEU 34 HD21 LEU 34 8.096 6.160 9.339 268 HD22 LEU 34 HD22 LEU 34 8.154 5.871 11.078 269 HD23 LEU 34 HD23 LEU 34 6.870 5.150 10.106 270 H VAL 35 H VAL 35 9.220 1.875 5.841 271 HA VAL 35 HA VAL 35 6.685 1.187 4.965 272 HB VAL 35 HB VAL 35 9.371 0.366 3.836 273 HG11 VAL 35 HG11 VAL 35 6.786 0.415 2.315 274 HG12 VAL 35 HG12 VAL 35 7.380 -1.040 3.113 275 HG13 VAL 35 HG13 VAL 35 8.331 -0.284 1.835 276 HG21 VAL 35 HG21 VAL 35 8.800 2.826 4.018 277 HG22 VAL 35 HG22 VAL 35 7.529 2.518 2.834 278 HG23 VAL 35 HG23 VAL 35 9.214 2.235 2.409 279 H ALA 36 H ALA 36 9.356 -0.940 5.891 280 HA ALA 36 HA ALA 36 7.990 -3.372 5.442 281 HB1 ALA 36 HB1 ALA 36 9.844 -4.420 6.492 282 HB2 ALA 36 HB2 ALA 36 10.288 -2.935 7.334 283 HB3 ALA 36 HB3 ALA 36 10.469 -3.044 5.583 284 H ALA 37 H ALA 37 8.489 -1.401 8.328 285 HA ALA 37 HA ALA 37 7.386 -3.150 10.214 286 HB1 ALA 37 HB1 ALA 37 8.710 -1.228 10.862 287 HB2 ALA 37 HB2 ALA 37 7.120 -1.150 11.623 288 HB3 ALA 37 HB3 ALA 37 7.478 -0.137 10.224 289 H PHE 38 H PHE 38 5.884 -0.682 8.181 290 HA PHE 38 HA PHE 38 3.334 -0.690 9.327 291 HB2 PHE 38 HB2 PHE 38 4.365 0.868 7.536 292 HB3 PHE 38 HB3 PHE 38 3.789 -0.325 6.378 293 HD1 PHE 38 HD2 PHE 38 2.642 1.849 9.164 294 HD2 PHE 38 HD1 PHE 38 1.613 -0.221 5.590 295 HE1 PHE 38 HE2 PHE 38 0.427 2.916 9.189 296 HE2 PHE 38 HE1 PHE 38 -0.608 0.843 5.611 297 HZ PHE 38 HZ PHE 38 -1.203 2.414 7.414 298 H VAL 39 H VAL 39 4.766 -2.774 6.878 299 HA VAL 39 HA VAL 39 2.298 -4.163 6.341 300 HB VAL 39 HB VAL 39 5.121 -4.926 5.573 301 HG11 VAL 39 HG11 VAL 39 3.599 -6.802 5.440 302 HG12 VAL 39 HG12 VAL 39 4.019 -6.253 3.817 303 HG13 VAL 39 HG13 VAL 39 2.450 -5.841 4.512 304 HG21 VAL 39 HG21 VAL 39 3.065 -3.207 4.217 305 HG22 VAL 39 HG22 VAL 39 4.365 -3.997 3.329 306 HG23 VAL 39 HG23 VAL 39 4.746 -2.826 4.591 307 H ASP 40 H ASP 40 5.340 -4.899 8.003 308 HA ASP 40 HA ASP 40 4.862 -7.528 8.754 309 HB2 ASP 40 HB2 ASP 40 7.033 -6.465 9.023 310 HB3 ASP 40 HB3 ASP 40 6.374 -5.353 10.216 311 H ASP 41 H ASP 41 3.926 -4.536 10.374 312 HA ASP 41 HA ASP 41 2.771 -5.793 12.655 313 HB2 ASP 41 HB2 ASP 41 3.486 -3.544 12.920 314 HB3 ASP 41 HB3 ASP 41 2.591 -3.012 11.505 315 H LYS 42 H LYS 42 1.477 -4.565 9.608 316 HA LYS 42 HA LYS 42 -1.250 -4.855 10.248 317 HB2 LYS 42 HB2 LYS 42 -0.099 -3.583 8.299 318 HB3 LYS 42 HB3 LYS 42 -0.210 -5.117 7.448 319 HG2 LYS 42 HG2 LYS 42 -2.485 -5.019 7.277 320 HG3 LYS 42 HG3 LYS 42 -2.662 -4.036 8.732 321 HD2 LYS 42 HD2 LYS 42 -1.400 -2.993 6.207 322 HD3 LYS 42 HD3 LYS 42 -3.133 -2.884 6.524 323 HE2 LYS 42 HE2 LYS 42 -1.242 -1.899 8.604 324 HE3 LYS 42 HE3 LYS 42 -1.490 -0.918 7.163 325 HZ1 LYS 42 HZ1 LYS 42 -3.791 -0.751 7.614 326 HZ2 LYS 42 HZ2 LYS 42 -2.991 -0.405 9.067 327 HZ3 LYS 42 HZ3 LYS 42 -3.713 -1.914 8.847 328 H MET 43 H MET 43 1.018 -7.079 8.641 329 HA MET 43 HA MET 43 -0.872 -9.070 8.009 330 HB2 MET 43 HB2 MET 43 2.091 -9.214 8.531 331 HB3 MET 43 HB3 MET 43 1.147 -10.613 8.047 332 HG2 MET 43 HG2 MET 43 0.507 -9.458 5.986 333 HG3 MET 43 HG3 MET 43 1.497 -8.078 6.467 334 HE1 MET 43 HE1 MET 43 1.408 -11.737 5.194 335 HE2 MET 43 HE2 MET 43 2.165 -11.994 6.766 336 HE3 MET 43 HE3 MET 43 3.094 -12.239 5.286 337 H HIS 44 H HIS 44 0.897 -8.357 10.928 338 HA HIS 44 HA HIS 44 0.452 -10.792 12.271 339 HB2 HIS 44 HB2 HIS 44 1.326 -8.072 13.060 340 HB3 HIS 44 HB3 HIS 44 0.668 -9.084 14.339 341 HD1 HIS 44 HD1 HIS 44 3.589 -8.766 12.034 342 HD2 HIS 44 HD2 HIS 44 2.233 -11.302 15.040 343 HE1 HIS 44 HE1 HIS 44 5.533 -10.256 12.595 344 HE2 HIS 44 HE2 HIS 44 4.756 -11.613 14.571 345 H GLU 45 H GLU 45 -1.506 -7.854 12.049 346 HA GLU 45 HA GLU 45 -3.330 -8.703 14.089 347 HB2 GLU 45 HB2 GLU 45 -4.571 -6.742 13.618 348 HB3 GLU 45 HB3 GLU 45 -2.876 -6.309 13.447 349 HG2 GLU 45 HG2 GLU 45 -3.073 -6.481 11.014 350 HG3 GLU 45 HG3 GLU 45 -4.772 -6.921 11.180 351 H PHE 46 H PHE 46 -3.003 -9.413 10.741 352 HA PHE 46 HA PHE 46 -5.809 -10.224 10.555 353 HB2 PHE 46 HB2 PHE 46 -3.639 -9.891 8.501 354 HB3 PHE 46 HB3 PHE 46 -5.130 -10.757 8.135 355 HD1 PHE 46 HD1 PHE 46 -7.337 -9.506 8.664 356 HD2 PHE 46 HD2 PHE 46 -3.566 -7.599 8.228 357 HE1 PHE 46 HE1 PHE 46 -8.476 -7.372 8.216 358 HE2 PHE 46 HE2 PHE 46 -4.695 -5.462 7.770 359 HZ PHE 46 HZ PHE 46 -7.151 -5.347 7.763 360 H SER 47 H SER 47 -2.751 -11.556 11.167 361 HA SER 47 HA SER 47 -2.978 -14.148 10.188 362 HB2 SER 47 HB2 SER 47 -1.297 -14.770 11.805 363 HB3 SER 47 HB3 SER 47 -0.924 -13.147 11.224 364 HG SER 47 HG SER 47 -1.599 -12.294 13.131 365 H GLU 48 H GLU 48 -4.614 -12.623 12.800 366 HA GLU 48 HA GLU 48 -5.571 -15.180 13.857 367 HB2 GLU 48 HB2 GLU 48 -6.582 -13.701 15.665 368 HB3 GLU 48 HB3 GLU 48 -4.828 -13.791 15.614 369 HG2 GLU 48 HG2 GLU 48 -4.609 -11.627 14.836 370 HG3 GLU 48 HG3 GLU 48 -6.254 -11.583 14.198 371 H LYS 49 H LYS 49 -6.408 -13.317 11.411 372 HA LYS 49 HA LYS 49 -9.300 -13.466 11.939 373 HB2 LYS 49 HB2 LYS 49 -7.792 -11.837 9.876 374 HB3 LYS 49 HB3 LYS 49 -9.543 -11.888 10.027 375 HG2 LYS 49 HG2 LYS 49 -7.757 -11.003 12.277 376 HG3 LYS 49 HG3 LYS 49 -8.358 -9.894 11.045 377 HD2 LYS 49 HD2 LYS 49 -10.260 -11.648 12.552 378 HD3 LYS 49 HD3 LYS 49 -9.656 -10.164 13.281 379 HE2 LYS 49 HE2 LYS 49 -10.602 -8.833 11.557 380 HE3 LYS 49 HE3 LYS 49 -10.962 -10.252 10.571 381 HZ1 LYS 49 HZ1 LYS 49 -12.885 -9.244 11.823 382 HZ2 LYS 49 HZ2 LYS 49 -12.171 -9.825 13.241 383 HZ3 LYS 49 HZ3 LYS 49 -12.656 -10.905 12.037 384 H GLN 50 H GLN 50 -6.900 -13.956 9.379 385 HA GLN 50 HA GLN 50 -6.788 -15.354 7.597 386 HB2 GLN 50 HB2 GLN 50 -8.498 -17.235 9.218 387 HB3 GLN 50 HB3 GLN 50 -7.325 -17.650 7.978 388 HG2 GLN 50 HG2 GLN 50 -5.705 -17.773 9.481 389 HG3 GLN 50 HG3 GLN 50 -6.046 -16.137 10.042 390 HE21 GLN 50 HE21 GLN 50 -8.227 -18.887 10.158 391 HE22 GLN 50 HE22 GLN 50 -8.306 -18.983 11.881 392 HA PRO 51 HA PRO 51 -10.865 -13.924 5.957 393 HB2 PRO 51 HB2 PRO 51 -9.819 -13.574 3.415 394 HB3 PRO 51 HB3 PRO 51 -9.915 -12.320 4.654 395 HG2 PRO 51 HG2 PRO 51 -7.603 -14.040 3.870 396 HG3 PRO 51 HG3 PRO 51 -7.630 -12.327 4.317 397 HD2 PRO 51 HD2 PRO 51 -6.803 -14.205 6.040 398 HD3 PRO 51 HD3 PRO 51 -7.720 -12.788 6.591 399 H MET 52 H MET 52 -8.563 -15.973 4.155 400 HA MET 52 HA MET 52 -10.801 -17.788 3.563 401 HB2 MET 52 HB2 MET 52 -8.545 -16.929 1.749 402 HB3 MET 52 HB3 MET 52 -9.580 -18.310 1.409 403 HG2 MET 52 HG2 MET 52 -11.508 -16.590 1.707 404 HG3 MET 52 HG3 MET 52 -10.239 -15.402 1.412 405 HE1 MET 52 HE1 MET 52 -12.514 -15.961 -1.873 406 HE2 MET 52 HE2 MET 52 -12.123 -14.796 -0.608 407 HE3 MET 52 HE3 MET 52 -13.017 -16.262 -0.209 408 H LEU 53 H LEU 53 -8.482 -17.631 5.575 409 HA LEU 53 HA LEU 53 -7.012 -19.014 6.617 410 HB2 LEU 53 HB2 LEU 53 -9.081 -20.828 5.486 411 HB3 LEU 53 HB3 LEU 53 -7.640 -21.552 6.181 412 HG LEU 53 HG LEU 53 -8.145 -20.183 8.274 413 HD11 LEU 53 HD11 LEU 53 -10.459 -19.498 8.596 414 HD12 LEU 53 HD12 LEU 53 -10.826 -19.923 6.923 415 HD13 LEU 53 HD13 LEU 53 -9.708 -18.604 7.275 416 HD21 LEU 53 HD21 LEU 53 -10.115 -22.303 7.447 417 HD22 LEU 53 HD22 LEU 53 -9.735 -21.813 9.097 418 HD23 LEU 53 HD23 LEU 53 -8.505 -22.592 8.104 419 H ASP 54 H ASP 54 -6.010 -18.014 4.288 420 HA ASP 54 HA ASP 54 -4.263 -20.204 3.428 421 HB2 ASP 54 HB2 ASP 54 -6.069 -19.679 1.711 422 HB3 ASP 54 HB3 ASP 54 -5.313 -18.104 1.528 423 H VAL 55 H VAL 55 -2.133 -19.613 3.147 424 HA VAL 55 HA VAL 55 -1.237 -17.371 4.587 425 HB VAL 55 HB VAL 55 0.418 -18.967 2.640 426 HG11 VAL 55 HG11 VAL 55 2.289 -18.322 4.013 427 HG12 VAL 55 HG12 VAL 55 1.221 -17.479 5.132 428 HG13 VAL 55 HG13 VAL 55 1.425 -16.876 3.489 429 HG21 VAL 55 HG21 VAL 55 0.957 -20.442 4.478 430 HG22 VAL 55 HG22 VAL 55 -0.786 -20.433 4.207 431 HG23 VAL 55 HG23 VAL 55 -0.097 -19.526 5.554 432 HA PRO 56 HA PRO 56 0.130 -15.331 0.393 433 HB2 PRO 56 HB2 PRO 56 -1.254 -16.195 -1.829 434 HB3 PRO 56 HB3 PRO 56 0.372 -16.723 -1.391 435 HG2 PRO 56 HG2 PRO 56 -2.252 -18.070 -0.931 436 HG3 PRO 56 HG3 PRO 56 -0.696 -18.774 -1.410 437 HD2 PRO 56 HD2 PRO 56 -1.610 -18.951 1.105 438 HD3 PRO 56 HD3 PRO 56 0.120 -18.758 0.753 439 H LYS 57 H LYS 57 -3.205 -16.465 0.708 440 HA LYS 57 HA LYS 57 -4.353 -14.109 -0.414 441 HB2 LYS 57 HB2 LYS 57 -5.591 -16.276 1.284 442 HB3 LYS 57 HB3 LYS 57 -6.493 -15.003 0.480 443 HG2 LYS 57 HG2 LYS 57 -5.591 -15.799 -1.689 444 HG3 LYS 57 HG3 LYS 57 -4.843 -17.145 -0.833 445 HD2 LYS 57 HD2 LYS 57 -7.038 -17.901 -0.089 446 HD3 LYS 57 HD3 LYS 57 -7.795 -16.542 -0.921 447 HE2 LYS 57 HE2 LYS 57 -8.015 -18.444 -2.337 448 HE3 LYS 57 HE3 LYS 57 -6.789 -17.395 -3.046 449 HZ1 LYS 57 HZ1 LYS 57 -5.270 -18.995 -1.537 450 HZ2 LYS 57 HZ2 LYS 57 -5.643 -19.308 -3.161 451 HZ3 LYS 57 HZ3 LYS 57 -6.527 -20.061 -1.935 452 H LEU 58 H LEU 58 -3.023 -14.842 2.627 453 HA LEU 58 HA LEU 58 -4.536 -12.835 4.079 454 HB2 LEU 58 HB2 LEU 58 -3.685 -14.954 5.129 455 HB3 LEU 58 HB3 LEU 58 -2.057 -14.342 4.924 456 HG LEU 58 HG LEU 58 -3.680 -12.418 6.357 457 HD11 LEU 58 HD11 LEU 58 -4.261 -13.627 8.275 458 HD12 LEU 58 HD12 LEU 58 -3.364 -15.054 7.750 459 HD13 LEU 58 HD13 LEU 58 -4.852 -14.593 6.925 460 HD21 LEU 58 HD21 LEU 58 -1.853 -12.554 7.942 461 HD22 LEU 58 HD22 LEU 58 -1.219 -12.502 6.298 462 HD23 LEU 58 HD23 LEU 58 -1.265 -14.031 7.175 463 H ALA 59 H ALA 59 -1.365 -13.289 2.652 464 HA ALA 59 HA ALA 59 -0.193 -10.888 3.566 465 HB1 ALA 59 HB1 ALA 59 0.466 -12.565 1.147 466 HB2 ALA 59 HB2 ALA 59 1.152 -12.739 2.762 467 HB3 ALA 59 HB3 ALA 59 1.485 -11.289 1.814 468 H VAL 60 H VAL 60 -1.842 -11.721 0.522 469 HA VAL 60 HA VAL 60 -1.486 -9.168 -0.654 470 HB VAL 60 HB VAL 60 -2.077 -11.331 -1.866 471 HG11 VAL 60 HG11 VAL 60 -4.045 -11.830 -0.392 472 HG12 VAL 60 HG12 VAL 60 -4.353 -11.952 -2.124 473 HG13 VAL 60 HG13 VAL 60 -4.907 -10.539 -1.227 474 HG21 VAL 60 HG21 VAL 60 -1.972 -9.211 -3.015 475 HG22 VAL 60 HG22 VAL 60 -3.610 -8.813 -2.494 476 HG23 VAL 60 HG23 VAL 60 -3.339 -10.144 -3.621 477 H LEU 61 H LEU 61 -3.708 -10.365 1.696 478 HA LEU 61 HA LEU 61 -5.844 -8.576 1.292 479 HB2 LEU 61 HB2 LEU 61 -5.873 -10.620 2.760 480 HB3 LEU 61 HB3 LEU 61 -4.937 -9.712 3.935 481 HG LEU 61 HG LEU 61 -6.879 -8.009 3.837 482 HD11 LEU 61 HD11 LEU 61 -7.997 -8.922 1.887 483 HD12 LEU 61 HD12 LEU 61 -9.050 -9.003 3.301 484 HD13 LEU 61 HD13 LEU 61 -8.236 -10.457 2.727 485 HD21 LEU 61 HD21 LEU 61 -7.006 -10.710 5.134 486 HD22 LEU 61 HD22 LEU 61 -8.198 -9.455 5.455 487 HD23 LEU 61 HD23 LEU 61 -6.500 -9.177 5.839 488 H THR 62 H THR 62 -2.855 -8.326 3.163 489 HA THR 62 HA THR 62 -3.510 -5.797 4.299 490 HB THR 62 HB THR 62 -1.162 -5.648 4.968 491 HG1 THR 62 HG1 THR 62 -0.841 -7.947 3.302 492 HG21 THR 62 HG21 THR 62 -2.805 -7.136 6.173 493 HG22 THR 62 HG22 THR 62 -1.101 -7.509 6.427 494 HG23 THR 62 HG23 THR 62 -2.067 -8.496 5.327 495 H ALA 63 H ALA 63 -1.847 -6.879 1.423 496 HA ALA 63 HA ALA 63 -0.681 -4.493 0.574 497 HB1 ALA 63 HB1 ALA 63 -0.279 -6.768 -0.374 498 HB2 ALA 63 HB2 ALA 63 -0.524 -5.510 -1.582 499 HB3 ALA 63 HB3 ALA 63 -1.828 -6.636 -1.204 500 H VAL 64 H VAL 64 -3.813 -5.908 -0.306 501 HA VAL 64 HA VAL 64 -4.616 -3.740 -1.915 502 HB VAL 64 HB VAL 64 -5.558 -6.051 -2.023 503 HG11 VAL 64 HG11 VAL 64 -7.050 -5.182 0.440 504 HG12 VAL 64 HG12 VAL 64 -5.923 -6.531 0.295 505 HG13 VAL 64 HG13 VAL 64 -7.472 -6.582 -0.547 506 HG21 VAL 64 HG21 VAL 64 -7.508 -3.775 -1.766 507 HG22 VAL 64 HG22 VAL 64 -7.854 -5.321 -2.539 508 HG23 VAL 64 HG23 VAL 64 -6.626 -4.254 -3.214 509 H GLN 65 H GLN 65 -4.979 -4.364 1.548 510 HA GLN 65 HA GLN 65 -6.864 -2.252 1.937 511 HB2 GLN 65 HB2 GLN 65 -6.462 -4.257 3.480 512 HB3 GLN 65 HB3 GLN 65 -5.074 -3.359 4.088 513 HG2 GLN 65 HG2 GLN 65 -6.629 -1.464 4.609 514 HG3 GLN 65 HG3 GLN 65 -7.971 -2.524 4.183 515 HE21 GLN 65 HE21 GLN 65 -5.502 -1.791 6.484 516 HE22 GLN 65 HE22 GLN 65 -6.077 -2.847 7.740 517 H ILE 66 H ILE 66 -3.350 -2.533 2.290 518 HA ILE 66 HA ILE 66 -2.838 -0.030 3.425 519 HB ILE 66 HB ILE 66 -1.182 -1.798 1.628 520 HG12 ILE 66 HG12 ILE 66 -0.716 -0.974 4.496 521 HG13 ILE 66 HG13 ILE 66 -1.702 -2.366 4.055 522 HG21 ILE 66 HG21 ILE 66 -0.134 0.690 2.969 523 HG22 ILE 66 HG22 ILE 66 -0.615 0.636 1.274 524 HG23 ILE 66 HG23 ILE 66 0.711 -0.377 1.846 525 HD11 ILE 66 HD11 ILE 66 0.248 -3.336 2.903 526 HD12 ILE 66 HD12 ILE 66 0.515 -3.087 4.626 527 HD13 ILE 66 HD13 ILE 66 1.220 -1.973 3.457 528 H ALA 67 H ALA 67 -3.352 -1.005 0.093 529 HA ALA 67 HA ALA 67 -2.633 1.366 -1.203 530 HB1 ALA 67 HB1 ALA 67 -2.977 -0.516 -2.564 531 HB2 ALA 67 HB2 ALA 67 -4.307 0.572 -2.962 532 HB3 ALA 67 HB3 ALA 67 -4.583 -0.811 -1.902 533 H SER 68 H SER 68 -5.829 0.313 -0.002 534 HA SER 68 HA SER 68 -7.199 2.670 -0.696 535 HB2 SER 68 HB2 SER 68 -8.520 1.640 1.523 536 HB3 SER 68 HB3 SER 68 -8.834 1.229 -0.164 537 HG SER 68 HG SER 68 -7.060 -0.098 1.616 538 H GLU 69 H GLU 69 -5.619 1.663 2.307 539 HA GLU 69 HA GLU 69 -6.378 3.736 3.973 540 HB2 GLU 69 HB2 GLU 69 -3.857 2.093 3.872 541 HB3 GLU 69 HB3 GLU 69 -4.132 3.295 5.123 542 HG2 GLU 69 HG2 GLU 69 -6.173 2.120 5.801 543 HG3 GLU 69 HG3 GLU 69 -5.864 0.897 4.569 544 H TYR 70 H TYR 70 -3.816 3.670 1.558 545 HA TYR 70 HA TYR 70 -3.006 6.373 2.304 546 HB2 TYR 70 HB2 TYR 70 -1.807 4.247 0.567 547 HB3 TYR 70 HB3 TYR 70 -1.275 5.922 0.432 548 HD1 TYR 70 HD1 TYR 70 -0.239 7.043 2.398 549 HD2 TYR 70 HD2 TYR 70 -1.114 2.876 2.394 550 HE1 TYR 70 HE1 TYR 70 1.286 6.725 4.301 551 HE2 TYR 70 HE2 TYR 70 0.407 2.552 4.297 552 HH TYR 70 HH TYR 70 2.369 3.688 5.301 553 H LEU 71 H LEU 71 -4.848 4.749 -0.157 554 HA LEU 71 HA LEU 71 -4.611 6.684 -2.203 555 HB2 LEU 71 HB2 LEU 71 -6.365 4.410 -1.647 556 HB3 LEU 71 HB3 LEU 71 -7.158 5.696 -2.530 557 HG LEU 71 HG LEU 71 -4.509 4.595 -3.445 558 HD11 LEU 71 HD11 LEU 71 -5.780 3.165 -5.025 559 HD12 LEU 71 HD12 LEU 71 -7.244 3.511 -4.106 560 HD13 LEU 71 HD13 LEU 71 -5.904 2.649 -3.344 561 HD21 LEU 71 HD21 LEU 71 -5.030 5.562 -5.514 562 HD22 LEU 71 HD22 LEU 71 -5.504 6.770 -4.317 563 HD23 LEU 71 HD23 LEU 71 -6.730 5.765 -5.089 564 H LYS 72 H LYS 72 -7.000 6.318 0.396 565 HA LYS 72 HA LYS 72 -8.487 8.612 -0.269 566 HB2 LYS 72 HB2 LYS 72 -9.410 8.472 2.001 567 HB3 LYS 72 HB3 LYS 72 -9.392 6.906 1.203 568 HG2 LYS 72 HG2 LYS 72 -7.453 6.229 2.484 569 HG3 LYS 72 HG3 LYS 72 -7.347 7.835 3.214 570 HD2 LYS 72 HD2 LYS 72 -9.391 7.522 4.391 571 HD3 LYS 72 HD3 LYS 72 -9.771 6.058 3.482 572 HE2 LYS 72 HE2 LYS 72 -8.986 5.546 5.738 573 HE3 LYS 72 HE3 LYS 72 -7.886 4.917 4.515 574 HZ1 LYS 72 HZ1 LYS 72 -6.325 6.576 4.966 575 HZ2 LYS 72 HZ2 LYS 72 -6.866 6.093 6.494 576 HZ3 LYS 72 HZ3 LYS 72 -7.437 7.529 5.813 577 H LEU 73 H LEU 73 -5.405 8.287 1.092 578 HA LEU 73 HA LEU 73 -5.437 10.847 2.460 579 HB2 LEU 73 HB2 LEU 73 -4.207 8.934 3.409 580 HB3 LEU 73 HB3 LEU 73 -3.188 8.889 1.985 581 HG LEU 73 HG LEU 73 -2.375 11.181 2.567 582 HD11 LEU 73 HD11 LEU 73 -2.725 11.864 4.959 583 HD12 LEU 73 HD12 LEU 73 -4.026 10.676 5.033 584 HD13 LEU 73 HD13 LEU 73 -4.133 12.032 3.911 585 HD21 LEU 73 HD21 LEU 73 -0.916 10.424 4.377 586 HD22 LEU 73 HD22 LEU 73 -1.085 9.195 3.123 587 HD23 LEU 73 HD23 LEU 73 -1.967 9.034 4.641 588 H LYS 74 H LYS 74 -4.508 9.497 -0.600 589 HA LYS 74 HA LYS 74 -2.892 11.795 -1.309 590 HB2 LYS 74 HB2 LYS 74 -2.195 10.621 -3.147 591 HB3 LYS 74 HB3 LYS 74 -2.640 9.283 -2.101 592 HG2 LYS 74 HG2 LYS 74 -4.785 9.082 -3.252 593 HG3 LYS 74 HG3 LYS 74 -4.367 10.451 -4.281 594 HD2 LYS 74 HD2 LYS 74 -2.821 7.862 -4.151 595 HD3 LYS 74 HD3 LYS 74 -4.029 8.248 -5.374 596 HE2 LYS 74 HE2 LYS 74 -2.543 10.374 -5.731 597 HE3 LYS 74 HE3 LYS 74 -1.301 9.377 -4.980 598 HZ1 LYS 74 HZ1 LYS 74 -2.887 8.544 -7.344 599 HZ2 LYS 74 HZ2 LYS 74 -1.560 7.740 -6.677 600 HZ3 LYS 74 HZ3 LYS 74 -1.347 9.236 -7.430 601 H GLU 75 H GLU 75 -6.171 10.705 -1.685 602 HA GLU 75 HA GLU 75 -6.824 12.419 -3.858 603 HB2 GLU 75 HB2 GLU 75 -9.023 11.675 -3.640 604 HB3 GLU 75 HB3 GLU 75 -8.075 10.312 -3.072 605 HG2 GLU 75 HG2 GLU 75 -9.461 10.300 -1.331 606 HG3 GLU 75 HG3 GLU 75 -8.558 11.704 -0.755 607 H GLU 76 H GLU 76 -6.749 12.828 -0.386 608 HA GLU 76 HA GLU 76 -8.305 15.220 -0.399 609 HB2 GLU 76 HB2 GLU 76 -7.650 15.497 1.906 610 HB3 GLU 76 HB3 GLU 76 -8.059 13.812 1.629 611 HG2 GLU 76 HG2 GLU 76 -5.957 13.093 2.025 612 HG3 GLU 76 HG3 GLU 76 -5.215 14.533 1.328 613 H TYR 77 H TYR 77 -4.966 14.423 -0.830 614 HA TYR 77 HA TYR 77 -3.852 16.985 -0.441 615 HB2 TYR 77 HB2 TYR 77 -2.453 15.012 -0.436 616 HB3 TYR 77 HB3 TYR 77 -2.936 14.613 -2.079 617 HD1 TYR 77 HD2 TYR 77 -1.928 17.969 -0.825 618 HD2 TYR 77 HD1 TYR 77 -0.845 14.576 -3.151 619 HE1 TYR 77 HE2 TYR 77 0.021 19.186 -1.680 620 HE2 TYR 77 HE1 TYR 77 1.108 15.785 -4.018 621 HH TYR 77 HH TYR 77 2.575 17.689 -3.280 622 H GLN 78 H GLN 78 -5.044 15.300 -3.299 623 HA GLN 78 HA GLN 78 -4.384 17.354 -5.141 624 HB2 GLN 78 HB2 GLN 78 -6.343 15.064 -5.334 625 HB3 GLN 78 HB3 GLN 78 -5.925 16.121 -6.675 626 HG2 GLN 78 HG2 GLN 78 -3.948 14.426 -5.169 627 HG3 GLN 78 HG3 GLN 78 -4.723 13.954 -6.682 628 HE21 GLN 78 HE21 GLN 78 -2.309 15.895 -5.186 629 HE22 GLN 78 HE22 GLN 78 -1.585 16.497 -6.636 630 H ARG 79 H ARG 79 -7.079 16.863 -3.003 631 HA ARG 79 HA ARG 79 -8.711 18.762 -4.483 632 HB2 ARG 79 HB2 ARG 79 -9.288 17.138 -2.009 633 HB3 ARG 79 HB3 ARG 79 -10.426 18.268 -2.731 634 HG2 ARG 79 HG2 ARG 79 -9.249 15.918 -4.198 635 HG3 ARG 79 HG3 ARG 79 -10.789 15.876 -3.338 636 HD2 ARG 79 HD2 ARG 79 -10.205 17.905 -5.485 637 HD3 ARG 79 HD3 ARG 79 -10.867 16.311 -5.849 638 HE ARG 79 HE ARG 79 -12.527 17.270 -3.932 639 HH11 ARG 79 HH11 ARG 79 -11.410 18.582 -6.986 640 HH12 ARG 79 HH12 ARG 79 -12.901 19.415 -7.304 641 HH21 ARG 79 HH21 ARG 79 -14.471 18.390 -4.344 642 HH22 ARG 79 HH22 ARG 79 -14.638 19.313 -5.802 643 H LEU 80 H LEU 80 -7.115 18.494 -1.336 644 HA LEU 80 HA LEU 80 -8.011 20.882 -0.207 645 HB2 LEU 80 HB2 LEU 80 -6.888 19.299 1.159 646 HB3 LEU 80 HB3 LEU 80 -5.462 19.320 0.141 647 HG LEU 80 HG LEU 80 -5.229 21.792 0.872 648 HD11 LEU 80 HD11 LEU 80 -7.470 21.968 1.856 649 HD12 LEU 80 HD12 LEU 80 -6.199 22.334 3.023 650 HD13 LEU 80 HD13 LEU 80 -7.019 20.774 3.073 651 HD21 LEU 80 HD21 LEU 80 -4.782 19.511 2.800 652 HD22 LEU 80 HD22 LEU 80 -4.055 21.111 2.938 653 HD23 LEU 80 HD23 LEU 80 -3.666 20.085 1.558 654 H ARG 81 H ARG 81 -5.225 20.275 -2.310 655 HA ARG 81 HA ARG 81 -4.320 22.992 -2.178 656 HB2 ARG 81 HB2 ARG 81 -3.542 20.614 -3.841 657 HB3 ARG 81 HB3 ARG 81 -2.868 22.209 -4.148 658 HG2 ARG 81 HG2 ARG 81 -2.664 21.645 -1.362 659 HG3 ARG 81 HG3 ARG 81 -2.016 20.281 -2.280 660 HD2 ARG 81 HD2 ARG 81 -0.264 21.891 -1.820 661 HD3 ARG 81 HD3 ARG 81 -0.596 21.828 -3.549 662 HE ARG 81 HE ARG 81 -1.602 23.968 -1.776 663 HH11 ARG 81 HH11 ARG 81 -0.252 22.886 -4.827 664 HH12 ARG 81 HH12 ARG 81 -0.222 24.472 -5.522 665 HH21 ARG 81 HH21 ARG 81 -1.545 26.063 -2.687 666 HH22 ARG 81 HH22 ARG 81 -0.948 26.282 -4.300 667 H GLU 82 H GLU 82 -6.500 21.211 -4.230 668 HA GLU 82 HA GLU 82 -6.414 23.199 -6.318 669 HB2 GLU 82 HB2 GLU 82 -7.382 21.655 -7.609 670 HB3 GLU 82 HB3 GLU 82 -7.085 20.540 -6.285 671 HG2 GLU 82 HG2 GLU 82 -9.274 20.534 -5.620 672 HG3 GLU 82 HG3 GLU 82 -9.595 22.134 -6.284 673 H GLN 83 H GLN 83 -8.378 22.509 -3.511 674 HA GLN 83 HA GLN 83 -10.514 24.252 -4.331 675 HB2 GLN 83 HB2 GLN 83 -11.544 23.765 -2.281 676 HB3 GLN 83 HB3 GLN 83 -10.681 22.289 -2.687 677 HG2 GLN 83 HG2 GLN 83 -8.865 22.964 -1.176 678 HG3 GLN 83 HG3 GLN 83 -9.792 24.399 -0.736 679 HE21 GLN 83 HE21 GLN 83 -10.101 23.930 1.376 680 HE22 GLN 83 HE22 GLN 83 -11.037 22.589 1.936 681 H LEU 84 H LEU 84 -7.420 24.713 -3.211 682 HA LEU 84 HA LEU 84 -7.967 27.217 -1.837 683 HB2 LEU 84 HB2 LEU 84 -5.898 25.283 -1.745 684 HB3 LEU 84 HB3 LEU 84 -5.176 26.762 -2.339 685 HG LEU 84 HG LEU 84 -4.930 26.577 0.075 686 HD11 LEU 84 HD11 LEU 84 -6.869 28.744 -0.708 687 HD12 LEU 84 HD12 LEU 84 -5.113 28.807 -0.854 688 HD13 LEU 84 HD13 LEU 84 -5.863 28.730 0.737 689 HD21 LEU 84 HD21 LEU 84 -6.776 26.547 1.588 690 HD22 LEU 84 HD22 LEU 84 -6.983 25.213 0.454 691 HD23 LEU 84 HD23 LEU 84 -7.934 26.686 0.270 692 H LYS 85 H LYS 85 -7.388 26.109 -4.966 693 HA LYS 85 HA LYS 85 -6.057 28.501 -5.909 694 HB2 LYS 85 HB2 LYS 85 -5.810 27.426 -7.946 695 HB3 LYS 85 HB3 LYS 85 -5.864 26.053 -6.848 696 HG2 LYS 85 HG2 LYS 85 -8.397 26.041 -7.359 697 HG3 LYS 85 HG3 LYS 85 -7.961 27.043 -8.742 698 HD2 LYS 85 HD2 LYS 85 -6.586 25.323 -9.658 699 HD3 LYS 85 HD3 LYS 85 -6.689 24.365 -8.179 700 HE2 LYS 85 HE2 LYS 85 -9.193 24.275 -8.590 701 HE3 LYS 85 HE3 LYS 85 -8.850 24.914 -10.194 702 HZ1 LYS 85 HZ1 LYS 85 -7.238 22.640 -9.478 703 HZ2 LYS 85 HZ2 LYS 85 -8.105 22.949 -10.896 704 HZ3 LYS 85 HZ3 LYS 85 -8.898 22.300 -9.545 705 H LYS 86 H LYS 86 -7.003 29.939 -7.460 706 HA LYS 86 HA LYS 86 -9.905 29.892 -7.715 707 HB2 LYS 86 HB2 LYS 86 -9.268 31.205 -5.634 708 HB3 LYS 86 HB3 LYS 86 -8.481 32.356 -6.704 709 HG2 LYS 86 HG2 LYS 86 -10.912 32.227 -7.852 710 HG3 LYS 86 HG3 LYS 86 -11.339 31.910 -6.171 711 HD2 LYS 86 HD2 LYS 86 -11.295 34.112 -5.856 712 HD3 LYS 86 HD3 LYS 86 -9.543 34.024 -6.037 713 HE2 LYS 86 HE2 LYS 86 -11.415 34.320 -8.370 714 HE3 LYS 86 HE3 LYS 86 -10.756 35.700 -7.503 715 HZ1 LYS 86 HZ1 LYS 86 -8.568 35.096 -8.133 716 HZ2 LYS 86 HZ2 LYS 86 -9.509 35.046 -9.533 717 HZ3 LYS 86 HZ3 LYS 86 -9.068 33.605 -8.761 718 H1 GLY 1 H1 GLY 1 -36.103 -3.342 20.048 719 H2 GLY 1 H2 GLY 1 -36.257 -4.993 20.372 720 H3 GLY 1 H3 GLY 1 -36.104 -4.457 18.778 721 HA2 GLY 1 HA3 GLY 1 -34.024 -4.226 20.879 722 HA3 GLY 1 HA2 GLY 1 -34.030 -5.411 19.584 723 H SER 2 H SER 2 -32.544 -2.733 20.496 724 HA SER 2 HA SER 2 -32.666 -1.176 18.079 725 HB2 SER 2 HB2 SER 2 -30.578 -0.951 20.246 726 HB3 SER 2 HB3 SER 2 -31.145 0.301 19.141 727 HG SER 2 HG SER 2 -33.047 -0.906 20.777 728 H HIS 3 H HIS 3 -32.089 -2.658 16.475 729 HA HIS 3 HA HIS 3 -29.312 -3.611 16.530 730 HB2 HIS 3 HB2 HIS 3 -31.534 -5.021 15.955 731 HB3 HIS 3 HB3 HIS 3 -31.124 -4.449 14.341 732 HD1 HIS 3 HD1 HIS 3 -29.864 -6.654 17.101 733 HD2 HIS 3 HD2 HIS 3 -28.853 -5.604 13.208 734 HE1 HIS 3 HE1 HIS 3 -28.087 -8.286 16.402 735 HE2 HIS 3 HE2 HIS 3 -27.652 -7.761 13.979 736 H MET 4 H MET 4 -30.824 -0.959 15.641 737 HA MET 4 HA MET 4 -29.606 -0.671 13.006 738 HB2 MET 4 HB2 MET 4 -31.941 0.102 13.378 739 HB3 MET 4 HB3 MET 4 -31.341 1.267 14.549 740 HG2 MET 4 HG2 MET 4 -30.147 2.458 12.863 741 HG3 MET 4 HG3 MET 4 -30.491 1.210 11.666 742 HE1 MET 4 HE1 MET 4 -31.389 2.848 9.910 743 HE2 MET 4 HE2 MET 4 -31.051 4.230 10.952 744 HE3 MET 4 HE3 MET 4 -32.637 4.061 10.201 745 H THR 5 H THR 5 -27.641 0.170 12.809 746 HA THR 5 HA THR 5 -26.479 1.594 15.076 747 HB THR 5 HB THR 5 -24.390 1.389 13.456 748 HG1 THR 5 HG1 THR 5 -24.807 -0.870 12.477 749 HG21 THR 5 HG21 THR 5 -23.789 -0.653 14.570 750 HG22 THR 5 HG22 THR 5 -25.481 -1.030 14.892 751 HG23 THR 5 HG23 THR 5 -24.712 0.335 15.702 752 H GLU 6 H GLU 6 -24.746 3.290 14.221 753 HA GLU 6 HA GLU 6 -26.316 5.327 12.880 754 HB2 GLU 6 HB2 GLU 6 -23.730 5.346 14.416 755 HB3 GLU 6 HB3 GLU 6 -24.241 6.741 13.477 756 HG2 GLU 6 HG2 GLU 6 -24.847 6.995 15.812 757 HG3 GLU 6 HG3 GLU 6 -26.284 6.895 14.799 758 H GLN 7 H GLN 7 -25.432 3.166 11.253 759 HA GLN 7 HA GLN 7 -24.471 2.687 9.257 760 HB2 GLN 7 HB2 GLN 7 -25.560 5.201 9.039 761 HB3 GLN 7 HB3 GLN 7 -23.914 5.463 8.483 762 HG2 GLN 7 HG2 GLN 7 -25.945 3.551 7.364 763 HG3 GLN 7 HG3 GLN 7 -25.279 4.988 6.595 764 HE21 GLN 7 HE21 GLN 7 -23.181 4.934 5.767 765 HE22 GLN 7 HE22 GLN 7 -22.351 3.442 5.489 766 HA PRO 8 HA PRO 8 -20.168 3.423 10.692 767 HB2 PRO 8 HB2 PRO 8 -19.430 0.855 10.937 768 HB3 PRO 8 HB3 PRO 8 -20.380 1.668 12.188 769 HG2 PRO 8 HG2 PRO 8 -21.273 -0.236 10.063 770 HG3 PRO 8 HG3 PRO 8 -21.784 -0.127 11.754 771 HD2 PRO 8 HD2 PRO 8 -23.192 0.908 9.614 772 HD3 PRO 8 HD3 PRO 8 -23.357 1.461 11.292 773 H LYS 9 H LYS 9 -18.101 2.249 9.771 774 HA LYS 9 HA LYS 9 -17.921 2.775 7.058 775 HB2 LYS 9 HB2 LYS 9 -15.756 1.624 7.121 776 HB3 LYS 9 HB3 LYS 9 -15.964 2.685 8.501 777 HG2 LYS 9 HG2 LYS 9 -16.748 0.536 9.727 778 HG3 LYS 9 HG3 LYS 9 -15.947 -0.303 8.401 779 HD2 LYS 9 HD2 LYS 9 -14.276 -0.160 10.005 780 HD3 LYS 9 HD3 LYS 9 -13.933 1.217 8.958 781 HE2 LYS 9 HE2 LYS 9 -15.049 2.714 10.509 782 HE3 LYS 9 HE3 LYS 9 -15.490 1.353 11.536 783 HZ1 LYS 9 HZ1 LYS 9 -12.767 2.393 11.003 784 HZ2 LYS 9 HZ2 LYS 9 -13.066 0.944 11.817 785 HZ3 LYS 9 HZ3 LYS 9 -13.603 2.406 12.473 786 H THR 10 H THR 10 -18.339 1.658 5.242 787 HA THR 10 HA THR 10 -19.636 -0.914 5.554 788 HB THR 10 HB THR 10 -20.534 1.060 4.141 789 HG1 THR 10 HG1 THR 10 -21.731 -0.677 3.833 790 HG21 THR 10 HG21 THR 10 -18.518 1.484 2.825 791 HG22 THR 10 HG22 THR 10 -19.859 1.019 1.778 792 HG23 THR 10 HG23 THR 10 -18.594 -0.149 2.161 793 H ARG 11 H ARG 11 -19.159 -2.686 4.096 794 HA ARG 11 HA ARG 11 -16.276 -2.863 3.544 795 HB2 ARG 11 HB2 ARG 11 -18.292 -5.047 4.095 796 HB3 ARG 11 HB3 ARG 11 -16.616 -5.329 3.652 797 HG2 ARG 11 HG2 ARG 11 -15.942 -4.079 5.702 798 HG3 ARG 11 HG3 ARG 11 -17.647 -4.031 6.157 799 HD2 ARG 11 HD2 ARG 11 -17.592 -6.581 5.842 800 HD3 ARG 11 HD3 ARG 11 -15.840 -6.415 5.899 801 HE ARG 11 HE ARG 11 -16.327 -5.255 8.135 802 HH11 ARG 11 HH11 ARG 11 -18.204 -7.909 6.814 803 HH12 ARG 11 HH12 ARG 11 -18.704 -8.493 8.370 804 HH21 ARG 11 HH21 ARG 11 -16.982 -6.036 10.181 805 HH22 ARG 11 HH22 ARG 11 -18.008 -7.433 10.274 806 H VAL 12 H VAL 12 -15.579 -3.791 1.614 807 HA VAL 12 HA VAL 12 -17.627 -4.211 -0.445 808 HB VAL 12 HB VAL 12 -16.755 -1.941 -0.760 809 HG11 VAL 12 HG11 VAL 12 -14.087 -3.320 -0.795 810 HG12 VAL 12 HG12 VAL 12 -14.610 -1.949 0.184 811 HG13 VAL 12 HG13 VAL 12 -14.333 -1.744 -1.546 812 HG21 VAL 12 HG21 VAL 12 -15.997 -3.994 -2.818 813 HG22 VAL 12 HG22 VAL 12 -15.844 -2.264 -3.117 814 HG23 VAL 12 HG23 VAL 12 -17.426 -2.961 -2.767 815 H SER 13 H SER 13 -17.290 -5.984 -1.657 816 HA SER 13 HA SER 13 -14.800 -7.450 -1.217 817 HB2 SER 13 HB2 SER 13 -17.424 -8.431 -2.371 818 HB3 SER 13 HB3 SER 13 -16.030 -9.430 -1.952 819 HG SER 13 HG SER 13 -16.455 -9.194 0.150 820 H VAL 14 H VAL 14 -13.303 -7.198 -2.736 821 HA VAL 14 HA VAL 14 -14.198 -6.801 -5.517 822 HB VAL 14 HB VAL 14 -11.847 -5.716 -5.796 823 HG11 VAL 14 HG11 VAL 14 -12.822 -3.491 -5.154 824 HG12 VAL 14 HG12 VAL 14 -14.207 -4.368 -4.506 825 HG13 VAL 14 HG13 VAL 14 -13.821 -4.475 -6.222 826 HG21 VAL 14 HG21 VAL 14 -11.134 -6.263 -3.457 827 HG22 VAL 14 HG22 VAL 14 -12.311 -5.077 -2.886 828 HG23 VAL 14 HG23 VAL 14 -10.965 -4.565 -3.896 829 H ARG 15 H ARG 15 -12.466 -7.440 -7.134 830 HA ARG 15 HA ARG 15 -11.437 -10.056 -6.300 831 HB2 ARG 15 HB2 ARG 15 -13.071 -10.015 -8.162 832 HB3 ARG 15 HB3 ARG 15 -11.953 -9.030 -9.094 833 HG2 ARG 15 HG2 ARG 15 -10.299 -10.857 -8.992 834 HG3 ARG 15 HG3 ARG 15 -11.490 -11.851 -8.153 835 HD2 ARG 15 HD2 ARG 15 -11.829 -10.667 -10.903 836 HD3 ARG 15 HD3 ARG 15 -11.399 -12.341 -10.556 837 HE ARG 15 HE ARG 15 -13.623 -12.356 -9.299 838 HH11 ARG 15 HH11 ARG 15 -13.003 -10.489 -12.197 839 HH12 ARG 15 HH12 ARG 15 -14.663 -10.472 -12.697 840 HH21 ARG 15 HH21 ARG 15 -15.809 -12.341 -9.962 841 HH22 ARG 15 HH22 ARG 15 -16.254 -11.537 -11.431 842 H ILE 16 H ILE 16 -9.330 -10.426 -6.201 843 HA ILE 16 HA ILE 16 -7.474 -8.718 -7.709 844 HB ILE 16 HB ILE 16 -7.260 -9.445 -4.783 845 HG12 ILE 16 HG12 ILE 16 -6.657 -6.805 -4.982 846 HG13 ILE 16 HG13 ILE 16 -7.798 -6.972 -6.310 847 HG21 ILE 16 HG21 ILE 16 -5.032 -8.395 -4.829 848 HG22 ILE 16 HG22 ILE 16 -5.142 -8.292 -6.585 849 HG23 ILE 16 HG23 ILE 16 -5.113 -9.867 -5.796 850 HD11 ILE 16 HD11 ILE 16 -8.969 -6.281 -4.345 851 HD12 ILE 16 HD12 ILE 16 -8.285 -7.610 -3.411 852 HD13 ILE 16 HD13 ILE 16 -9.426 -7.944 -4.715 853 H TYR 17 H TYR 17 -6.185 -9.907 -8.933 854 HA TYR 17 HA TYR 17 -5.006 -11.623 -9.806 855 HB2 TYR 17 HB2 TYR 17 -4.054 -11.414 -7.327 856 HB3 TYR 17 HB3 TYR 17 -4.748 -13.025 -7.186 857 HD1 TYR 17 HD2 TYR 17 -2.585 -11.070 -9.540 858 HD2 TYR 17 HD1 TYR 17 -3.374 -14.822 -7.689 859 HE1 TYR 17 HE2 TYR 17 -0.578 -12.015 -10.603 860 HE2 TYR 17 HE1 TYR 17 -1.370 -15.771 -8.749 861 HH TYR 17 HH TYR 17 0.948 -13.790 -10.417 862 H GLY 18 H GLY 18 -7.970 -11.863 -9.351 863 HA2 GLY 18 HA2 GLY 18 -9.299 -13.520 -10.424 864 HA3 GLY 18 HA3 GLY 18 -8.087 -14.718 -10.013 865 H GLN 19 H GLN 19 -8.320 -13.191 -7.193 866 HA GLN 19 HA GLN 19 -10.608 -14.850 -6.352 867 HB2 GLN 19 HB2 GLN 19 -7.903 -14.594 -5.280 868 HB3 GLN 19 HB3 GLN 19 -9.158 -14.423 -4.055 869 HG2 GLN 19 HG2 GLN 19 -8.803 -16.735 -5.948 870 HG3 GLN 19 HG3 GLN 19 -8.447 -16.725 -4.223 871 HE21 GLN 19 HE21 GLN 19 -10.774 -15.219 -3.466 872 HE22 GLN 19 HE22 GLN 19 -12.137 -16.266 -3.654 873 H ASP 20 H ASP 20 -12.015 -14.054 -4.774 874 HA ASP 20 HA ASP 20 -12.182 -11.154 -4.747 875 HB2 ASP 20 HB2 ASP 20 -14.436 -11.383 -4.290 876 HB3 ASP 20 HB3 ASP 20 -14.126 -12.861 -5.194 877 H TYR 21 H TYR 21 -12.147 -9.887 -2.947 878 HA TYR 21 HA TYR 21 -11.646 -11.155 -0.345 879 HB2 TYR 21 HB2 TYR 21 -9.977 -8.918 -1.523 880 HB3 TYR 21 HB3 TYR 21 -9.842 -9.528 0.122 881 HD1 TYR 21 HD2 TYR 21 -9.242 -12.007 0.414 882 HD2 TYR 21 HD1 TYR 21 -8.738 -9.887 -3.236 883 HE1 TYR 21 HE2 TYR 21 -7.654 -13.717 -0.353 884 HE2 TYR 21 HE1 TYR 21 -7.148 -11.596 -4.020 885 HH TYR 21 HH TYR 21 -5.714 -13.294 -3.166 886 H THR 22 H THR 22 -12.565 -10.119 1.351 887 HA THR 22 HA THR 22 -14.215 -7.798 0.702 888 HB THR 22 HB THR 22 -14.301 -9.580 3.141 889 HG1 THR 22 HG1 THR 22 -14.939 -10.684 1.238 890 HG21 THR 22 HG21 THR 22 -16.212 -7.461 2.151 891 HG22 THR 22 HG22 THR 22 -15.194 -7.356 3.588 892 HG23 THR 22 HG23 THR 22 -16.502 -8.537 3.520 893 H ILE 23 H ILE 23 -13.472 -5.873 1.204 894 HA ILE 23 HA ILE 23 -11.749 -5.573 3.576 895 HB ILE 23 HB ILE 23 -10.569 -3.732 2.306 896 HG12 ILE 23 HG12 ILE 23 -11.863 -5.090 -0.076 897 HG13 ILE 23 HG13 ILE 23 -12.255 -3.480 0.513 898 HG21 ILE 23 HG21 ILE 23 -10.222 -6.501 1.170 899 HG22 ILE 23 HG22 ILE 23 -9.619 -5.984 2.744 900 HG23 ILE 23 HG23 ILE 23 -8.998 -5.236 1.274 901 HD11 ILE 23 HD11 ILE 23 -10.862 -3.092 -1.287 902 HD12 ILE 23 HD12 ILE 23 -9.801 -4.440 -0.885 903 HD13 ILE 23 HD13 ILE 23 -9.769 -2.968 0.091 904 H VAL 24 H VAL 24 -11.540 -3.073 4.026 905 HA VAL 24 HA VAL 24 -14.274 -2.117 4.323 906 HB VAL 24 HB VAL 24 -11.707 -0.989 5.456 907 HG11 VAL 24 HG11 VAL 24 -14.567 -0.425 6.235 908 HG12 VAL 24 HG12 VAL 24 -13.550 0.644 5.269 909 HG13 VAL 24 HG13 VAL 24 -13.118 0.290 6.942 910 HG21 VAL 24 HG21 VAL 24 -13.774 -2.783 6.729 911 HG22 VAL 24 HG22 VAL 24 -12.422 -2.026 7.571 912 HG23 VAL 24 HG23 VAL 24 -12.117 -3.224 6.312 913 H GLY 25 H GLY 25 -15.120 -0.499 3.128 914 HA2 GLY 25 HA2 GLY 25 -13.262 1.301 1.724 915 HA3 GLY 25 HA3 GLY 25 -14.499 0.456 0.807 916 H ALA 26 H ALA 26 -14.048 2.689 3.522 917 HA ALA 26 HA ALA 26 -16.759 3.720 3.035 918 HB1 ALA 26 HB1 ALA 26 -16.351 2.910 5.304 919 HB2 ALA 26 HB2 ALA 26 -16.648 4.648 5.293 920 HB3 ALA 26 HB3 ALA 26 -15.002 4.036 5.466 921 H GLU 27 H GLU 27 -14.020 4.384 1.727 922 HA GLU 27 HA GLU 27 -13.879 7.223 2.374 923 HB2 GLU 27 HB2 GLU 27 -11.861 7.274 0.981 924 HB3 GLU 27 HB3 GLU 27 -11.756 6.056 2.241 925 HG2 GLU 27 HG2 GLU 27 -12.093 4.297 0.679 926 HG3 GLU 27 HG3 GLU 27 -12.522 5.437 -0.597 927 H SER 28 H SER 28 -14.268 5.197 -0.534 928 HA SER 28 HA SER 28 -16.271 6.832 -1.651 929 HB2 SER 28 HB2 SER 28 -14.886 8.490 -2.402 930 HB3 SER 28 HB3 SER 28 -13.458 7.464 -2.344 931 HG SER 28 HG SER 28 -15.103 8.048 -4.436 932 HA PRO 29 HA PRO 29 -16.806 2.906 -3.650 933 HB2 PRO 29 HB2 PRO 29 -18.603 3.733 -5.554 934 HB3 PRO 29 HB3 PRO 29 -19.030 3.361 -3.882 935 HG2 PRO 29 HG2 PRO 29 -18.518 6.012 -5.162 936 HG3 PRO 29 HG3 PRO 29 -19.773 5.553 -3.995 937 HD2 PRO 29 HD2 PRO 29 -17.575 6.895 -3.242 938 HD3 PRO 29 HD3 PRO 29 -18.320 5.669 -2.197 939 H ALA 30 H ALA 30 -15.801 5.800 -5.284 940 HA ALA 30 HA ALA 30 -15.124 4.419 -7.741 941 HB1 ALA 30 HB1 ALA 30 -14.639 7.266 -6.866 942 HB2 ALA 30 HB2 ALA 30 -15.957 6.696 -7.889 943 HB3 ALA 30 HB3 ALA 30 -14.293 6.623 -8.471 944 H HIS 31 H HIS 31 -13.508 5.805 -4.926 945 HA HIS 31 HA HIS 31 -10.852 5.462 -5.841 946 HB2 HIS 31 HB2 HIS 31 -12.005 5.649 -3.062 947 HB3 HIS 31 HB3 HIS 31 -10.278 5.539 -3.374 948 HD1 HIS 31 HD1 HIS 31 -11.272 7.554 -6.048 949 HD2 HIS 31 HD2 HIS 31 -11.028 8.213 -1.949 950 HE1 HIS 31 HE1 HIS 31 -11.145 10.044 -5.768 951 HE2 HIS 31 HE2 HIS 31 -11.174 10.428 -3.281 952 H ILE 32 H ILE 32 -12.930 3.441 -3.811 953 HA ILE 32 HA ILE 32 -11.064 1.401 -3.333 954 HB ILE 32 HB ILE 32 -12.933 -0.009 -2.684 955 HG12 ILE 32 HG12 ILE 32 -14.703 2.182 -3.807 956 HG13 ILE 32 HG13 ILE 32 -14.485 0.586 -4.510 957 HG21 ILE 32 HG21 ILE 32 -13.705 1.294 -0.865 958 HG22 ILE 32 HG22 ILE 32 -13.470 2.798 -1.750 959 HG23 ILE 32 HG23 ILE 32 -12.075 1.850 -1.235 960 HD11 ILE 32 HD11 ILE 32 -15.392 -0.337 -2.335 961 HD12 ILE 32 HD12 ILE 32 -16.529 0.511 -3.376 962 HD13 ILE 32 HD13 ILE 32 -15.870 1.315 -1.951 963 H ARG 33 H ARG 33 -12.739 2.187 -6.187 964 HA ARG 33 HA ARG 33 -12.769 -0.458 -7.313 965 HB2 ARG 33 HB2 ARG 33 -14.219 1.648 -7.941 966 HB3 ARG 33 HB3 ARG 33 -12.858 2.031 -8.985 967 HG2 ARG 33 HG2 ARG 33 -14.308 0.869 -10.374 968 HG3 ARG 33 HG3 ARG 33 -13.134 -0.355 -9.888 969 HD2 ARG 33 HD2 ARG 33 -14.663 -1.180 -8.191 970 HD3 ARG 33 HD3 ARG 33 -15.823 0.082 -8.597 971 HE ARG 33 HE ARG 33 -15.029 -1.850 -10.658 972 HH11 ARG 33 HH11 ARG 33 -17.485 -0.556 -8.516 973 HH12 ARG 33 HH12 ARG 33 -18.789 -1.373 -9.317 974 HH21 ARG 33 HH21 ARG 33 -16.747 -2.937 -11.698 975 HH22 ARG 33 HH22 ARG 33 -18.371 -2.736 -11.120 976 H LEU 34 H LEU 34 -10.589 2.220 -7.121 977 HA LEU 34 HA LEU 34 -8.820 1.280 -9.207 978 HB2 LEU 34 HB2 LEU 34 -8.260 3.356 -7.088 979 HB3 LEU 34 HB3 LEU 34 -7.424 3.147 -8.612 980 HG LEU 34 HG LEU 34 -10.299 4.020 -8.342 981 HD11 LEU 34 HD11 LEU 34 -9.463 6.230 -9.018 982 HD12 LEU 34 HD12 LEU 34 -7.811 5.623 -8.910 983 HD13 LEU 34 HD13 LEU 34 -8.813 5.720 -7.461 984 HD21 LEU 34 HD21 LEU 34 -8.453 3.837 -10.714 985 HD22 LEU 34 HD22 LEU 34 -10.034 4.620 -10.729 986 HD23 LEU 34 HD23 LEU 34 -9.909 2.886 -10.429 987 H VAL 35 H VAL 35 -9.165 1.099 -5.774 988 HA VAL 35 HA VAL 35 -6.697 0.357 -4.851 989 HB VAL 35 HB VAL 35 -9.419 -0.647 -4.012 990 HG11 VAL 35 HG11 VAL 35 -8.407 -1.319 -1.906 991 HG12 VAL 35 HG12 VAL 35 -6.816 -0.862 -2.512 992 HG13 VAL 35 HG13 VAL 35 -7.692 -2.201 -3.254 993 HG21 VAL 35 HG21 VAL 35 -7.648 1.485 -2.830 994 HG22 VAL 35 HG22 VAL 35 -9.243 1.011 -2.249 995 HG23 VAL 35 HG23 VAL 35 -9.069 1.775 -3.830 996 H ALA 36 H ALA 36 -9.222 -1.855 -6.039 997 HA ALA 36 HA ALA 36 -7.693 -4.206 -5.774 998 HB1 ALA 36 HB1 ALA 36 -9.420 -5.288 -7.033 999 HB2 ALA 36 HB2 ALA 36 -9.977 -3.746 -7.683 1000 HB3 ALA 36 HB3 ALA 36 -10.171 -4.099 -5.969 1001 H ALA 37 H ALA 37 -8.309 -2.133 -8.599 1002 HA ALA 37 HA ALA 37 -6.939 -3.709 -10.477 1003 HB1 ALA 37 HB1 ALA 37 -8.497 -1.935 -11.101 1004 HB2 ALA 37 HB2 ALA 37 -6.931 -1.717 -11.882 1005 HB3 ALA 37 HB3 ALA 37 -7.371 -0.725 -10.492 1006 H PHE 38 H PHE 38 -5.827 -1.162 -8.320 1007 HA PHE 38 HA PHE 38 -3.253 -0.828 -9.408 1008 HB2 PHE 38 HB2 PHE 38 -4.484 0.681 -7.768 1009 HB3 PHE 38 HB3 PHE 38 -3.983 -0.441 -6.507 1010 HD1 PHE 38 HD2 PHE 38 -2.819 2.000 -8.994 1011 HD2 PHE 38 HD1 PHE 38 -1.742 -0.460 -5.693 1012 HE1 PHE 38 HE2 PHE 38 -0.679 3.198 -8.806 1013 HE2 PHE 38 HE1 PHE 38 0.401 0.736 -5.498 1014 HZ PHE 38 HZ PHE 38 0.934 2.565 -7.054 1015 H VAL 39 H VAL 39 -4.353 -2.777 -6.636 1016 HA VAL 39 HA VAL 39 -1.766 -3.872 -6.161 1017 HB VAL 39 HB VAL 39 -3.487 -3.662 -4.393 1018 HG11 VAL 39 HG11 VAL 39 -4.854 -5.818 -5.959 1019 HG12 VAL 39 HG12 VAL 39 -5.494 -4.261 -5.438 1020 HG13 VAL 39 HG13 VAL 39 -5.178 -5.525 -4.251 1021 HG21 VAL 39 HG21 VAL 39 -1.609 -5.129 -4.032 1022 HG22 VAL 39 HG22 VAL 39 -2.430 -6.441 -4.879 1023 HG23 VAL 39 HG23 VAL 39 -3.060 -5.854 -3.339 1024 H ASP 40 H ASP 40 -4.533 -4.912 -8.060 1025 HA ASP 40 HA ASP 40 -3.784 -7.597 -8.449 1026 HB2 ASP 40 HB2 ASP 40 -6.018 -6.785 -9.008 1027 HB3 ASP 40 HB3 ASP 40 -5.351 -5.752 -10.267 1028 H ASP 41 H ASP 41 -3.059 -4.676 -10.313 1029 HA ASP 41 HA ASP 41 -1.597 -5.989 -12.353 1030 HB2 ASP 41 HB2 ASP 41 -2.585 -3.556 -12.247 1031 HB3 ASP 41 HB3 ASP 41 -1.009 -3.157 -11.570 1032 H LYS 42 H LYS 42 -0.744 -4.674 -9.234 1033 HA LYS 42 HA LYS 42 2.054 -4.666 -9.521 1034 HB2 LYS 42 HB2 LYS 42 0.471 -3.703 -7.639 1035 HB3 LYS 42 HB3 LYS 42 0.790 -5.253 -6.874 1036 HG2 LYS 42 HG2 LYS 42 2.582 -4.272 -5.995 1037 HG3 LYS 42 HG3 LYS 42 3.299 -4.396 -7.602 1038 HD2 LYS 42 HD2 LYS 42 1.605 -2.048 -6.771 1039 HD3 LYS 42 HD3 LYS 42 3.347 -2.101 -6.490 1040 HE2 LYS 42 HE2 LYS 42 3.666 -2.480 -8.930 1041 HE3 LYS 42 HE3 LYS 42 1.931 -2.252 -9.153 1042 HZ1 LYS 42 HZ1 LYS 42 3.700 -0.290 -9.361 1043 HZ2 LYS 42 HZ2 LYS 42 3.335 -0.134 -7.711 1044 HZ3 LYS 42 HZ3 LYS 42 2.103 -0.034 -8.874 1045 H MET 43 H MET 43 -0.162 -7.175 -8.300 1046 HA MET 43 HA MET 43 1.862 -9.031 -7.615 1047 HB2 MET 43 HB2 MET 43 -1.074 -9.241 -8.135 1048 HB3 MET 43 HB3 MET 43 -0.120 -10.713 -8.044 1049 HG2 MET 43 HG2 MET 43 0.718 -9.746 -5.799 1050 HG3 MET 43 HG3 MET 43 -0.695 -8.699 -5.915 1051 HE1 MET 43 HE1 MET 43 -0.738 -13.282 -5.446 1052 HE2 MET 43 HE2 MET 43 0.686 -12.250 -5.319 1053 HE3 MET 43 HE3 MET 43 -0.070 -12.520 -6.890 1054 H HIS 44 H HIS 44 0.250 -8.294 -10.614 1055 HA HIS 44 HA HIS 44 1.025 -10.678 -11.972 1056 HB2 HIS 44 HB2 HIS 44 -0.180 -8.070 -12.793 1057 HB3 HIS 44 HB3 HIS 44 0.473 -9.145 -14.028 1058 HD1 HIS 44 HD1 HIS 44 -2.471 -8.620 -11.883 1059 HD2 HIS 44 HD2 HIS 44 -0.840 -11.721 -14.123 1060 HE1 HIS 44 HE1 HIS 44 -4.308 -10.321 -12.128 1061 HE2 HIS 44 HE2 HIS 44 -3.232 -12.264 -13.316 1062 H GLU 45 H GLU 45 2.536 -7.515 -11.558 1063 HA GLU 45 HA GLU 45 4.447 -7.996 -13.639 1064 HB2 GLU 45 HB2 GLU 45 5.488 -5.942 -13.015 1065 HB3 GLU 45 HB3 GLU 45 3.749 -5.707 -12.936 1066 HG2 GLU 45 HG2 GLU 45 3.789 -5.861 -10.528 1067 HG3 GLU 45 HG3 GLU 45 5.509 -6.255 -10.550 1068 H PHE 46 H PHE 46 4.278 -8.746 -10.257 1069 HA PHE 46 HA PHE 46 7.119 -9.295 -10.082 1070 HB2 PHE 46 HB2 PHE 46 4.861 -9.707 -8.125 1071 HB3 PHE 46 HB3 PHE 46 6.530 -10.149 -7.789 1072 HD1 PHE 46 HD1 PHE 46 8.114 -7.948 -8.718 1073 HD2 PHE 46 HD2 PHE 46 4.276 -7.900 -6.888 1074 HE1 PHE 46 HE1 PHE 46 8.535 -5.665 -7.903 1075 HE2 PHE 46 HE2 PHE 46 4.691 -5.618 -6.067 1076 HZ PHE 46 HZ PHE 46 6.823 -4.497 -6.574 1077 H SER 47 H SER 47 4.366 -10.947 -11.124 1078 HA SER 47 HA SER 47 4.940 -13.577 -10.304 1079 HB2 SER 47 HB2 SER 47 3.443 -12.612 -12.749 1080 HB3 SER 47 HB3 SER 47 3.422 -14.265 -12.134 1081 HG SER 47 HG SER 47 2.744 -12.134 -10.417 1082 H GLU 48 H GLU 48 6.356 -11.583 -12.733 1083 HA GLU 48 HA GLU 48 7.617 -13.884 -14.030 1084 HB2 GLU 48 HB2 GLU 48 8.440 -12.254 -15.688 1085 HB3 GLU 48 HB3 GLU 48 6.690 -12.211 -15.531 1086 HG2 GLU 48 HG2 GLU 48 6.716 -10.151 -14.450 1087 HG3 GLU 48 HG3 GLU 48 8.417 -10.302 -14.010 1088 H LYS 49 H LYS 49 8.204 -12.199 -11.343 1089 HA LYS 49 HA LYS 49 11.106 -12.053 -11.789 1090 HB2 LYS 49 HB2 LYS 49 9.347 -10.675 -9.761 1091 HB3 LYS 49 HB3 LYS 49 11.098 -10.707 -9.626 1092 HG2 LYS 49 HG2 LYS 49 9.664 -9.627 -12.038 1093 HG3 LYS 49 HG3 LYS 49 10.087 -8.634 -10.645 1094 HD2 LYS 49 HD2 LYS 49 12.172 -10.246 -12.088 1095 HD3 LYS 49 HD3 LYS 49 11.679 -8.660 -12.665 1096 HE2 LYS 49 HE2 LYS 49 12.424 -7.598 -10.695 1097 HE3 LYS 49 HE3 LYS 49 12.592 -9.127 -9.842 1098 HZ1 LYS 49 HZ1 LYS 49 14.701 -8.060 -10.691 1099 HZ2 LYS 49 HZ2 LYS 49 14.196 -8.501 -12.243 1100 HZ3 LYS 49 HZ3 LYS 49 14.481 -9.691 -11.074 1101 H GLN 50 H GLN 50 8.739 -12.966 -9.303 1102 HA GLN 50 HA GLN 50 8.740 -14.543 -7.677 1103 HB2 GLN 50 HB2 GLN 50 10.703 -15.913 -9.522 1104 HB3 GLN 50 HB3 GLN 50 9.923 -16.675 -8.145 1105 HG2 GLN 50 HG2 GLN 50 7.782 -16.508 -9.161 1106 HG3 GLN 50 HG3 GLN 50 8.410 -15.480 -10.447 1107 HE21 GLN 50 HE21 GLN 50 8.113 -18.715 -9.256 1108 HE22 GLN 50 HE22 GLN 50 8.710 -19.507 -10.673 1109 HA PRO 51 HA PRO 51 12.466 -12.582 -5.714 1110 HB2 PRO 51 HB2 PRO 51 11.216 -12.494 -3.240 1111 HB3 PRO 51 HB3 PRO 51 11.216 -11.185 -4.425 1112 HG2 PRO 51 HG2 PRO 51 9.118 -13.239 -3.870 1113 HG3 PRO 51 HG3 PRO 51 8.933 -11.522 -4.265 1114 HD2 PRO 51 HD2 PRO 51 8.503 -13.434 -6.092 1115 HD3 PRO 51 HD3 PRO 51 9.239 -11.879 -6.534 1116 H MET 52 H MET 52 10.369 -15.004 -4.152 1117 HA MET 52 HA MET 52 12.783 -16.564 -3.532 1118 HB2 MET 52 HB2 MET 52 10.414 -16.026 -1.734 1119 HB3 MET 52 HB3 MET 52 11.569 -17.315 -1.433 1120 HG2 MET 52 HG2 MET 52 13.363 -15.548 -1.415 1121 HG3 MET 52 HG3 MET 52 12.069 -14.353 -1.432 1122 HE1 MET 52 HE1 MET 52 13.447 -14.203 2.244 1123 HE2 MET 52 HE2 MET 52 13.165 -13.302 0.754 1124 HE3 MET 52 HE3 MET 52 14.397 -14.562 0.801 1125 H LEU 53 H LEU 53 10.633 -16.560 -5.637 1126 HA LEU 53 HA LEU 53 9.268 -17.966 -6.777 1127 HB2 LEU 53 HB2 LEU 53 11.471 -19.671 -5.734 1128 HB3 LEU 53 HB3 LEU 53 10.096 -20.484 -6.460 1129 HG LEU 53 HG LEU 53 10.484 -18.906 -8.470 1130 HD11 LEU 53 HD11 LEU 53 12.686 -18.049 -8.765 1131 HD12 LEU 53 HD12 LEU 53 13.233 -18.780 -7.255 1132 HD13 LEU 53 HD13 LEU 53 12.074 -17.450 -7.222 1133 HD21 LEU 53 HD21 LEU 53 12.196 -20.438 -9.389 1134 HD22 LEU 53 HD22 LEU 53 10.861 -21.277 -8.604 1135 HD23 LEU 53 HD23 LEU 53 12.411 -21.122 -7.778 1136 H ASP 54 H ASP 54 7.876 -17.216 -4.727 1137 HA ASP 54 HA ASP 54 6.349 -19.571 -4.019 1138 HB2 ASP 54 HB2 ASP 54 8.129 -19.174 -2.210 1139 HB3 ASP 54 HB3 ASP 54 7.219 -17.724 -1.804 1140 H VAL 55 H VAL 55 4.218 -19.113 -3.524 1141 HA VAL 55 HA VAL 55 3.133 -16.812 -4.723 1142 HB VAL 55 HB VAL 55 1.589 -18.502 -2.779 1143 HG11 VAL 55 HG11 VAL 55 0.490 -16.534 -3.753 1144 HG12 VAL 55 HG12 VAL 55 -0.262 -18.038 -4.282 1145 HG13 VAL 55 HG13 VAL 55 0.816 -17.161 -5.369 1146 HG21 VAL 55 HG21 VAL 55 1.120 -20.048 -4.652 1147 HG22 VAL 55 HG22 VAL 55 2.808 -20.077 -4.144 1148 HG23 VAL 55 HG23 VAL 55 2.343 -19.214 -5.612 1149 HA PRO 56 HA PRO 56 1.927 -15.235 -0.242 1150 HB2 PRO 56 HB2 PRO 56 3.686 -16.098 1.719 1151 HB3 PRO 56 HB3 PRO 56 2.056 -16.730 1.464 1152 HG2 PRO 56 HG2 PRO 56 4.677 -17.822 0.552 1153 HG3 PRO 56 HG3 PRO 56 3.257 -18.684 1.169 1154 HD2 PRO 56 HD2 PRO 56 3.814 -18.623 -1.441 1155 HD3 PRO 56 HD3 PRO 56 2.138 -18.543 -0.861 1156 H LYS 57 H LYS 57 5.321 -15.973 -0.921 1157 HA LYS 57 HA LYS 57 6.333 -13.566 0.203 1158 HB2 LYS 57 HB2 LYS 57 7.470 -15.660 -1.612 1159 HB3 LYS 57 HB3 LYS 57 8.358 -14.176 -1.312 1160 HG2 LYS 57 HG2 LYS 57 9.194 -15.794 0.196 1161 HG3 LYS 57 HG3 LYS 57 8.200 -14.687 1.142 1162 HD2 LYS 57 HD2 LYS 57 6.421 -16.254 1.266 1163 HD3 LYS 57 HD3 LYS 57 7.160 -17.291 0.048 1164 HE2 LYS 57 HE2 LYS 57 9.121 -17.460 1.730 1165 HE3 LYS 57 HE3 LYS 57 7.942 -16.878 2.907 1166 HZ1 LYS 57 HZ1 LYS 57 7.176 -19.126 1.183 1167 HZ2 LYS 57 HZ2 LYS 57 6.739 -18.789 2.785 1168 HZ3 LYS 57 HZ3 LYS 57 8.267 -19.427 2.446 1169 H LEU 58 H LEU 58 4.945 -14.423 -2.827 1170 HA LEU 58 HA LEU 58 5.936 -12.127 -4.263 1171 HB2 LEU 58 HB2 LEU 58 5.244 -14.416 -5.218 1172 HB3 LEU 58 HB3 LEU 58 3.594 -13.850 -5.039 1173 HG LEU 58 HG LEU 58 4.978 -11.816 -6.416 1174 HD11 LEU 58 HD11 LEU 58 5.417 -14.465 -7.766 1175 HD12 LEU 58 HD12 LEU 58 6.660 -13.665 -6.808 1176 HD13 LEU 58 HD13 LEU 58 6.015 -12.875 -8.245 1177 HD21 LEU 58 HD21 LEU 58 3.429 -12.363 -8.206 1178 HD22 LEU 58 HD22 LEU 58 2.608 -12.416 -6.647 1179 HD23 LEU 58 HD23 LEU 58 3.074 -13.917 -7.449 1180 H ALA 59 H ALA 59 2.966 -13.154 -2.703 1181 HA ALA 59 HA ALA 59 1.348 -10.977 -3.430 1182 HB1 ALA 59 HB1 ALA 59 1.187 -12.852 -1.078 1183 HB2 ALA 59 HB2 ALA 59 0.347 -12.992 -2.623 1184 HB3 ALA 59 HB3 ALA 59 -0.068 -11.690 -1.510 1185 H VAL 60 H VAL 60 3.331 -11.538 -0.526 1186 HA VAL 60 HA VAL 60 2.572 -9.120 0.753 1187 HB VAL 60 HB VAL 60 3.556 -11.125 1.907 1188 HG11 VAL 60 HG11 VAL 60 5.430 -11.431 0.276 1189 HG12 VAL 60 HG12 VAL 60 5.905 -11.479 1.973 1190 HG13 VAL 60 HG13 VAL 60 6.213 -10.033 1.011 1191 HG21 VAL 60 HG21 VAL 60 4.886 -9.778 3.526 1192 HG22 VAL 60 HG22 VAL 60 3.317 -9.080 3.120 1193 HG23 VAL 60 HG23 VAL 60 4.789 -8.422 2.401 1194 H LEU 61 H LEU 61 4.834 -9.810 -1.761 1195 HA LEU 61 HA LEU 61 6.618 -7.667 -1.311 1196 HB2 LEU 61 HB2 LEU 61 7.072 -9.644 -2.772 1197 HB3 LEU 61 HB3 LEU 61 5.964 -8.970 -3.951 1198 HG LEU 61 HG LEU 61 7.430 -6.996 -4.186 1199 HD11 LEU 61 HD11 LEU 61 8.538 -6.784 -2.140 1200 HD12 LEU 61 HD12 LEU 61 9.792 -7.310 -3.261 1201 HD13 LEU 61 HD13 LEU 61 9.065 -8.467 -2.148 1202 HD21 LEU 61 HD21 LEU 61 8.944 -9.569 -4.578 1203 HD22 LEU 61 HD22 LEU 61 9.129 -8.066 -5.483 1204 HD23 LEU 61 HD23 LEU 61 7.650 -9.010 -5.637 1205 H THR 62 H THR 62 3.466 -7.845 -2.762 1206 HA THR 62 HA THR 62 3.657 -5.371 -4.180 1207 HB THR 62 HB THR 62 1.210 -5.497 -4.396 1208 HG1 THR 62 HG1 THR 62 1.316 -7.923 -2.909 1209 HG21 THR 62 HG21 THR 62 1.091 -7.663 -5.586 1210 HG22 THR 62 HG22 THR 62 2.643 -8.106 -4.879 1211 HG23 THR 62 HG23 THR 62 2.534 -6.736 -5.985 1212 H ALA 63 H ALA 63 2.400 -6.371 -1.046 1213 HA ALA 63 HA ALA 63 1.217 -4.001 -0.207 1214 HB1 ALA 63 HB1 ALA 63 2.654 -6.065 1.458 1215 HB2 ALA 63 HB2 ALA 63 0.957 -6.112 0.984 1216 HB3 ALA 63 HB3 ALA 63 1.532 -4.850 2.072 1217 H VAL 64 H VAL 64 4.555 -5.109 0.202 1218 HA VAL 64 HA VAL 64 5.370 -2.861 1.692 1219 HB VAL 64 HB VAL 64 6.541 -5.058 1.691 1220 HG11 VAL 64 HG11 VAL 64 6.590 -5.486 -0.701 1221 HG12 VAL 64 HG12 VAL 64 8.213 -5.519 -0.013 1222 HG13 VAL 64 HG13 VAL 64 7.671 -4.113 -0.931 1223 HG21 VAL 64 HG21 VAL 64 8.826 -4.069 1.772 1224 HG22 VAL 64 HG22 VAL 64 7.608 -3.212 2.717 1225 HG23 VAL 64 HG23 VAL 64 8.126 -2.569 1.159 1226 H GLN 65 H GLN 65 5.474 -3.522 -1.814 1227 HA GLN 65 HA GLN 65 6.978 -1.154 -2.346 1228 HB2 GLN 65 HB2 GLN 65 6.681 -3.217 -3.898 1229 HB3 GLN 65 HB3 GLN 65 5.194 -2.416 -4.404 1230 HG2 GLN 65 HG2 GLN 65 6.605 -0.362 -4.859 1231 HG3 GLN 65 HG3 GLN 65 8.014 -1.398 -4.656 1232 HE21 GLN 65 HE21 GLN 65 5.327 -0.560 -6.666 1233 HE22 GLN 65 HE22 GLN 65 5.824 -1.477 -8.052 1234 H ILE 66 H ILE 66 3.534 -1.971 -2.409 1235 HA ILE 66 HA ILE 66 2.540 0.428 -3.435 1236 HB ILE 66 HB ILE 66 1.353 -1.572 -1.514 1237 HG12 ILE 66 HG12 ILE 66 0.636 -0.897 -4.377 1238 HG13 ILE 66 HG13 ILE 66 1.740 -2.184 -3.919 1239 HG21 ILE 66 HG21 ILE 66 -0.175 0.689 -2.784 1240 HG22 ILE 66 HG22 ILE 66 0.430 0.735 -1.129 1241 HG23 ILE 66 HG23 ILE 66 -0.757 -0.479 -1.597 1242 HD11 ILE 66 HD11 ILE 66 -0.365 -3.171 -4.360 1243 HD12 ILE 66 HD12 ILE 66 -1.200 -2.000 -3.341 1244 HD13 ILE 66 HD13 ILE 66 -0.136 -3.203 -2.611 1245 H ALA 67 H ALA 67 3.339 -0.505 -0.123 1246 HA ALA 67 HA ALA 67 2.432 1.813 1.158 1247 HB1 ALA 67 HB1 ALA 67 2.903 -0.048 2.514 1248 HB2 ALA 67 HB2 ALA 67 4.125 1.151 2.933 1249 HB3 ALA 67 HB3 ALA 67 4.540 -0.202 1.881 1250 H SER 68 H SER 68 5.693 1.007 -0.080 1251 HA SER 68 HA SER 68 6.871 3.458 0.674 1252 HB2 SER 68 HB2 SER 68 8.540 2.773 -1.227 1253 HB3 SER 68 HB3 SER 68 8.439 1.810 0.245 1254 HG SER 68 HG SER 68 6.757 1.131 -1.891 1255 H GLU 69 H GLU 69 5.062 2.505 -2.172 1256 HA GLU 69 HA GLU 69 5.813 4.656 -3.834 1257 HB2 GLU 69 HB2 GLU 69 3.366 2.898 -3.787 1258 HB3 GLU 69 HB3 GLU 69 3.610 4.141 -5.003 1259 HG2 GLU 69 HG2 GLU 69 5.838 2.985 -5.482 1260 HG3 GLU 69 HG3 GLU 69 5.198 1.640 -4.546 1261 H TYR 70 H TYR 70 3.251 4.301 -1.435 1262 HA TYR 70 HA TYR 70 2.260 6.973 -2.023 1263 HB2 TYR 70 HB2 TYR 70 1.331 4.818 -0.135 1264 HB3 TYR 70 HB3 TYR 70 0.605 6.421 -0.192 1265 HD1 TYR 70 HD1 TYR 70 0.007 7.165 -2.735 1266 HD2 TYR 70 HD2 TYR 70 0.226 3.167 -1.295 1267 HE1 TYR 70 HE1 TYR 70 -1.478 6.432 -4.552 1268 HE2 TYR 70 HE2 TYR 70 -1.259 2.427 -3.110 1269 HH TYR 70 HH TYR 70 -2.886 3.301 -4.634 1270 H LEU 71 H LEU 71 4.162 5.338 0.431 1271 HA LEU 71 HA LEU 71 3.889 7.265 2.455 1272 HB2 LEU 71 HB2 LEU 71 5.676 5.000 1.945 1273 HB3 LEU 71 HB3 LEU 71 6.371 6.268 2.940 1274 HG LEU 71 HG LEU 71 3.674 5.073 3.577 1275 HD11 LEU 71 HD11 LEU 71 5.161 3.189 3.574 1276 HD12 LEU 71 HD12 LEU 71 4.826 3.648 5.241 1277 HD13 LEU 71 HD13 LEU 71 6.365 4.084 4.504 1278 HD21 LEU 71 HD21 LEU 71 4.354 7.233 4.626 1279 HD22 LEU 71 HD22 LEU 71 5.706 6.385 5.376 1280 HD23 LEU 71 HD23 LEU 71 4.048 5.932 5.774 1281 H LYS 72 H LYS 72 6.204 7.091 -0.227 1282 HA LYS 72 HA LYS 72 7.660 9.368 0.737 1283 HB2 LYS 72 HB2 LYS 72 9.059 9.138 -1.111 1284 HB3 LYS 72 HB3 LYS 72 8.540 7.489 -0.799 1285 HG2 LYS 72 HG2 LYS 72 7.014 7.543 -2.626 1286 HG3 LYS 72 HG3 LYS 72 7.255 9.277 -2.847 1287 HD2 LYS 72 HD2 LYS 72 8.542 8.217 -4.528 1288 HD3 LYS 72 HD3 LYS 72 9.688 8.750 -3.298 1289 HE2 LYS 72 HE2 LYS 72 10.148 6.467 -4.114 1290 HE3 LYS 72 HE3 LYS 72 9.820 6.528 -2.382 1291 HZ1 LYS 72 HZ1 LYS 72 7.676 5.931 -4.322 1292 HZ2 LYS 72 HZ2 LYS 72 7.741 5.566 -2.668 1293 HZ3 LYS 72 HZ3 LYS 72 8.705 4.712 -3.763 1294 H LEU 73 H LEU 73 4.772 8.921 -0.992 1295 HA LEU 73 HA LEU 73 4.841 11.457 -2.365 1296 HB2 LEU 73 HB2 LEU 73 3.635 9.593 -3.371 1297 HB3 LEU 73 HB3 LEU 73 2.602 9.468 -1.959 1298 HG LEU 73 HG LEU 73 1.720 11.744 -2.462 1299 HD11 LEU 73 HD11 LEU 73 2.100 12.632 -4.739 1300 HD12 LEU 73 HD12 LEU 73 3.366 11.426 -4.965 1301 HD13 LEU 73 HD13 LEU 73 3.538 12.668 -3.726 1302 HD21 LEU 73 HD21 LEU 73 0.330 11.047 -4.334 1303 HD22 LEU 73 HD22 LEU 73 0.521 9.748 -3.156 1304 HD23 LEU 73 HD23 LEU 73 1.435 9.713 -4.665 1305 H LYS 74 H LYS 74 3.058 10.052 0.383 1306 HA LYS 74 HA LYS 74 1.668 12.397 1.070 1307 HB2 LYS 74 HB2 LYS 74 1.344 11.373 3.292 1308 HB3 LYS 74 HB3 LYS 74 0.986 10.262 1.983 1309 HG2 LYS 74 HG2 LYS 74 2.159 8.872 3.335 1310 HG3 LYS 74 HG3 LYS 74 3.495 9.532 2.396 1311 HD2 LYS 74 HD2 LYS 74 4.263 9.690 4.574 1312 HD3 LYS 74 HD3 LYS 74 3.633 11.305 4.263 1313 HE2 LYS 74 HE2 LYS 74 1.539 10.684 5.398 1314 HE3 LYS 74 HE3 LYS 74 2.215 9.093 5.741 1315 HZ1 LYS 74 HZ1 LYS 74 3.323 11.676 6.691 1316 HZ2 LYS 74 HZ2 LYS 74 3.961 10.142 7.028 1317 HZ3 LYS 74 HZ3 LYS 74 2.440 10.578 7.628 1318 H GLU 75 H GLU 75 4.940 11.517 1.466 1319 HA GLU 75 HA GLU 75 5.658 13.132 3.655 1320 HB2 GLU 75 HB2 GLU 75 7.074 11.328 2.743 1321 HB3 GLU 75 HB3 GLU 75 7.336 12.277 1.286 1322 HG2 GLU 75 HG2 GLU 75 9.250 12.495 2.689 1323 HG3 GLU 75 HG3 GLU 75 8.387 14.031 2.678 1324 H GLU 76 H GLU 76 5.785 13.761 0.129 1325 HA GLU 76 HA GLU 76 6.785 16.385 0.373 1326 HB2 GLU 76 HB2 GLU 76 6.289 16.686 -1.925 1327 HB3 GLU 76 HB3 GLU 76 6.755 15.002 -1.740 1328 HG2 GLU 76 HG2 GLU 76 4.606 14.231 -2.111 1329 HG3 GLU 76 HG3 GLU 76 3.868 15.767 -1.661 1330 H TYR 77 H TYR 77 3.606 15.037 0.588 1331 HA TYR 77 HA TYR 77 2.043 17.339 0.259 1332 HB2 TYR 77 HB2 TYR 77 0.867 15.327 0.204 1333 HB3 TYR 77 HB3 TYR 77 1.679 14.697 1.628 1334 HD1 TYR 77 HD2 TYR 77 -0.676 17.421 0.650 1335 HD2 TYR 77 HD1 TYR 77 0.507 14.611 3.606 1336 HE1 TYR 77 HE2 TYR 77 -2.620 18.047 2.010 1337 HE2 TYR 77 HE1 TYR 77 -1.439 15.225 4.970 1338 HH TYR 77 HH TYR 77 -4.050 16.728 3.886 1339 H GLN 78 H GLN 78 3.750 16.031 3.038 1340 HA GLN 78 HA GLN 78 2.681 18.072 4.809 1341 HB2 GLN 78 HB2 GLN 78 4.631 15.808 5.244 1342 HB3 GLN 78 HB3 GLN 78 4.176 16.948 6.501 1343 HG2 GLN 78 HG2 GLN 78 1.927 16.201 6.484 1344 HG3 GLN 78 HG3 GLN 78 2.185 15.261 5.015 1345 HE21 GLN 78 HE21 GLN 78 2.765 15.445 8.440 1346 HE22 GLN 78 HE22 GLN 78 3.237 13.795 8.648 1347 H ARG 79 H ARG 79 5.431 17.552 2.815 1348 HA ARG 79 HA ARG 79 7.160 19.366 4.238 1349 HB2 ARG 79 HB2 ARG 79 7.430 18.078 1.523 1350 HB3 ARG 79 HB3 ARG 79 8.669 19.067 2.282 1351 HG2 ARG 79 HG2 ARG 79 7.574 16.508 3.428 1352 HG3 ARG 79 HG3 ARG 79 9.076 16.653 2.515 1353 HD2 ARG 79 HD2 ARG 79 10.093 17.950 4.184 1354 HD3 ARG 79 HD3 ARG 79 8.558 18.287 4.978 1355 HE ARG 79 HE ARG 79 9.207 15.491 4.931 1356 HH11 ARG 79 HH11 ARG 79 9.609 18.517 6.655 1357 HH12 ARG 79 HH12 ARG 79 10.071 17.744 8.140 1358 HH21 ARG 79 HH21 ARG 79 9.740 14.478 6.855 1359 HH22 ARG 79 HH22 ARG 79 10.126 15.421 8.265 1360 H LEU 80 H LEU 80 5.461 19.477 1.101 1361 HA LEU 80 HA LEU 80 6.332 22.101 0.507 1362 HB2 LEU 80 HB2 LEU 80 5.288 21.827 -1.442 1363 HB3 LEU 80 HB3 LEU 80 5.082 20.170 -0.923 1364 HG LEU 80 HG LEU 80 2.961 22.162 -0.228 1365 HD11 LEU 80 HD11 LEU 80 3.287 20.850 -2.923 1366 HD12 LEU 80 HD12 LEU 80 3.308 22.581 -2.582 1367 HD13 LEU 80 HD13 LEU 80 1.825 21.657 -2.360 1368 HD21 LEU 80 HD21 LEU 80 2.991 19.798 0.615 1369 HD22 LEU 80 HD22 LEU 80 2.766 19.275 -1.054 1370 HD23 LEU 80 HD23 LEU 80 1.536 20.263 -0.265 1371 H ARG 81 H ARG 81 3.760 20.917 2.496 1372 HA ARG 81 HA ARG 81 2.311 23.398 2.487 1373 HB2 ARG 81 HB2 ARG 81 2.035 20.811 3.960 1374 HB3 ARG 81 HB3 ARG 81 1.171 22.233 4.531 1375 HG2 ARG 81 HG2 ARG 81 0.338 22.416 2.087 1376 HG3 ARG 81 HG3 ARG 81 0.847 20.734 1.968 1377 HD2 ARG 81 HD2 ARG 81 -1.580 21.141 2.573 1378 HD3 ARG 81 HD3 ARG 81 -0.683 20.035 3.609 1379 HE ARG 81 HE ARG 81 -1.034 21.466 5.356 1380 HH11 ARG 81 HH11 ARG 81 -1.508 23.273 2.383 1381 HH12 ARG 81 HH12 ARG 81 -2.079 24.694 3.191 1382 HH21 ARG 81 HH21 ARG 81 -1.770 23.356 6.413 1383 HH22 ARG 81 HH22 ARG 81 -2.215 24.746 5.473 1384 H GLU 82 H GLU 82 4.634 21.824 4.657 1385 HA GLU 82 HA GLU 82 4.333 23.714 6.746 1386 HB2 GLU 82 HB2 GLU 82 6.154 22.681 7.804 1387 HB3 GLU 82 HB3 GLU 82 5.399 21.389 6.887 1388 HG2 GLU 82 HG2 GLU 82 7.095 21.617 5.154 1389 HG3 GLU 82 HG3 GLU 82 7.852 22.924 6.062 1390 H GLN 83 H GLN 83 6.260 23.665 3.835 1391 HA GLN 83 HA GLN 83 7.768 26.017 4.656 1392 HB2 GLN 83 HB2 GLN 83 8.927 25.774 2.515 1393 HB3 GLN 83 HB3 GLN 83 8.913 24.251 3.395 1394 HG2 GLN 83 HG2 GLN 83 7.683 23.212 1.837 1395 HG3 GLN 83 HG3 GLN 83 6.671 24.626 1.544 1396 HE21 GLN 83 HE21 GLN 83 6.760 24.469 -0.663 1397 HE22 GLN 83 HE22 GLN 83 8.192 24.789 -1.577 1398 H LEU 84 H LEU 84 4.795 25.389 3.286 1399 HA LEU 84 HA LEU 84 4.719 27.626 1.457 1400 HB2 LEU 84 HB2 LEU 84 3.262 25.294 1.715 1401 HB3 LEU 84 HB3 LEU 84 2.148 26.513 2.303 1402 HG LEU 84 HG LEU 84 3.534 26.726 -0.372 1403 HD11 LEU 84 HD11 LEU 84 1.358 26.009 -1.346 1404 HD12 LEU 84 HD12 LEU 84 0.852 25.502 0.265 1405 HD13 LEU 84 HD13 LEU 84 2.234 24.726 -0.515 1406 HD21 LEU 84 HD21 LEU 84 1.833 28.344 -0.885 1407 HD22 LEU 84 HD22 LEU 84 2.639 28.806 0.614 1408 HD23 LEU 84 HD23 LEU 84 1.040 28.061 0.664 1409 H LYS 85 H LYS 85 3.978 26.970 4.770 1410 HA LYS 85 HA LYS 85 2.442 29.421 5.071 1411 HB2 LYS 85 HB2 LYS 85 1.957 28.688 7.291 1412 HB3 LYS 85 HB3 LYS 85 1.790 27.295 6.232 1413 HG2 LYS 85 HG2 LYS 85 3.971 26.477 6.924 1414 HG3 LYS 85 HG3 LYS 85 4.189 27.895 7.951 1415 HD2 LYS 85 HD2 LYS 85 2.169 27.214 9.227 1416 HD3 LYS 85 HD3 LYS 85 2.097 25.744 8.252 1417 HE2 LYS 85 HE2 LYS 85 4.224 25.018 9.085 1418 HE3 LYS 85 HE3 LYS 85 4.474 26.550 9.920 1419 HZ1 LYS 85 HZ1 LYS 85 2.241 24.706 10.529 1420 HZ2 LYS 85 HZ2 LYS 85 2.725 26.056 11.422 1421 HZ3 LYS 85 HZ3 LYS 85 3.712 24.685 11.355 1422 H LYS 86 H LYS 86 3.009 30.695 7.158 1423 HA LYS 86 HA LYS 86 5.777 30.899 7.859 1424 HB2 LYS 86 HB2 LYS 86 5.709 32.074 5.644 1425 HB3 LYS 86 HB3 LYS 86 4.543 33.201 6.320 1426 HG2 LYS 86 HG2 LYS 86 6.763 33.144 8.070 1427 HG3 LYS 86 HG3 LYS 86 7.387 33.281 6.424 1428 HD2 LYS 86 HD2 LYS 86 6.462 35.336 6.101 1429 HD3 LYS 86 HD3 LYS 86 5.075 34.991 7.138 1430 HE2 LYS 86 HE2 LYS 86 7.861 35.395 8.199 1431 HE3 LYS 86 HE3 LYS 86 6.711 36.717 8.006 1432 HZ1 LYS 86 HZ1 LYS 86 5.983 34.301 9.543 1433 HZ2 LYS 86 HZ2 LYS 86 5.338 35.863 9.647 1434 HZ3 LYS 86 HZ3 LYS 86 6.877 35.544 10.264 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 34.884 18.799 -4.106 2 H2 GLY 1 H2 GLY 1 36.146 19.466 -5.009 3 H3 GLY 1 H3 GLY 1 36.477 18.325 -3.809 4 HA2 GLY 1 HA3 GLY 1 34.954 17.807 -6.293 5 HA3 GLY 1 HA2 GLY 1 36.629 17.346 -6.013 6 H SER 2 H SER 2 34.752 15.448 -6.681 7 HA SER 2 HA SER 2 34.765 13.816 -4.272 8 HB2 SER 2 HB2 SER 2 32.282 14.232 -5.958 9 HB3 SER 2 HB3 SER 2 32.437 13.089 -4.623 10 HG SER 2 HG SER 2 33.200 15.546 -3.826 11 H HIS 3 H HIS 3 34.969 11.626 -4.680 12 HA HIS 3 HA HIS 3 36.018 10.965 -7.278 13 HB2 HIS 3 HB2 HIS 3 35.640 9.345 -4.757 14 HB3 HIS 3 HB3 HIS 3 36.324 8.679 -6.237 15 HD1 HIS 3 HD1 HIS 3 37.754 9.146 -3.366 16 HD2 HIS 3 HD2 HIS 3 38.290 11.323 -6.866 17 HE1 HIS 3 HE1 HIS 3 40.021 10.210 -3.160 18 HE2 HIS 3 HE2 HIS 3 40.390 11.377 -5.360 19 H MET 4 H MET 4 33.317 9.761 -5.295 20 HA MET 4 HA MET 4 31.912 9.088 -7.776 21 HB2 MET 4 HB2 MET 4 33.085 7.047 -6.802 22 HB3 MET 4 HB3 MET 4 31.980 7.181 -5.442 23 HG2 MET 4 HG2 MET 4 30.155 7.170 -7.319 24 HG3 MET 4 HG3 MET 4 31.432 6.405 -8.260 25 HE1 MET 4 HE1 MET 4 30.555 6.062 -4.364 26 HE2 MET 4 HE2 MET 4 29.446 4.697 -4.477 27 HE3 MET 4 HE3 MET 4 29.047 6.225 -5.262 28 H THR 5 H THR 5 29.897 9.794 -7.757 29 HA THR 5 HA THR 5 28.816 11.081 -5.442 30 HB THR 5 HB THR 5 26.838 10.732 -7.468 31 HG1 THR 5 HG1 THR 5 28.120 11.653 -9.229 32 HG21 THR 5 HG21 THR 5 27.068 12.687 -6.010 33 HG22 THR 5 HG22 THR 5 27.099 13.160 -7.710 34 HG23 THR 5 HG23 THR 5 28.600 13.092 -6.788 35 H GLU 6 H GLU 6 26.479 10.627 -4.819 36 HA GLU 6 HA GLU 6 26.254 8.071 -3.727 37 HB2 GLU 6 HB2 GLU 6 24.188 10.209 -4.225 38 HB3 GLU 6 HB3 GLU 6 23.810 8.708 -3.391 39 HG2 GLU 6 HG2 GLU 6 24.214 10.414 -1.769 40 HG3 GLU 6 HG3 GLU 6 25.547 9.260 -1.713 41 H GLN 7 H GLN 7 25.288 6.234 -4.321 42 HA GLN 7 HA GLN 7 24.911 5.701 -7.074 43 HB2 GLN 7 HB2 GLN 7 24.313 4.078 -4.595 44 HB3 GLN 7 HB3 GLN 7 24.158 3.453 -6.231 45 HG2 GLN 7 HG2 GLN 7 26.471 3.612 -6.620 46 HG3 GLN 7 HG3 GLN 7 26.721 4.607 -5.186 47 HE21 GLN 7 HE21 GLN 7 27.915 2.046 -6.028 48 HE22 GLN 7 HE22 GLN 7 27.643 0.951 -4.719 49 HA PRO 8 HA PRO 8 20.588 6.532 -7.575 50 HB2 PRO 8 HB2 PRO 8 19.932 4.711 -9.479 51 HB3 PRO 8 HB3 PRO 8 20.937 6.123 -9.823 52 HG2 PRO 8 HG2 PRO 8 21.764 3.296 -9.291 53 HG3 PRO 8 HG3 PRO 8 22.343 4.414 -10.541 54 HD2 PRO 8 HD2 PRO 8 23.712 3.954 -8.254 55 HD3 PRO 8 HD3 PRO 8 23.735 5.525 -9.079 56 H LYS 9 H LYS 9 18.444 5.038 -7.945 57 HA LYS 9 HA LYS 9 17.747 3.912 -5.580 58 HB2 LYS 9 HB2 LYS 9 15.927 2.738 -6.782 59 HB3 LYS 9 HB3 LYS 9 16.082 4.430 -7.229 60 HG2 LYS 9 HG2 LYS 9 17.304 3.724 -9.271 61 HG3 LYS 9 HG3 LYS 9 17.002 2.045 -8.828 62 HD2 LYS 9 HD2 LYS 9 14.525 2.687 -8.785 63 HD3 LYS 9 HD3 LYS 9 15.020 4.157 -9.628 64 HE2 LYS 9 HE2 LYS 9 15.421 1.317 -10.558 65 HE3 LYS 9 HE3 LYS 9 14.295 2.493 -11.227 66 HZ1 LYS 9 HZ1 LYS 9 16.171 2.428 -12.636 67 HZ2 LYS 9 HZ2 LYS 9 17.255 2.556 -11.345 68 HZ3 LYS 9 HZ3 LYS 9 16.288 3.876 -11.768 69 H THR 10 H THR 10 18.833 2.416 -4.510 70 HA THR 10 HA THR 10 19.900 0.087 -5.921 71 HB THR 10 HB THR 10 21.484 1.398 -4.536 72 HG1 THR 10 HG1 THR 10 21.977 -0.558 -3.058 73 HG21 THR 10 HG21 THR 10 19.531 0.723 -2.360 74 HG22 THR 10 HG22 THR 10 20.243 2.286 -2.768 75 HG23 THR 10 HG23 THR 10 21.225 1.043 -1.997 76 H ARG 11 H ARG 11 19.714 -2.022 -4.815 77 HA ARG 11 HA ARG 11 17.016 -2.338 -3.766 78 HB2 ARG 11 HB2 ARG 11 17.365 -4.754 -4.108 79 HB3 ARG 11 HB3 ARG 11 17.647 -3.838 -5.580 80 HG2 ARG 11 HG2 ARG 11 19.967 -4.141 -5.453 81 HG3 ARG 11 HG3 ARG 11 19.890 -4.651 -3.767 82 HD2 ARG 11 HD2 ARG 11 20.272 -6.572 -5.194 83 HD3 ARG 11 HD3 ARG 11 18.673 -6.677 -4.460 84 HE ARG 11 HE ARG 11 18.441 -5.435 -6.965 85 HH11 ARG 11 HH11 ARG 11 19.255 -8.561 -5.618 86 HH12 ARG 11 HH12 ARG 11 18.617 -9.451 -6.962 87 HH21 ARG 11 HH21 ARG 11 17.606 -6.592 -8.736 88 HH22 ARG 11 HH22 ARG 11 17.676 -8.324 -8.742 89 H VAL 12 H VAL 12 16.544 -3.129 -1.775 90 HA VAL 12 HA VAL 12 18.798 -3.615 0.053 91 HB VAL 12 HB VAL 12 17.906 -1.358 0.448 92 HG11 VAL 12 HG11 VAL 12 15.552 -1.276 1.500 93 HG12 VAL 12 HG12 VAL 12 15.301 -2.818 0.684 94 HG13 VAL 12 HG13 VAL 12 15.691 -1.379 -0.255 95 HG21 VAL 12 HG21 VAL 12 17.212 -3.316 2.637 96 HG22 VAL 12 HG22 VAL 12 17.441 -1.580 2.850 97 HG23 VAL 12 HG23 VAL 12 18.792 -2.592 2.342 98 H SER 13 H SER 13 18.472 -5.187 1.612 99 HA SER 13 HA SER 13 16.207 -6.961 1.116 100 HB2 SER 13 HB2 SER 13 18.466 -7.576 2.993 101 HB3 SER 13 HB3 SER 13 17.495 -8.682 2.026 102 HG SER 13 HG SER 13 19.060 -8.578 0.645 103 H VAL 14 H VAL 14 14.491 -6.920 2.433 104 HA VAL 14 HA VAL 14 14.882 -5.999 5.206 105 HB VAL 14 HB VAL 14 12.567 -5.075 5.142 106 HG11 VAL 14 HG11 VAL 14 14.573 -3.868 3.250 107 HG12 VAL 14 HG12 VAL 14 14.430 -3.571 4.982 108 HG13 VAL 14 HG13 VAL 14 13.162 -3.025 3.887 109 HG21 VAL 14 HG21 VAL 14 12.805 -5.340 2.151 110 HG22 VAL 14 HG22 VAL 14 11.456 -4.653 3.055 111 HG23 VAL 14 HG23 VAL 14 11.804 -6.380 3.163 112 H ARG 15 H ARG 15 13.609 -7.036 6.794 113 HA ARG 15 HA ARG 15 12.655 -9.665 5.920 114 HB2 ARG 15 HB2 ARG 15 14.473 -9.309 7.710 115 HB3 ARG 15 HB3 ARG 15 13.144 -8.855 8.767 116 HG2 ARG 15 HG2 ARG 15 12.130 -11.018 8.513 117 HG3 ARG 15 HG3 ARG 15 13.333 -11.483 7.312 118 HD2 ARG 15 HD2 ARG 15 15.090 -11.284 9.014 119 HD3 ARG 15 HD3 ARG 15 13.871 -10.848 10.207 120 HE ARG 15 HE ARG 15 13.438 -13.380 8.871 121 HH11 ARG 15 HH11 ARG 15 14.882 -11.753 11.620 122 HH12 ARG 15 HH12 ARG 15 14.868 -13.173 12.621 123 HH21 ARG 15 HH21 ARG 15 13.437 -15.239 10.179 124 HH22 ARG 15 HH22 ARG 15 14.040 -15.149 11.805 125 H ILE 16 H ILE 16 10.536 -9.928 5.706 126 HA ILE 16 HA ILE 16 8.719 -8.490 7.540 127 HB ILE 16 HB ILE 16 7.819 -9.333 4.806 128 HG12 ILE 16 HG12 ILE 16 8.915 -6.578 5.336 129 HG13 ILE 16 HG13 ILE 16 9.935 -7.861 4.693 130 HG21 ILE 16 HG21 ILE 16 6.984 -7.085 6.632 131 HG22 ILE 16 HG22 ILE 16 6.186 -8.653 6.501 132 HG23 ILE 16 HG23 ILE 16 6.201 -7.553 5.123 133 HD11 ILE 16 HD11 ILE 16 8.313 -8.089 2.812 134 HD12 ILE 16 HD12 ILE 16 9.164 -6.547 2.874 135 HD13 ILE 16 HD13 ILE 16 7.493 -6.654 3.423 136 H TYR 17 H TYR 17 7.445 -9.776 8.703 137 HA TYR 17 HA TYR 17 6.436 -11.607 9.548 138 HB2 TYR 17 HB2 TYR 17 5.528 -11.420 6.986 139 HB3 TYR 17 HB3 TYR 17 6.179 -13.056 6.994 140 HD1 TYR 17 HD1 TYR 17 3.944 -10.825 8.991 141 HD2 TYR 17 HD2 TYR 17 4.852 -14.797 7.771 142 HE1 TYR 17 HE1 TYR 17 1.909 -11.625 10.117 143 HE2 TYR 17 HE2 TYR 17 2.817 -15.614 8.889 144 HH TYR 17 HH TYR 17 0.338 -13.591 9.934 145 H GLY 18 H GLY 18 9.396 -11.602 8.950 146 HA2 GLY 18 HA2 GLY 18 10.893 -13.152 9.966 147 HA3 GLY 18 HA3 GLY 18 9.780 -14.445 9.562 148 H GLN 19 H GLN 19 9.769 -12.904 6.768 149 HA GLN 19 HA GLN 19 12.091 -14.430 5.791 150 HB2 GLN 19 HB2 GLN 19 9.450 -14.594 5.026 151 HB3 GLN 19 HB3 GLN 19 10.145 -13.562 3.785 152 HG2 GLN 19 HG2 GLN 19 11.169 -16.290 4.556 153 HG3 GLN 19 HG3 GLN 19 10.157 -15.930 3.158 154 HE21 GLN 19 HE21 GLN 19 11.051 -14.710 1.443 155 HE22 GLN 19 HE22 GLN 19 12.761 -14.573 1.232 156 H ASP 20 H ASP 20 13.536 -13.512 4.365 157 HA ASP 20 HA ASP 20 13.647 -10.596 4.390 158 HB2 ASP 20 HB2 ASP 20 15.658 -11.761 5.065 159 HB3 ASP 20 HB3 ASP 20 15.659 -12.702 3.579 160 H TYR 21 H TYR 21 13.325 -9.340 2.648 161 HA TYR 21 HA TYR 21 13.144 -10.624 -0.002 162 HB2 TYR 21 HB2 TYR 21 11.275 -8.472 1.015 163 HB3 TYR 21 HB3 TYR 21 11.200 -9.272 -0.551 164 HD1 TYR 21 HD2 TYR 21 10.681 -11.758 -0.599 165 HD2 TYR 21 HD1 TYR 21 10.176 -9.368 2.881 166 HE1 TYR 21 HE2 TYR 21 9.191 -13.465 0.351 167 HE2 TYR 21 HE1 TYR 21 8.683 -11.077 3.840 168 HH TYR 21 HH TYR 21 7.320 -12.893 3.205 169 H THR 22 H THR 22 14.000 -9.492 -1.677 170 HA THR 22 HA THR 22 15.492 -7.076 -1.012 171 HB THR 22 HB THR 22 16.258 -7.496 -3.512 172 HG1 THR 22 HG1 THR 22 14.793 -9.195 -3.916 173 HG21 THR 22 HG21 THR 22 17.736 -7.613 -1.571 174 HG22 THR 22 HG22 THR 22 18.054 -8.958 -2.668 175 HG23 THR 22 HG23 THR 22 17.131 -9.225 -1.190 176 H ILE 23 H ILE 23 14.574 -5.169 -1.367 177 HA ILE 23 HA ILE 23 12.784 -4.877 -3.693 178 HB ILE 23 HB ILE 23 11.506 -3.182 -2.360 179 HG12 ILE 23 HG12 ILE 23 12.965 -4.427 -0.015 180 HG13 ILE 23 HG13 ILE 23 13.269 -2.812 -0.642 181 HG21 ILE 23 HG21 ILE 23 10.718 -5.493 -2.754 182 HG22 ILE 23 HG22 ILE 23 10.122 -4.807 -1.246 183 HG23 ILE 23 HG23 ILE 23 11.445 -5.974 -1.221 184 HD11 ILE 23 HD11 ILE 23 10.859 -3.843 0.797 185 HD12 ILE 23 HD12 ILE 23 10.812 -2.352 -0.145 186 HD13 ILE 23 HD13 ILE 23 11.915 -2.497 1.223 187 H VAL 24 H VAL 24 12.540 -2.549 -4.360 188 HA VAL 24 HA VAL 24 15.163 -1.344 -4.522 189 HB VAL 24 HB VAL 24 12.550 -0.407 -5.721 190 HG11 VAL 24 HG11 VAL 24 13.969 0.911 -7.227 191 HG12 VAL 24 HG12 VAL 24 15.398 0.378 -6.338 192 HG13 VAL 24 HG13 VAL 24 14.187 1.383 -5.543 193 HG21 VAL 24 HG21 VAL 24 13.178 -2.627 -6.531 194 HG22 VAL 24 HG22 VAL 24 14.778 -2.019 -6.965 195 HG23 VAL 24 HG23 VAL 24 13.346 -1.415 -7.800 196 H GLY 25 H GLY 25 15.867 0.102 -3.073 197 HA2 GLY 25 HA2 GLY 25 13.954 1.405 -1.297 198 HA3 GLY 25 HA3 GLY 25 15.703 1.398 -1.126 199 H ALA 26 H ALA 26 13.434 2.454 -3.653 200 HA ALA 26 HA ALA 26 15.046 4.807 -4.152 201 HB1 ALA 26 HB1 ALA 26 14.090 3.612 -6.039 202 HB2 ALA 26 HB2 ALA 26 13.456 5.254 -5.959 203 HB3 ALA 26 HB3 ALA 26 12.465 3.899 -5.419 204 H GLU 27 H GLU 27 14.423 5.228 -1.699 205 HA GLU 27 HA GLU 27 12.498 7.397 -1.797 206 HB2 GLU 27 HB2 GLU 27 11.500 5.033 -0.974 207 HB3 GLU 27 HB3 GLU 27 12.155 5.595 0.552 208 HG2 GLU 27 HG2 GLU 27 10.525 7.561 -0.899 209 HG3 GLU 27 HG3 GLU 27 9.669 6.132 -0.328 210 H SER 28 H SER 28 14.261 5.528 0.692 211 HA SER 28 HA SER 28 16.205 7.503 1.185 212 HB2 SER 28 HB2 SER 28 14.150 8.660 2.121 213 HB3 SER 28 HB3 SER 28 14.050 7.366 3.312 214 HG SER 28 HG SER 28 15.953 9.404 3.032 215 HA PRO 29 HA PRO 29 17.980 3.804 2.841 216 HB2 PRO 29 HB2 PRO 29 19.865 4.977 4.481 217 HB3 PRO 29 HB3 PRO 29 20.061 4.706 2.747 218 HG2 PRO 29 HG2 PRO 29 19.247 7.188 4.200 219 HG3 PRO 29 HG3 PRO 29 20.328 7.009 2.805 220 HD2 PRO 29 HD2 PRO 29 17.807 7.863 2.516 221 HD3 PRO 29 HD3 PRO 29 18.563 6.798 1.308 222 H ALA 30 H ALA 30 16.650 6.276 4.885 223 HA ALA 30 HA ALA 30 16.775 4.559 7.240 224 HB1 ALA 30 HB1 ALA 30 15.908 6.471 8.465 225 HB2 ALA 30 HB2 ALA 30 15.673 7.354 6.956 226 HB3 ALA 30 HB3 ALA 30 17.301 6.940 7.494 227 H HIS 31 H HIS 31 14.342 6.154 5.206 228 HA HIS 31 HA HIS 31 12.050 5.311 6.531 229 HB2 HIS 31 HB2 HIS 31 12.655 6.204 3.766 230 HB3 HIS 31 HB3 HIS 31 11.122 5.389 4.027 231 HD1 HIS 31 HD1 HIS 31 9.926 7.621 3.440 232 HD2 HIS 31 HD2 HIS 31 12.307 7.786 6.847 233 HE1 HIS 31 HE1 HIS 31 9.219 9.707 4.668 234 HE2 HIS 31 HE2 HIS 31 10.542 9.680 6.812 235 H ILE 32 H ILE 32 13.941 3.665 4.059 236 HA ILE 32 HA ILE 32 12.200 1.588 3.445 237 HB ILE 32 HB ILE 32 14.148 0.300 2.705 238 HG12 ILE 32 HG12 ILE 32 15.779 2.552 3.917 239 HG13 ILE 32 HG13 ILE 32 15.700 0.907 4.528 240 HG21 ILE 32 HG21 ILE 32 14.422 3.196 1.929 241 HG22 ILE 32 HG22 ILE 32 13.122 2.145 1.368 242 HG23 ILE 32 HG23 ILE 32 14.793 1.774 0.951 243 HD11 ILE 32 HD11 ILE 32 17.717 1.087 3.345 244 HD12 ILE 32 HD12 ILE 32 16.941 1.883 1.976 245 HD13 ILE 32 HD13 ILE 32 16.628 0.178 2.301 246 H ARG 33 H ARG 33 13.892 2.072 6.395 247 HA ARG 33 HA ARG 33 13.923 -0.731 7.105 248 HB2 ARG 33 HB2 ARG 33 14.726 1.795 8.493 249 HB3 ARG 33 HB3 ARG 33 14.527 0.312 9.418 250 HG2 ARG 33 HG2 ARG 33 16.585 -0.278 8.855 251 HG3 ARG 33 HG3 ARG 33 16.079 -0.345 7.166 252 HD2 ARG 33 HD2 ARG 33 17.995 1.115 7.405 253 HD3 ARG 33 HD3 ARG 33 16.576 2.047 6.937 254 HE ARG 33 HE ARG 33 16.632 2.166 9.670 255 HH11 ARG 33 HH11 ARG 33 18.830 3.059 7.092 256 HH12 ARG 33 HH12 ARG 33 19.543 4.363 7.989 257 HH21 ARG 33 HH21 ARG 33 17.554 3.872 10.841 258 HH22 ARG 33 HH22 ARG 33 18.817 4.827 10.130 259 H LEU 34 H LEU 34 11.712 1.916 7.417 260 HA LEU 34 HA LEU 34 10.222 0.485 9.493 261 HB2 LEU 34 HB2 LEU 34 8.946 2.469 9.830 262 HB3 LEU 34 HB3 LEU 34 10.637 2.916 9.772 263 HG LEU 34 HG LEU 34 9.937 3.333 7.185 264 HD11 LEU 34 HD11 LEU 34 7.579 2.784 7.647 265 HD12 LEU 34 HD12 LEU 34 7.793 4.452 7.118 266 HD13 LEU 34 HD13 LEU 34 7.524 4.098 8.825 267 HD21 LEU 34 HD21 LEU 34 9.909 5.688 7.750 268 HD22 LEU 34 HD22 LEU 34 11.142 4.856 8.699 269 HD23 LEU 34 HD23 LEU 34 9.607 5.302 9.441 270 H VAL 35 H VAL 35 10.257 0.916 6.128 271 HA VAL 35 HA VAL 35 7.540 0.784 5.472 272 HB VAL 35 HB VAL 35 9.806 -0.469 3.907 273 HG11 VAL 35 HG11 VAL 35 7.146 0.584 2.962 274 HG12 VAL 35 HG12 VAL 35 7.522 -1.121 3.214 275 HG13 VAL 35 HG13 VAL 35 8.384 -0.201 1.982 276 HG21 VAL 35 HG21 VAL 35 10.230 1.904 4.460 277 HG22 VAL 35 HG22 VAL 35 8.700 2.328 3.692 278 HG23 VAL 35 HG23 VAL 35 10.004 1.630 2.732 279 H ALA 36 H ALA 36 9.897 -1.829 5.928 280 HA ALA 36 HA ALA 36 8.094 -3.951 5.443 281 HB1 ALA 36 HB1 ALA 36 10.727 -3.827 6.890 282 HB2 ALA 36 HB2 ALA 36 10.411 -4.390 5.249 283 HB3 ALA 36 HB3 ALA 36 9.840 -5.327 6.628 284 H ALA 37 H ALA 37 9.005 -2.193 8.350 285 HA ALA 37 HA ALA 37 7.806 -3.924 10.230 286 HB1 ALA 37 HB1 ALA 37 8.305 -0.953 10.438 287 HB2 ALA 37 HB2 ALA 37 9.450 -2.226 10.860 288 HB3 ALA 37 HB3 ALA 37 7.960 -2.040 11.782 289 H PHE 38 H PHE 38 6.569 -1.356 8.218 290 HA PHE 38 HA PHE 38 4.079 -1.030 9.538 291 HB2 PHE 38 HB2 PHE 38 4.970 0.679 8.035 292 HB3 PHE 38 HB3 PHE 38 4.879 -0.438 6.679 293 HD1 PHE 38 HD2 PHE 38 2.450 0.483 9.372 294 HD2 PHE 38 HD1 PHE 38 3.292 0.286 5.203 295 HE1 PHE 38 HE2 PHE 38 0.175 1.275 8.876 296 HE2 PHE 38 HE1 PHE 38 1.024 1.081 4.706 297 HZ PHE 38 HZ PHE 38 -0.541 1.579 6.542 298 H VAL 39 H VAL 39 5.158 -3.026 6.834 299 HA VAL 39 HA VAL 39 2.600 -4.093 6.216 300 HB VAL 39 HB VAL 39 5.314 -5.302 5.639 301 HG11 VAL 39 HG11 VAL 39 4.137 -6.482 3.824 302 HG12 VAL 39 HG12 VAL 39 2.610 -5.823 4.411 303 HG13 VAL 39 HG13 VAL 39 3.534 -6.937 5.420 304 HG21 VAL 39 HG21 VAL 39 4.849 -4.313 3.343 305 HG22 VAL 39 HG22 VAL 39 5.320 -3.187 4.614 306 HG23 VAL 39 HG23 VAL 39 3.627 -3.322 4.138 307 H ASP 40 H ASP 40 5.303 -5.216 8.216 308 HA ASP 40 HA ASP 40 4.287 -7.730 8.909 309 HB2 ASP 40 HB2 ASP 40 6.620 -6.716 9.375 310 HB3 ASP 40 HB3 ASP 40 5.884 -6.032 10.820 311 H ASP 41 H ASP 41 3.883 -4.573 10.430 312 HA ASP 41 HA ASP 41 2.356 -5.332 12.647 313 HB2 ASP 41 HB2 ASP 41 2.923 -3.128 12.884 314 HB3 ASP 41 HB3 ASP 41 2.822 -2.805 11.159 315 H LYS 42 H LYS 42 1.335 -4.312 9.416 316 HA LYS 42 HA LYS 42 -1.425 -4.489 9.849 317 HB2 LYS 42 HB2 LYS 42 0.162 -4.786 7.294 318 HB3 LYS 42 HB3 LYS 42 -1.586 -4.621 7.361 319 HG2 LYS 42 HG2 LYS 42 -0.029 -2.540 8.759 320 HG3 LYS 42 HG3 LYS 42 0.093 -2.558 7.001 321 HD2 LYS 42 HD2 LYS 42 -1.692 -1.074 7.674 322 HD3 LYS 42 HD3 LYS 42 -2.375 -2.481 6.863 323 HE2 LYS 42 HE2 LYS 42 -3.683 -1.893 8.824 324 HE3 LYS 42 HE3 LYS 42 -2.923 -3.470 9.031 325 HZ1 LYS 42 HZ1 LYS 42 -1.130 -2.258 10.302 326 HZ2 LYS 42 HZ2 LYS 42 -2.651 -2.210 11.051 327 HZ3 LYS 42 HZ3 LYS 42 -2.138 -0.895 10.277 328 H MET 43 H MET 43 0.837 -6.869 8.460 329 HA MET 43 HA MET 43 -1.103 -8.856 7.987 330 HB2 MET 43 HB2 MET 43 1.875 -9.038 8.427 331 HB3 MET 43 HB3 MET 43 0.882 -10.426 8.008 332 HG2 MET 43 HG2 MET 43 0.167 -9.202 5.959 333 HG3 MET 43 HG3 MET 43 1.347 -7.956 6.365 334 HE1 MET 43 HE1 MET 43 0.717 -11.609 5.295 335 HE2 MET 43 HE2 MET 43 1.662 -11.932 6.749 336 HE3 MET 43 HE3 MET 43 2.334 -12.291 5.158 337 H HIS 44 H HIS 44 0.912 -8.155 10.782 338 HA HIS 44 HA HIS 44 0.446 -10.450 12.284 339 HB2 HIS 44 HB2 HIS 44 2.026 -8.451 12.733 340 HB3 HIS 44 HB3 HIS 44 0.644 -7.727 13.547 341 HD1 HIS 44 HD1 HIS 44 3.296 -10.258 13.958 342 HD2 HIS 44 HD2 HIS 44 -0.179 -9.098 15.917 343 HE1 HIS 44 HE1 HIS 44 3.419 -11.318 16.230 344 HE2 HIS 44 HE2 HIS 44 1.395 -10.453 17.454 345 H GLU 45 H GLU 45 -1.349 -7.369 12.379 346 HA GLU 45 HA GLU 45 -3.308 -8.503 14.165 347 HB2 GLU 45 HB2 GLU 45 -4.332 -6.310 14.158 348 HB3 GLU 45 HB3 GLU 45 -2.597 -6.175 14.397 349 HG2 GLU 45 HG2 GLU 45 -2.256 -5.384 12.189 350 HG3 GLU 45 HG3 GLU 45 -3.901 -5.805 11.712 351 H PHE 46 H PHE 46 -2.909 -8.670 10.859 352 HA PHE 46 HA PHE 46 -5.781 -8.690 10.335 353 HB2 PHE 46 HB2 PHE 46 -3.379 -8.349 8.674 354 HB3 PHE 46 HB3 PHE 46 -4.659 -9.306 7.940 355 HD1 PHE 46 HD1 PHE 46 -5.291 -6.566 10.316 356 HD2 PHE 46 HD2 PHE 46 -5.203 -7.737 6.221 357 HE1 PHE 46 HE1 PHE 46 -6.495 -4.516 9.708 358 HE2 PHE 46 HE2 PHE 46 -6.415 -5.683 5.610 359 HZ PHE 46 HZ PHE 46 -7.057 -4.071 7.361 360 H SER 47 H SER 47 -3.099 -10.844 10.729 361 HA SER 47 HA SER 47 -4.153 -13.116 9.426 362 HB2 SER 47 HB2 SER 47 -2.249 -12.982 11.778 363 HB3 SER 47 HB3 SER 47 -2.522 -14.396 10.762 364 HG SER 47 HG SER 47 -1.582 -11.890 9.801 365 H GLU 48 H GLU 48 -4.909 -11.621 12.442 366 HA GLU 48 HA GLU 48 -6.059 -13.964 13.628 367 HB2 GLU 48 HB2 GLU 48 -6.762 -12.519 15.423 368 HB3 GLU 48 HB3 GLU 48 -5.099 -12.146 14.999 369 HG2 GLU 48 HG2 GLU 48 -5.652 -10.102 14.081 370 HG3 GLU 48 HG3 GLU 48 -7.331 -10.569 13.798 371 H LYS 49 H LYS 49 -7.110 -11.739 11.290 372 HA LYS 49 HA LYS 49 -9.925 -11.909 11.960 373 HB2 LYS 49 HB2 LYS 49 -8.808 -10.939 9.334 374 HB3 LYS 49 HB3 LYS 49 -10.343 -10.524 10.077 375 HG2 LYS 49 HG2 LYS 49 -7.603 -9.633 10.940 376 HG3 LYS 49 HG3 LYS 49 -8.880 -8.645 10.239 377 HD2 LYS 49 HD2 LYS 49 -9.147 -10.085 12.873 378 HD3 LYS 49 HD3 LYS 49 -8.580 -8.425 12.729 379 HE2 LYS 49 HE2 LYS 49 -10.726 -7.894 11.540 380 HE3 LYS 49 HE3 LYS 49 -11.284 -9.513 11.959 381 HZ1 LYS 49 HZ1 LYS 49 -10.561 -7.324 13.828 382 HZ2 LYS 49 HZ2 LYS 49 -10.880 -8.908 14.323 383 HZ3 LYS 49 HZ3 LYS 49 -12.094 -7.996 13.583 384 H GLN 50 H GLN 50 -7.651 -13.787 10.389 385 HA GLN 50 HA GLN 50 -7.678 -15.466 8.838 386 HB2 GLN 50 HB2 GLN 50 -9.151 -17.345 9.597 387 HB3 GLN 50 HB3 GLN 50 -8.122 -16.653 10.841 388 HG2 GLN 50 HG2 GLN 50 -10.219 -15.239 11.424 389 HG3 GLN 50 HG3 GLN 50 -11.081 -16.480 10.517 390 HE21 GLN 50 HE21 GLN 50 -11.211 -15.824 13.348 391 HE22 GLN 50 HE22 GLN 50 -10.795 -17.274 14.194 392 HA PRO 51 HA PRO 51 -11.178 -13.746 6.238 393 HB2 PRO 51 HB2 PRO 51 -9.525 -13.597 4.004 394 HB3 PRO 51 HB3 PRO 51 -9.932 -12.254 5.074 395 HG2 PRO 51 HG2 PRO 51 -7.475 -13.937 4.991 396 HG3 PRO 51 HG3 PRO 51 -7.655 -12.228 5.405 397 HD2 PRO 51 HD2 PRO 51 -7.265 -14.150 7.266 398 HD3 PRO 51 HD3 PRO 51 -8.206 -12.680 7.591 399 H MET 52 H MET 52 -8.611 -15.731 4.745 400 HA MET 52 HA MET 52 -10.690 -17.656 3.940 401 HB2 MET 52 HB2 MET 52 -8.074 -17.212 2.503 402 HB3 MET 52 HB3 MET 52 -9.475 -18.105 1.934 403 HG2 MET 52 HG2 MET 52 -9.239 -15.123 2.270 404 HG3 MET 52 HG3 MET 52 -9.324 -16.024 0.759 405 HE1 MET 52 HE1 MET 52 -11.595 -18.202 1.492 406 HE2 MET 52 HE2 MET 52 -11.464 -17.346 -0.043 407 HE3 MET 52 HE3 MET 52 -12.999 -17.369 0.825 408 H LEU 53 H LEU 53 -8.482 -17.301 6.192 409 HA LEU 53 HA LEU 53 -7.147 -18.624 7.459 410 HB2 LEU 53 HB2 LEU 53 -8.973 -20.642 6.190 411 HB3 LEU 53 HB3 LEU 53 -7.694 -21.146 7.280 412 HG LEU 53 HG LEU 53 -9.729 -19.103 8.126 413 HD11 LEU 53 HD11 LEU 53 -9.974 -22.101 8.127 414 HD12 LEU 53 HD12 LEU 53 -11.098 -20.911 7.464 415 HD13 LEU 53 HD13 LEU 53 -10.901 -21.064 9.211 416 HD21 LEU 53 HD21 LEU 53 -9.138 -19.906 10.351 417 HD22 LEU 53 HD22 LEU 53 -7.700 -19.373 9.482 418 HD23 LEU 53 HD23 LEU 53 -8.045 -21.095 9.647 419 H ASP 54 H ASP 54 -6.075 -17.781 5.010 420 HA ASP 54 HA ASP 54 -4.123 -19.908 4.536 421 HB2 ASP 54 HB2 ASP 54 -5.850 -20.001 2.726 422 HB3 ASP 54 HB3 ASP 54 -5.422 -18.350 2.294 423 H VAL 55 H VAL 55 -2.069 -19.172 4.145 424 HA VAL 55 HA VAL 55 -1.414 -16.613 5.104 425 HB VAL 55 HB VAL 55 0.356 -18.518 3.574 426 HG11 VAL 55 HG11 VAL 55 1.084 -16.237 5.408 427 HG12 VAL 55 HG12 VAL 55 1.246 -16.235 3.651 428 HG13 VAL 55 HG13 VAL 55 2.212 -17.345 4.627 429 HG21 VAL 55 HG21 VAL 55 1.105 -19.254 5.789 430 HG22 VAL 55 HG22 VAL 55 -0.619 -19.548 5.559 431 HG23 VAL 55 HG23 VAL 55 -0.080 -18.187 6.543 432 HA PRO 56 HA PRO 56 -0.122 -15.349 0.578 433 HB2 PRO 56 HB2 PRO 56 -1.511 -16.745 -1.388 434 HB3 PRO 56 HB3 PRO 56 0.188 -16.975 -0.965 435 HG2 PRO 56 HG2 PRO 56 -2.199 -18.562 -0.169 436 HG3 PRO 56 HG3 PRO 56 -0.541 -19.102 -0.491 437 HD2 PRO 56 HD2 PRO 56 -1.529 -18.883 2.015 438 HD3 PRO 56 HD3 PRO 56 0.176 -18.575 1.636 439 H LYS 57 H LYS 57 -3.365 -16.603 1.207 440 HA LYS 57 HA LYS 57 -4.687 -14.568 -0.306 441 HB2 LYS 57 HB2 LYS 57 -5.859 -16.263 1.900 442 HB3 LYS 57 HB3 LYS 57 -6.742 -15.402 0.652 443 HG2 LYS 57 HG2 LYS 57 -5.079 -17.881 0.408 444 HG3 LYS 57 HG3 LYS 57 -6.772 -17.640 -0.013 445 HD2 LYS 57 HD2 LYS 57 -6.003 -16.083 -1.824 446 HD3 LYS 57 HD3 LYS 57 -4.349 -16.578 -1.460 447 HE2 LYS 57 HE2 LYS 57 -6.601 -18.342 -2.401 448 HE3 LYS 57 HE3 LYS 57 -5.180 -17.866 -3.322 449 HZ1 LYS 57 HZ1 LYS 57 -3.962 -19.456 -2.375 450 HZ2 LYS 57 HZ2 LYS 57 -5.423 -20.135 -1.870 451 HZ3 LYS 57 HZ3 LYS 57 -4.546 -19.141 -0.817 452 H LEU 58 H LEU 58 -3.455 -14.825 2.904 453 HA LEU 58 HA LEU 58 -4.957 -12.621 3.979 454 HB2 LEU 58 HB2 LEU 58 -4.105 -14.535 5.341 455 HB3 LEU 58 HB3 LEU 58 -2.472 -14.000 5.032 456 HG LEU 58 HG LEU 58 -3.509 -13.482 7.312 457 HD11 LEU 58 HD11 LEU 58 -2.289 -11.219 5.749 458 HD12 LEU 58 HD12 LEU 58 -1.410 -12.521 6.550 459 HD13 LEU 58 HD13 LEU 58 -2.343 -11.369 7.506 460 HD21 LEU 58 HD21 LEU 58 -5.651 -12.606 6.304 461 HD22 LEU 58 HD22 LEU 58 -4.747 -11.149 5.879 462 HD23 LEU 58 HD23 LEU 58 -4.917 -11.625 7.567 463 H ALA 59 H ALA 59 -1.797 -13.174 2.587 464 HA ALA 59 HA ALA 59 -0.623 -10.689 3.208 465 HB1 ALA 59 HB1 ALA 59 1.001 -11.260 1.436 466 HB2 ALA 59 HB2 ALA 59 -0.008 -12.640 0.998 467 HB3 ALA 59 HB3 ALA 59 0.739 -12.564 2.596 468 H VAL 60 H VAL 60 -2.650 -11.698 0.497 469 HA VAL 60 HA VAL 60 -2.153 -9.264 -0.966 470 HB VAL 60 HB VAL 60 -3.928 -9.951 -2.500 471 HG11 VAL 60 HG11 VAL 60 -1.654 -10.872 -2.759 472 HG12 VAL 60 HG12 VAL 60 -2.905 -11.944 -3.384 473 HG13 VAL 60 HG13 VAL 60 -2.146 -12.289 -1.833 474 HG21 VAL 60 HG21 VAL 60 -4.343 -12.456 -0.910 475 HG22 VAL 60 HG22 VAL 60 -5.326 -11.791 -2.210 476 HG23 VAL 60 HG23 VAL 60 -5.314 -11.014 -0.627 477 H LEU 61 H LEU 61 -4.386 -10.330 1.448 478 HA LEU 61 HA LEU 61 -6.400 -8.368 1.010 479 HB2 LEU 61 HB2 LEU 61 -6.624 -10.524 2.330 480 HB3 LEU 61 HB3 LEU 61 -5.766 -9.713 3.629 481 HG LEU 61 HG LEU 61 -7.680 -7.901 3.270 482 HD11 LEU 61 HD11 LEU 61 -8.694 -9.084 1.383 483 HD12 LEU 61 HD12 LEU 61 -9.809 -8.950 2.744 484 HD13 LEU 61 HD13 LEU 61 -8.990 -10.479 2.420 485 HD21 LEU 61 HD21 LEU 61 -8.089 -10.479 4.770 486 HD22 LEU 61 HD22 LEU 61 -8.921 -8.956 5.073 487 HD23 LEU 61 HD23 LEU 61 -7.186 -9.083 5.356 488 H THR 62 H THR 62 -3.422 -8.475 2.848 489 HA THR 62 HA THR 62 -3.912 -6.079 4.318 490 HB THR 62 HB THR 62 -1.152 -6.414 4.180 491 HG1 THR 62 HG1 THR 62 -2.373 -8.982 4.388 492 HG21 THR 62 HG21 THR 62 -2.976 -7.729 6.181 493 HG22 THR 62 HG22 THR 62 -2.601 -6.006 6.184 494 HG23 THR 62 HG23 THR 62 -1.318 -7.188 6.431 495 H ALA 63 H ALA 63 -2.159 -6.897 1.367 496 HA ALA 63 HA ALA 63 -0.976 -4.419 0.850 497 HB1 ALA 63 HB1 ALA 63 -0.633 -5.199 -1.375 498 HB2 ALA 63 HB2 ALA 63 -1.962 -6.349 -1.241 499 HB3 ALA 63 HB3 ALA 63 -0.491 -6.593 -0.304 500 H VAL 64 H VAL 64 -4.115 -5.709 -0.197 501 HA VAL 64 HA VAL 64 -4.814 -3.410 -1.709 502 HB VAL 64 HB VAL 64 -5.770 -5.726 -1.996 503 HG11 VAL 64 HG11 VAL 64 -7.485 -4.892 0.335 504 HG12 VAL 64 HG12 VAL 64 -6.304 -6.201 0.321 505 HG13 VAL 64 HG13 VAL 64 -7.749 -6.306 -0.685 506 HG21 VAL 64 HG21 VAL 64 -6.672 -3.809 -3.171 507 HG22 VAL 64 HG22 VAL 64 -7.697 -3.419 -1.793 508 HG23 VAL 64 HG23 VAL 64 -7.968 -4.905 -2.702 509 H GLN 65 H GLN 65 -5.157 -4.234 1.659 510 HA GLN 65 HA GLN 65 -7.121 -2.265 2.262 511 HB2 GLN 65 HB2 GLN 65 -6.258 -4.344 3.648 512 HB3 GLN 65 HB3 GLN 65 -5.120 -3.167 4.293 513 HG2 GLN 65 HG2 GLN 65 -8.006 -2.440 4.282 514 HG3 GLN 65 HG3 GLN 65 -7.452 -3.625 5.464 515 HE21 GLN 65 HE21 GLN 65 -7.373 -0.310 4.485 516 HE22 GLN 65 HE22 GLN 65 -6.563 0.296 5.883 517 H ILE 66 H ILE 66 -3.594 -2.375 2.457 518 HA ILE 66 HA ILE 66 -3.147 0.160 3.547 519 HB ILE 66 HB ILE 66 -1.436 -1.483 1.671 520 HG12 ILE 66 HG12 ILE 66 -1.070 -0.988 4.627 521 HG13 ILE 66 HG13 ILE 66 -2.009 -2.341 4.006 522 HG21 ILE 66 HG21 ILE 66 -0.719 1.016 3.197 523 HG22 ILE 66 HG22 ILE 66 -0.790 0.834 1.445 524 HG23 ILE 66 HG23 ILE 66 0.436 -0.030 2.372 525 HD11 ILE 66 HD11 ILE 66 0.054 -3.026 2.735 526 HD12 ILE 66 HD12 ILE 66 0.135 -3.174 4.491 527 HD13 ILE 66 HD13 ILE 66 0.929 -1.823 3.683 528 H ALA 67 H ALA 67 -3.366 -0.882 0.163 529 HA ALA 67 HA ALA 67 -2.835 1.611 -1.015 530 HB1 ALA 67 HB1 ALA 67 -3.846 0.666 -3.038 531 HB2 ALA 67 HB2 ALA 67 -4.477 -0.681 -2.087 532 HB3 ALA 67 HB3 ALA 67 -2.734 -0.469 -2.270 533 H SER 68 H SER 68 -5.843 0.148 0.113 534 HA SER 68 HA SER 68 -7.605 2.032 -1.019 535 HB2 SER 68 HB2 SER 68 -8.045 -0.298 0.146 536 HB3 SER 68 HB3 SER 68 -8.265 0.706 1.579 537 HG SER 68 HG SER 68 -9.679 1.955 -0.069 538 H GLU 69 H GLU 69 -6.108 1.894 2.219 539 HA GLU 69 HA GLU 69 -7.364 4.315 3.077 540 HB2 GLU 69 HB2 GLU 69 -5.313 2.475 4.211 541 HB3 GLU 69 HB3 GLU 69 -5.452 4.093 4.886 542 HG2 GLU 69 HG2 GLU 69 -7.708 2.115 4.659 543 HG3 GLU 69 HG3 GLU 69 -6.770 2.425 6.119 544 H TYR 70 H TYR 70 -4.590 3.648 1.194 545 HA TYR 70 HA TYR 70 -3.398 6.227 1.828 546 HB2 TYR 70 HB2 TYR 70 -2.391 3.727 0.867 547 HB3 TYR 70 HB3 TYR 70 -1.983 4.991 -0.289 548 HD1 TYR 70 HD1 TYR 70 -1.296 7.289 1.074 549 HD2 TYR 70 HD2 TYR 70 -0.685 3.287 2.380 550 HE1 TYR 70 HE1 TYR 70 0.530 8.048 2.524 551 HE2 TYR 70 HE2 TYR 70 1.143 4.037 3.835 552 HH TYR 70 HH TYR 70 2.654 5.836 4.093 553 H LEU 71 H LEU 71 -5.439 4.804 -0.548 554 HA LEU 71 HA LEU 71 -4.868 6.609 -2.669 555 HB2 LEU 71 HB2 LEU 71 -7.077 4.699 -2.055 556 HB3 LEU 71 HB3 LEU 71 -7.336 5.896 -3.306 557 HG LEU 71 HG LEU 71 -5.056 3.906 -3.299 558 HD11 LEU 71 HD11 LEU 71 -6.293 2.794 -5.132 559 HD12 LEU 71 HD12 LEU 71 -7.682 3.818 -4.774 560 HD13 LEU 71 HD13 LEU 71 -7.095 2.674 -3.568 561 HD21 LEU 71 HD21 LEU 71 -5.100 4.578 -5.793 562 HD22 LEU 71 HD22 LEU 71 -4.317 5.645 -4.635 563 HD23 LEU 71 HD23 LEU 71 -5.937 6.021 -5.226 564 H LYS 72 H LYS 72 -6.840 6.768 0.176 565 HA LYS 72 HA LYS 72 -8.374 9.035 -0.713 566 HB2 LYS 72 HB2 LYS 72 -9.342 9.037 1.484 567 HB3 LYS 72 HB3 LYS 72 -9.210 7.368 0.953 568 HG2 LYS 72 HG2 LYS 72 -6.908 7.547 2.274 569 HG3 LYS 72 HG3 LYS 72 -7.817 8.782 3.147 570 HD2 LYS 72 HD2 LYS 72 -8.693 5.922 2.718 571 HD3 LYS 72 HD3 LYS 72 -7.997 6.567 4.205 572 HE2 LYS 72 HE2 LYS 72 -9.900 8.168 4.325 573 HE3 LYS 72 HE3 LYS 72 -10.609 7.359 2.927 574 HZ1 LYS 72 HZ1 LYS 72 -11.538 5.939 4.328 575 HZ2 LYS 72 HZ2 LYS 72 -10.717 6.609 5.647 576 HZ3 LYS 72 HZ3 LYS 72 -9.997 5.364 4.752 577 H LEU 73 H LEU 73 -5.268 8.549 0.566 578 HA LEU 73 HA LEU 73 -4.999 11.041 1.933 579 HB2 LEU 73 HB2 LEU 73 -3.631 8.989 2.395 580 HB3 LEU 73 HB3 LEU 73 -2.834 9.222 0.855 581 HG LEU 73 HG LEU 73 -1.625 9.962 2.995 582 HD11 LEU 73 HD11 LEU 73 -1.901 11.801 0.634 583 HD12 LEU 73 HD12 LEU 73 -0.743 10.486 0.845 584 HD13 LEU 73 HD13 LEU 73 -0.636 11.927 1.857 585 HD21 LEU 73 HD21 LEU 73 -3.606 11.197 3.910 586 HD22 LEU 73 HD22 LEU 73 -3.323 12.425 2.676 587 HD23 LEU 73 HD23 LEU 73 -2.095 12.102 3.896 588 H LYS 74 H LYS 74 -4.045 9.822 -1.261 589 HA LYS 74 HA LYS 74 -2.884 12.299 -2.076 590 HB2 LYS 74 HB2 LYS 74 -2.925 11.303 -4.366 591 HB3 LYS 74 HB3 LYS 74 -2.124 10.299 -3.167 592 HG2 LYS 74 HG2 LYS 74 -3.719 8.676 -3.255 593 HG3 LYS 74 HG3 LYS 74 -5.005 9.805 -3.682 594 HD2 LYS 74 HD2 LYS 74 -4.572 8.410 -5.581 595 HD3 LYS 74 HD3 LYS 74 -3.963 10.029 -5.940 596 HE2 LYS 74 HE2 LYS 74 -1.704 9.323 -5.443 597 HE3 LYS 74 HE3 LYS 74 -2.277 7.729 -4.954 598 HZ1 LYS 74 HZ1 LYS 74 -3.060 7.377 -7.225 599 HZ2 LYS 74 HZ2 LYS 74 -1.399 7.671 -7.187 600 HZ3 LYS 74 HZ3 LYS 74 -2.458 8.888 -7.679 601 H GLU 75 H GLU 75 -6.068 11.017 -2.007 602 HA GLU 75 HA GLU 75 -7.231 12.685 -3.988 603 HB2 GLU 75 HB2 GLU 75 -8.228 10.555 -3.169 604 HB3 GLU 75 HB3 GLU 75 -8.564 11.339 -1.632 605 HG2 GLU 75 HG2 GLU 75 -10.561 11.295 -2.948 606 HG3 GLU 75 HG3 GLU 75 -10.003 12.962 -2.811 607 H GLU 76 H GLU 76 -6.990 12.908 -0.430 608 HA GLU 76 HA GLU 76 -8.485 15.292 -0.212 609 HB2 GLU 76 HB2 GLU 76 -7.815 15.379 2.041 610 HB3 GLU 76 HB3 GLU 76 -7.862 13.667 1.658 611 HG2 GLU 76 HG2 GLU 76 -5.816 13.501 2.464 612 HG3 GLU 76 HG3 GLU 76 -5.248 14.467 1.104 613 H TYR 77 H TYR 77 -5.117 14.659 -0.895 614 HA TYR 77 HA TYR 77 -4.103 17.252 -0.497 615 HB2 TYR 77 HB2 TYR 77 -2.597 15.369 -0.712 616 HB3 TYR 77 HB3 TYR 77 -3.206 15.007 -2.321 617 HD1 TYR 77 HD2 TYR 77 -2.377 18.424 -1.154 618 HD2 TYR 77 HD1 TYR 77 -1.107 15.068 -3.439 619 HE1 TYR 77 HE2 TYR 77 -0.573 19.778 -2.123 620 HE2 TYR 77 HE1 TYR 77 0.705 16.416 -4.416 621 HH TYR 77 HH TYR 77 1.600 19.463 -3.209 622 H GLN 78 H GLN 78 -5.383 15.639 -3.389 623 HA GLN 78 HA GLN 78 -5.052 17.864 -5.113 624 HB2 GLN 78 HB2 GLN 78 -6.813 15.417 -5.264 625 HB3 GLN 78 HB3 GLN 78 -6.736 16.615 -6.546 626 HG2 GLN 78 HG2 GLN 78 -4.240 15.317 -5.548 627 HG3 GLN 78 HG3 GLN 78 -5.283 14.487 -6.701 628 HE21 GLN 78 HE21 GLN 78 -3.818 14.538 -8.358 629 HE22 GLN 78 HE22 GLN 78 -3.358 15.994 -9.171 630 H ARG 79 H ARG 79 -7.591 16.817 -2.963 631 HA ARG 79 HA ARG 79 -9.637 18.546 -3.917 632 HB2 ARG 79 HB2 ARG 79 -9.954 16.471 -2.520 633 HB3 ARG 79 HB3 ARG 79 -9.351 17.381 -1.143 634 HG2 ARG 79 HG2 ARG 79 -11.594 17.626 -0.838 635 HG3 ARG 79 HG3 ARG 79 -11.262 19.051 -1.822 636 HD2 ARG 79 HD2 ARG 79 -11.836 16.647 -3.381 637 HD3 ARG 79 HD3 ARG 79 -13.174 17.162 -2.354 638 HE ARG 79 HE ARG 79 -11.998 18.644 -4.594 639 HH11 ARG 79 HH11 ARG 79 -14.327 18.510 -1.978 640 HH12 ARG 79 HH12 ARG 79 -15.296 19.802 -2.605 641 HH21 ARG 79 HH21 ARG 79 -13.279 20.346 -5.431 642 HH22 ARG 79 HH22 ARG 79 -14.711 20.836 -4.572 643 H LEU 80 H LEU 80 -7.122 18.824 -1.495 644 HA LEU 80 HA LEU 80 -8.062 21.327 -0.463 645 HB2 LEU 80 HB2 LEU 80 -6.831 20.031 1.056 646 HB3 LEU 80 HB3 LEU 80 -5.578 19.684 -0.114 647 HG LEU 80 HG LEU 80 -5.596 22.494 0.268 648 HD11 LEU 80 HD11 LEU 80 -6.784 22.087 2.369 649 HD12 LEU 80 HD12 LEU 80 -5.149 22.686 2.642 650 HD13 LEU 80 HD13 LEU 80 -5.507 20.975 2.868 651 HD21 LEU 80 HD21 LEU 80 -3.666 20.372 1.212 652 HD22 LEU 80 HD22 LEU 80 -3.324 22.096 1.075 653 HD23 LEU 80 HD23 LEU 80 -3.666 21.149 -0.374 654 H ARG 81 H ARG 81 -5.626 20.283 -2.782 655 HA ARG 81 HA ARG 81 -4.478 22.849 -3.163 656 HB2 ARG 81 HB2 ARG 81 -4.192 20.199 -4.406 657 HB3 ARG 81 HB3 ARG 81 -3.888 21.551 -5.485 658 HG2 ARG 81 HG2 ARG 81 -2.609 21.767 -2.850 659 HG3 ARG 81 HG3 ARG 81 -2.034 20.441 -3.857 660 HD2 ARG 81 HD2 ARG 81 -0.800 22.632 -4.102 661 HD3 ARG 81 HD3 ARG 81 -1.392 21.910 -5.596 662 HE ARG 81 HE ARG 81 -3.288 23.753 -4.571 663 HH11 ARG 81 HH11 ARG 81 -0.173 23.634 -6.141 664 HH12 ARG 81 HH12 ARG 81 -0.378 25.146 -6.968 665 HH21 ARG 81 HH21 ARG 81 -3.569 25.766 -5.651 666 HH22 ARG 81 HH22 ARG 81 -2.315 26.350 -6.695 667 H GLU 82 H GLU 82 -7.201 21.228 -4.699 668 HA GLU 82 HA GLU 82 -7.355 23.016 -6.904 669 HB2 GLU 82 HB2 GLU 82 -9.558 22.093 -7.321 670 HB3 GLU 82 HB3 GLU 82 -8.439 20.797 -6.926 671 HG2 GLU 82 HG2 GLU 82 -9.342 20.608 -4.721 672 HG3 GLU 82 HG3 GLU 82 -10.348 22.035 -4.962 673 H GLN 83 H GLN 83 -8.462 23.158 -3.624 674 HA GLN 83 HA GLN 83 -10.241 25.381 -4.086 675 HB2 GLN 83 HB2 GLN 83 -9.494 23.697 -1.801 676 HB3 GLN 83 HB3 GLN 83 -9.718 25.388 -1.381 677 HG2 GLN 83 HG2 GLN 83 -11.754 24.029 -1.118 678 HG3 GLN 83 HG3 GLN 83 -11.951 25.379 -2.228 679 HE21 GLN 83 HE21 GLN 83 -11.605 21.917 -1.964 680 HE22 GLN 83 HE22 GLN 83 -12.252 21.543 -3.522 681 H LEU 84 H LEU 84 -6.919 24.885 -3.455 682 HA LEU 84 HA LEU 84 -6.474 27.659 -2.663 683 HB2 LEU 84 HB2 LEU 84 -5.051 25.142 -2.324 684 HB3 LEU 84 HB3 LEU 84 -3.993 26.400 -2.920 685 HG LEU 84 HG LEU 84 -3.865 26.288 -0.510 686 HD11 LEU 84 HD11 LEU 84 -4.040 28.548 -0.030 687 HD12 LEU 84 HD12 LEU 84 -5.473 28.759 -1.030 688 HD13 LEU 84 HD13 LEU 84 -3.897 28.530 -1.786 689 HD21 LEU 84 HD21 LEU 84 -5.813 26.780 0.903 690 HD22 LEU 84 HD22 LEU 84 -6.027 25.299 -0.030 691 HD23 LEU 84 HD23 LEU 84 -6.840 26.782 -0.530 692 H LYS 85 H LYS 85 -7.329 26.777 -5.391 693 HA LYS 85 HA LYS 85 -5.283 28.267 -6.834 694 HB2 LYS 85 HB2 LYS 85 -4.859 26.682 -8.448 695 HB3 LYS 85 HB3 LYS 85 -5.087 25.638 -7.054 696 HG2 LYS 85 HG2 LYS 85 -7.267 25.034 -7.744 697 HG3 LYS 85 HG3 LYS 85 -7.318 26.318 -8.950 698 HD2 LYS 85 HD2 LYS 85 -5.423 25.153 -10.120 699 HD3 LYS 85 HD3 LYS 85 -5.649 23.808 -9.000 700 HE2 LYS 85 HE2 LYS 85 -6.850 23.264 -10.970 701 HE3 LYS 85 HE3 LYS 85 -8.047 23.730 -9.764 702 HZ1 LYS 85 HZ1 LYS 85 -7.553 26.079 -10.975 703 HZ2 LYS 85 HZ2 LYS 85 -8.810 25.028 -11.400 704 HZ3 LYS 85 HZ3 LYS 85 -7.359 25.000 -12.267 705 H LYS 86 H LYS 86 -6.107 28.762 -9.107 706 HA LYS 86 HA LYS 86 -9.000 29.267 -9.002 707 HB2 LYS 86 HB2 LYS 86 -6.780 30.983 -10.128 708 HB3 LYS 86 HB3 LYS 86 -8.468 31.246 -10.522 709 HG2 LYS 86 HG2 LYS 86 -7.203 31.437 -7.795 710 HG3 LYS 86 HG3 LYS 86 -7.763 32.774 -8.794 711 HD2 LYS 86 HD2 LYS 86 -9.436 30.659 -7.443 712 HD3 LYS 86 HD3 LYS 86 -9.408 32.387 -7.113 713 HE2 LYS 86 HE2 LYS 86 -10.450 32.898 -9.183 714 HE3 LYS 86 HE3 LYS 86 -10.235 31.252 -9.772 715 HZ1 LYS 86 HZ1 LYS 86 -12.517 31.731 -9.036 716 HZ2 LYS 86 HZ2 LYS 86 -11.949 31.993 -7.467 717 HZ3 LYS 86 HZ3 LYS 86 -11.811 30.461 -8.171 718 H1 GLY 1 H1 GLY 1 -37.105 15.777 3.436 719 H2 GLY 1 H2 GLY 1 -37.483 14.390 2.541 720 H3 GLY 1 H3 GLY 1 -35.867 14.793 2.839 721 HA2 GLY 1 HA3 GLY 1 -36.095 14.374 5.164 722 HA3 GLY 1 HA2 GLY 1 -37.821 14.108 4.959 723 H SER 2 H SER 2 -35.228 12.467 5.685 724 HA SER 2 HA SER 2 -36.122 10.078 4.238 725 HB2 SER 2 HB2 SER 2 -33.212 10.767 4.703 726 HB3 SER 2 HB3 SER 2 -33.846 9.386 3.808 727 HG SER 2 HG SER 2 -34.635 10.790 2.251 728 H HIS 3 H HIS 3 -36.317 8.303 5.477 729 HA HIS 3 HA HIS 3 -35.824 8.579 8.323 730 HB2 HIS 3 HB2 HIS 3 -37.195 6.510 6.614 731 HB3 HIS 3 HB3 HIS 3 -36.796 6.168 8.293 732 HD1 HIS 3 HD1 HIS 3 -39.235 6.052 9.053 733 HD2 HIS 3 HD2 HIS 3 -38.226 9.674 7.275 734 HE1 HIS 3 HE1 HIS 3 -41.169 7.591 9.510 735 HE2 HIS 3 HE2 HIS 3 -40.542 9.778 8.423 736 H MET 4 H MET 4 -34.868 6.389 5.705 737 HA MET 4 HA MET 4 -32.822 5.173 7.356 738 HB2 MET 4 HB2 MET 4 -33.503 4.730 4.443 739 HB3 MET 4 HB3 MET 4 -32.362 3.776 5.378 740 HG2 MET 4 HG2 MET 4 -34.388 3.345 6.932 741 HG3 MET 4 HG3 MET 4 -35.339 3.856 5.539 742 HE1 MET 4 HE1 MET 4 -33.063 1.294 7.157 743 HE2 MET 4 HE2 MET 4 -31.960 1.630 5.822 744 HE3 MET 4 HE3 MET 4 -32.776 0.069 5.922 745 H THR 5 H THR 5 -30.997 6.258 7.659 746 HA THR 5 HA THR 5 -30.043 8.161 5.712 747 HB THR 5 HB THR 5 -28.053 7.840 7.640 748 HG1 THR 5 HG1 THR 5 -29.211 6.660 9.059 749 HG21 THR 5 HG21 THR 5 -29.027 9.946 8.584 750 HG22 THR 5 HG22 THR 5 -30.398 9.733 7.496 751 HG23 THR 5 HG23 THR 5 -28.781 9.983 6.838 752 H GLU 6 H GLU 6 -27.534 8.073 5.366 753 HA GLU 6 HA GLU 6 -26.964 5.894 3.710 754 HB2 GLU 6 HB2 GLU 6 -25.262 8.059 4.906 755 HB3 GLU 6 HB3 GLU 6 -24.546 6.792 3.929 756 HG2 GLU 6 HG2 GLU 6 -24.939 8.728 2.568 757 HG3 GLU 6 HG3 GLU 6 -26.010 7.426 2.059 758 H GLN 7 H GLN 7 -25.460 4.217 3.905 759 HA GLN 7 HA GLN 7 -25.354 3.040 6.535 760 HB2 GLN 7 HB2 GLN 7 -24.544 2.111 3.784 761 HB3 GLN 7 HB3 GLN 7 -24.183 1.169 5.223 762 HG2 GLN 7 HG2 GLN 7 -26.450 0.788 5.677 763 HG3 GLN 7 HG3 GLN 7 -26.972 2.058 4.572 764 HE21 GLN 7 HE21 GLN 7 -25.631 -1.154 4.805 765 HE22 GLN 7 HE22 GLN 7 -26.031 -1.656 3.197 766 HA PRO 8 HA PRO 8 -21.217 4.334 7.440 767 HB2 PRO 8 HB2 PRO 8 -20.601 2.582 9.384 768 HB3 PRO 8 HB3 PRO 8 -21.841 3.818 9.616 769 HG2 PRO 8 HG2 PRO 8 -22.161 0.918 8.941 770 HG3 PRO 8 HG3 PRO 8 -23.062 1.898 10.112 771 HD2 PRO 8 HD2 PRO 8 -23.985 1.317 7.605 772 HD3 PRO 8 HD3 PRO 8 -24.438 2.778 8.503 773 H LYS 9 H LYS 9 -18.999 3.064 8.000 774 HA LYS 9 HA LYS 9 -17.879 2.087 5.728 775 HB2 LYS 9 HB2 LYS 9 -17.240 1.291 8.571 776 HB3 LYS 9 HB3 LYS 9 -16.217 0.898 7.200 777 HG2 LYS 9 HG2 LYS 9 -15.904 3.302 6.770 778 HG3 LYS 9 HG3 LYS 9 -16.893 3.667 8.181 779 HD2 LYS 9 HD2 LYS 9 -15.210 2.160 9.453 780 HD3 LYS 9 HD3 LYS 9 -14.170 2.417 8.055 781 HE2 LYS 9 HE2 LYS 9 -15.424 4.735 9.478 782 HE3 LYS 9 HE3 LYS 9 -13.959 3.987 10.099 783 HZ1 LYS 9 HZ1 LYS 9 -13.416 5.849 8.697 784 HZ2 LYS 9 HZ2 LYS 9 -14.296 5.200 7.409 785 HZ3 LYS 9 HZ3 LYS 9 -12.896 4.423 7.952 786 H THR 10 H THR 10 -18.594 0.472 4.459 787 HA THR 10 HA THR 10 -19.475 -2.011 5.760 788 HB THR 10 HB THR 10 -21.108 -0.619 4.279 789 HG1 THR 10 HG1 THR 10 -21.642 -2.933 3.285 790 HG21 THR 10 HG21 THR 10 -19.615 -0.358 2.348 791 HG22 THR 10 HG22 THR 10 -21.085 -1.226 1.906 792 HG23 THR 10 HG23 THR 10 -19.578 -2.109 2.140 793 H ARG 11 H ARG 11 -19.134 -3.983 4.360 794 HA ARG 11 HA ARG 11 -16.388 -3.896 3.349 795 HB2 ARG 11 HB2 ARG 11 -18.071 -6.297 4.083 796 HB3 ARG 11 HB3 ARG 11 -16.361 -6.309 3.671 797 HG2 ARG 11 HG2 ARG 11 -15.922 -4.900 5.657 798 HG3 ARG 11 HG3 ARG 11 -17.628 -5.046 6.090 799 HD2 ARG 11 HD2 ARG 11 -15.617 -7.281 5.854 800 HD3 ARG 11 HD3 ARG 11 -16.327 -6.653 7.338 801 HE ARG 11 HE ARG 11 -18.076 -7.828 5.296 802 HH11 ARG 11 HH11 ARG 11 -16.689 -7.924 8.508 803 HH12 ARG 11 HH12 ARG 11 -17.711 -9.216 9.047 804 HH21 ARG 11 HH21 ARG 11 -19.419 -9.528 6.001 805 HH22 ARG 11 HH22 ARG 11 -19.263 -10.132 7.620 806 H VAL 12 H VAL 12 -15.863 -4.512 1.314 807 HA VAL 12 HA VAL 12 -18.085 -5.226 -0.487 808 HB VAL 12 HB VAL 12 -17.337 -2.903 -0.861 809 HG11 VAL 12 HG11 VAL 12 -14.665 -4.173 -1.422 810 HG12 VAL 12 HG12 VAL 12 -15.051 -2.987 -0.177 811 HG13 VAL 12 HG13 VAL 12 -15.089 -2.524 -1.878 812 HG21 VAL 12 HG21 VAL 12 -16.779 -4.897 -3.044 813 HG22 VAL 12 HG22 VAL 12 -16.803 -3.155 -3.318 814 HG23 VAL 12 HG23 VAL 12 -18.256 -3.980 -2.754 815 H SER 13 H SER 13 -17.680 -6.788 -2.018 816 HA SER 13 HA SER 13 -15.290 -8.394 -1.578 817 HB2 SER 13 HB2 SER 13 -17.541 -9.204 -3.384 818 HB3 SER 13 HB3 SER 13 -16.521 -10.208 -2.349 819 HG SER 13 HG SER 13 -18.463 -10.081 -1.319 820 H VAL 14 H VAL 14 -13.610 -8.225 -2.931 821 HA VAL 14 HA VAL 14 -14.116 -7.457 -5.729 822 HB VAL 14 HB VAL 14 -11.851 -6.262 -5.636 823 HG11 VAL 14 HG11 VAL 14 -12.873 -4.166 -4.898 824 HG12 VAL 14 HG12 VAL 14 -14.206 -5.072 -4.180 825 HG13 VAL 14 HG13 VAL 14 -13.965 -5.095 -5.928 826 HG21 VAL 14 HG21 VAL 14 -11.206 -7.127 -3.406 827 HG22 VAL 14 HG22 VAL 14 -12.498 -6.158 -2.693 828 HG23 VAL 14 HG23 VAL 14 -11.150 -5.366 -3.509 829 H ARG 15 H ARG 15 -12.588 -8.265 -7.255 830 HA ARG 15 HA ARG 15 -11.340 -10.741 -6.341 831 HB2 ARG 15 HB2 ARG 15 -12.997 -10.562 -8.302 832 HB3 ARG 15 HB3 ARG 15 -11.645 -9.887 -9.202 833 HG2 ARG 15 HG2 ARG 15 -10.372 -11.907 -8.914 834 HG3 ARG 15 HG3 ARG 15 -11.616 -12.580 -7.855 835 HD2 ARG 15 HD2 ARG 15 -13.209 -12.560 -9.712 836 HD3 ARG 15 HD3 ARG 15 -11.977 -11.869 -10.767 837 HE ARG 15 HE ARG 15 -11.302 -14.402 -9.513 838 HH11 ARG 15 HH11 ARG 15 -12.669 -12.795 -12.301 839 HH12 ARG 15 HH12 ARG 15 -12.297 -14.087 -13.398 840 HH21 ARG 15 HH21 ARG 15 -10.805 -16.120 -10.959 841 HH22 ARG 15 HH22 ARG 15 -11.258 -15.983 -12.631 842 H ILE 16 H ILE 16 -9.210 -10.932 -6.110 843 HA ILE 16 HA ILE 16 -7.445 -9.110 -7.612 844 HB ILE 16 HB ILE 16 -6.719 -10.081 -4.860 845 HG12 ILE 16 HG12 ILE 16 -8.010 -7.411 -5.430 846 HG13 ILE 16 HG13 ILE 16 -8.906 -8.792 -4.807 847 HG21 ILE 16 HG21 ILE 16 -5.165 -8.231 -4.906 848 HG22 ILE 16 HG22 ILE 16 -5.847 -7.659 -6.429 849 HG23 ILE 16 HG23 ILE 16 -4.975 -9.191 -6.374 850 HD11 ILE 16 HD11 ILE 16 -8.386 -7.462 -2.947 851 HD12 ILE 16 HD12 ILE 16 -6.719 -7.233 -3.472 852 HD13 ILE 16 HD13 ILE 16 -7.251 -8.810 -2.890 853 H TYR 17 H TYR 17 -6.153 -10.212 -8.912 854 HA TYR 17 HA TYR 17 -4.883 -11.816 -9.856 855 HB2 TYR 17 HB2 TYR 17 -3.857 -11.550 -7.397 856 HB3 TYR 17 HB3 TYR 17 -4.356 -13.237 -7.303 857 HD1 TYR 17 HD1 TYR 17 -2.724 -11.052 -9.873 858 HD2 TYR 17 HD2 TYR 17 -2.658 -14.728 -7.736 859 HE1 TYR 17 HE1 TYR 17 -0.689 -11.710 -11.084 860 HE2 TYR 17 HE2 TYR 17 -0.620 -15.396 -8.939 861 HH TYR 17 HH TYR 17 1.290 -13.292 -10.665 862 H GLY 18 H GLY 18 -7.798 -12.351 -9.196 863 HA2 GLY 18 HA2 GLY 18 -8.889 -14.179 -10.361 864 HA3 GLY 18 HA3 GLY 18 -7.636 -15.241 -9.751 865 H GLN 19 H GLN 19 -7.975 -13.844 -7.022 866 HA GLN 19 HA GLN 19 -10.296 -15.482 -6.243 867 HB2 GLN 19 HB2 GLN 19 -7.739 -14.781 -4.890 868 HB3 GLN 19 HB3 GLN 19 -9.160 -15.029 -3.884 869 HG2 GLN 19 HG2 GLN 19 -7.990 -16.999 -5.830 870 HG3 GLN 19 HG3 GLN 19 -7.884 -17.075 -4.072 871 HE21 GLN 19 HE21 GLN 19 -9.693 -17.678 -2.884 872 HE22 GLN 19 HE22 GLN 19 -11.081 -18.403 -3.618 873 H ASP 20 H ASP 20 -11.893 -14.679 -4.914 874 HA ASP 20 HA ASP 20 -12.114 -11.760 -4.903 875 HB2 ASP 20 HB2 ASP 20 -13.936 -13.544 -5.677 876 HB3 ASP 20 HB3 ASP 20 -14.335 -13.515 -3.964 877 H TYR 21 H TYR 21 -12.159 -10.555 -3.071 878 HA TYR 21 HA TYR 21 -12.176 -11.959 -0.480 879 HB2 TYR 21 HB2 TYR 21 -10.303 -9.684 -1.150 880 HB3 TYR 21 HB3 TYR 21 -10.366 -10.596 0.353 881 HD1 TYR 21 HD1 TYR 21 -9.761 -13.073 0.263 882 HD2 TYR 21 HD2 TYR 21 -8.925 -10.357 -2.903 883 HE1 TYR 21 HE1 TYR 21 -8.070 -14.625 -0.609 884 HE2 TYR 21 HE2 TYR 21 -7.229 -11.911 -3.788 885 HH TYR 21 HH TYR 21 -5.858 -13.720 -3.089 886 H THR 22 H THR 22 -12.823 -10.648 1.319 887 HA THR 22 HA THR 22 -14.539 -8.402 0.508 888 HB THR 22 HB THR 22 -14.825 -9.449 3.249 889 HG1 THR 22 HG1 THR 22 -15.148 -11.081 0.957 890 HG21 THR 22 HG21 THR 22 -17.185 -9.312 2.702 891 HG22 THR 22 HG22 THR 22 -16.801 -9.057 0.999 892 HG23 THR 22 HG23 THR 22 -16.372 -7.831 2.193 893 H ILE 23 H ILE 23 -13.771 -6.442 0.932 894 HA ILE 23 HA ILE 23 -12.029 -6.075 3.288 895 HB ILE 23 HB ILE 23 -10.903 -4.233 1.991 896 HG12 ILE 23 HG12 ILE 23 -12.207 -5.596 -0.382 897 HG13 ILE 23 HG13 ILE 23 -12.668 -4.016 0.241 898 HG21 ILE 23 HG21 ILE 23 -9.945 -6.491 2.384 899 HG22 ILE 23 HG22 ILE 23 -9.356 -5.716 0.915 900 HG23 ILE 23 HG23 ILE 23 -10.575 -6.987 0.813 901 HD11 ILE 23 HD11 ILE 23 -11.311 -3.551 -1.580 902 HD12 ILE 23 HD12 ILE 23 -10.168 -4.829 -1.178 903 HD13 ILE 23 HD13 ILE 23 -10.232 -3.359 -0.199 904 H VAL 24 H VAL 24 -11.970 -3.764 4.032 905 HA VAL 24 HA VAL 24 -14.691 -2.806 4.251 906 HB VAL 24 HB VAL 24 -12.168 -1.643 5.458 907 HG11 VAL 24 HG11 VAL 24 -13.699 -0.524 7.017 908 HG12 VAL 24 HG12 VAL 24 -15.076 -1.198 6.144 909 HG13 VAL 24 HG13 VAL 24 -14.009 -0.039 5.349 910 HG21 VAL 24 HG21 VAL 24 -14.194 -3.511 6.685 911 HG22 VAL 24 HG22 VAL 24 -12.804 -2.803 7.505 912 HG23 VAL 24 HG23 VAL 24 -12.565 -3.952 6.190 913 H GLY 25 H GLY 25 -15.517 -1.515 2.737 914 HA2 GLY 25 HA2 GLY 25 -13.767 0.103 1.066 915 HA3 GLY 25 HA3 GLY 25 -15.492 -0.148 0.841 916 H ALA 26 H ALA 26 -13.216 1.369 3.102 917 HA ALA 26 HA ALA 26 -15.253 3.317 3.852 918 HB1 ALA 26 HB1 ALA 26 -13.919 2.250 5.609 919 HB2 ALA 26 HB2 ALA 26 -13.705 4.001 5.589 920 HB3 ALA 26 HB3 ALA 26 -12.456 2.950 4.918 921 H GLU 27 H GLU 27 -14.608 3.662 1.247 922 HA GLU 27 HA GLU 27 -13.213 6.229 1.333 923 HB2 GLU 27 HB2 GLU 27 -11.967 4.044 0.285 924 HB3 GLU 27 HB3 GLU 27 -12.764 4.687 -1.142 925 HG2 GLU 27 HG2 GLU 27 -10.815 6.103 0.641 926 HG3 GLU 27 HG3 GLU 27 -10.566 5.589 -1.026 927 H SER 28 H SER 28 -14.807 4.190 -1.150 928 HA SER 28 HA SER 28 -17.111 5.769 -1.376 929 HB2 SER 28 HB2 SER 28 -16.476 6.637 -3.760 930 HB3 SER 28 HB3 SER 28 -15.936 7.544 -2.348 931 HG SER 28 HG SER 28 -13.907 6.821 -2.618 932 HA PRO 29 HA PRO 29 -18.381 2.125 -3.504 933 HB2 PRO 29 HB2 PRO 29 -20.271 3.101 -5.217 934 HB3 PRO 29 HB3 PRO 29 -20.535 2.865 -3.488 935 HG2 PRO 29 HG2 PRO 29 -19.832 5.367 -4.971 936 HG3 PRO 29 HG3 PRO 29 -21.013 5.134 -3.669 937 HD2 PRO 29 HD2 PRO 29 -18.594 6.197 -3.200 938 HD3 PRO 29 HD3 PRO 29 -19.383 5.128 -2.021 939 H ALA 30 H ALA 30 -16.857 4.642 -5.251 940 HA ALA 30 HA ALA 30 -16.793 3.012 -7.695 941 HB1 ALA 30 HB1 ALA 30 -17.503 5.300 -8.039 942 HB2 ALA 30 HB2 ALA 30 -15.944 5.027 -8.815 943 HB3 ALA 30 HB3 ALA 30 -16.027 5.897 -7.285 944 H HIS 31 H HIS 31 -14.605 4.886 -5.594 945 HA HIS 31 HA HIS 31 -12.176 4.166 -6.696 946 HB2 HIS 31 HB2 HIS 31 -13.070 5.054 -4.013 947 HB3 HIS 31 HB3 HIS 31 -11.490 4.283 -4.088 948 HD1 HIS 31 HD1 HIS 31 -11.655 7.199 -3.291 949 HD2 HIS 31 HD2 HIS 31 -11.211 5.945 -7.232 950 HE1 HIS 31 HE1 HIS 31 -10.564 9.115 -4.496 951 HE2 HIS 31 HE2 HIS 31 -10.557 8.424 -6.913 952 H ILE 32 H ILE 32 -14.066 2.427 -4.270 953 HA ILE 32 HA ILE 32 -12.230 0.458 -3.584 954 HB ILE 32 HB ILE 32 -14.121 -0.923 -2.871 955 HG12 ILE 32 HG12 ILE 32 -15.865 1.234 -4.101 956 HG13 ILE 32 HG13 ILE 32 -15.661 -0.389 -4.747 957 HG21 ILE 32 HG21 ILE 32 -14.878 0.537 -1.149 958 HG22 ILE 32 HG22 ILE 32 -14.564 1.962 -2.139 959 HG23 ILE 32 HG23 ILE 32 -13.221 0.990 -1.541 960 HD11 ILE 32 HD11 ILE 32 -16.555 -1.210 -2.511 961 HD12 ILE 32 HD12 ILE 32 -17.695 -0.427 -3.605 962 HD13 ILE 32 HD13 ILE 32 -17.044 0.461 -2.228 963 H ARG 33 H ARG 33 -13.973 0.769 -6.546 964 HA ARG 33 HA ARG 33 -13.788 -2.029 -7.226 965 HB2 ARG 33 HB2 ARG 33 -14.796 0.425 -8.584 966 HB3 ARG 33 HB3 ARG 33 -14.407 -0.978 -9.569 967 HG2 ARG 33 HG2 ARG 33 -16.276 -2.016 -8.977 968 HG3 ARG 33 HG3 ARG 33 -15.993 -1.699 -7.263 969 HD2 ARG 33 HD2 ARG 33 -18.091 -0.697 -8.081 970 HD3 ARG 33 HD3 ARG 33 -16.956 0.507 -7.473 971 HE ARG 33 HE ARG 33 -16.554 0.261 -10.223 972 HH11 ARG 33 HH11 ARG 33 -19.009 1.380 -8.002 973 HH12 ARG 33 HH12 ARG 33 -19.694 2.504 -9.130 974 HH21 ARG 33 HH21 ARG 33 -17.448 1.739 -11.711 975 HH22 ARG 33 HH22 ARG 33 -18.806 2.711 -11.241 976 H LEU 34 H LEU 34 -11.760 0.752 -7.554 977 HA LEU 34 HA LEU 34 -10.153 -0.643 -9.573 978 HB2 LEU 34 HB2 LEU 34 -9.035 1.449 -10.004 979 HB3 LEU 34 HB3 LEU 34 -10.768 1.652 -10.124 980 HG LEU 34 HG LEU 34 -10.357 2.413 -7.546 981 HD11 LEU 34 HD11 LEU 34 -7.944 3.351 -9.094 982 HD12 LEU 34 HD12 LEU 34 -7.921 2.199 -7.760 983 HD13 LEU 34 HD13 LEU 34 -8.413 3.868 -7.474 984 HD21 LEU 34 HD21 LEU 34 -10.380 4.751 -8.510 985 HD22 LEU 34 HD22 LEU 34 -11.690 3.684 -9.011 986 HD23 LEU 34 HD23 LEU 34 -10.337 3.993 -10.101 987 H VAL 35 H VAL 35 -10.208 -0.063 -6.234 988 HA VAL 35 HA VAL 35 -7.483 0.181 -5.628 989 HB VAL 35 HB VAL 35 -9.521 -1.333 -3.982 990 HG11 VAL 35 HG11 VAL 35 -8.095 -0.727 -2.090 991 HG12 VAL 35 HG12 VAL 35 -6.963 0.060 -3.189 992 HG13 VAL 35 HG13 VAL 35 -7.210 -1.685 -3.276 993 HG21 VAL 35 HG21 VAL 35 -9.866 0.799 -2.793 994 HG22 VAL 35 HG22 VAL 35 -10.375 0.877 -4.481 995 HG23 VAL 35 HG23 VAL 35 -8.848 1.606 -3.985 996 H ALA 36 H ALA 36 -9.493 -2.714 -5.978 997 HA ALA 36 HA ALA 36 -7.438 -4.583 -5.497 998 HB1 ALA 36 HB1 ALA 36 -9.013 -6.176 -6.675 999 HB2 ALA 36 HB2 ALA 36 -10.087 -4.799 -6.903 1000 HB3 ALA 36 HB3 ALA 36 -9.669 -5.328 -5.275 1001 H ALA 37 H ALA 37 -8.634 -3.032 -8.416 1002 HA ALA 37 HA ALA 37 -7.256 -4.580 -10.306 1003 HB1 ALA 37 HB1 ALA 37 -9.094 -3.057 -10.874 1004 HB2 ALA 37 HB2 ALA 37 -7.656 -2.748 -11.850 1005 HB3 ALA 37 HB3 ALA 37 -8.055 -1.680 -10.504 1006 H PHE 38 H PHE 38 -6.335 -1.647 -8.554 1007 HA PHE 38 HA PHE 38 -3.880 -1.195 -9.863 1008 HB2 PHE 38 HB2 PHE 38 -4.960 0.527 -8.496 1009 HB3 PHE 38 HB3 PHE 38 -4.741 -0.458 -7.054 1010 HD1 PHE 38 HD1 PHE 38 -2.814 1.192 -9.769 1011 HD2 PHE 38 HD2 PHE 38 -2.871 -0.149 -5.734 1012 HE1 PHE 38 HE1 PHE 38 -0.628 2.253 -9.393 1013 HE2 PHE 38 HE2 PHE 38 -0.682 0.909 -5.347 1014 HZ PHE 38 HZ PHE 38 0.444 2.113 -7.178 1015 H VAL 39 H VAL 39 -4.690 -2.987 -6.913 1016 HA VAL 39 HA VAL 39 -2.018 -3.715 -6.299 1017 HB VAL 39 HB VAL 39 -4.638 -4.958 -5.451 1018 HG11 VAL 39 HG11 VAL 39 -2.922 -6.632 -5.216 1019 HG12 VAL 39 HG12 VAL 39 -3.317 -5.993 -3.619 1020 HG13 VAL 39 HG13 VAL 39 -1.843 -5.474 -4.437 1021 HG21 VAL 39 HG21 VAL 39 -4.785 -3.199 -4.107 1022 HG22 VAL 39 HG22 VAL 39 -3.252 -2.579 -4.716 1023 HG23 VAL 39 HG23 VAL 39 -3.269 -3.681 -3.340 1024 H ASP 40 H ASP 40 -4.611 -5.274 -8.109 1025 HA ASP 40 HA ASP 40 -3.366 -7.742 -8.582 1026 HB2 ASP 40 HB2 ASP 40 -5.672 -7.584 -9.112 1027 HB3 ASP 40 HB3 ASP 40 -5.426 -6.158 -10.116 1028 H ASP 41 H ASP 41 -3.147 -4.639 -10.187 1029 HA ASP 41 HA ASP 41 -1.654 -5.443 -12.441 1030 HB2 ASP 41 HB2 ASP 41 -2.872 -3.241 -12.125 1031 HB3 ASP 41 HB3 ASP 41 -1.547 -2.745 -11.079 1032 H LYS 42 H LYS 42 -0.748 -4.274 -9.247 1033 HA LYS 42 HA LYS 42 2.021 -4.109 -9.641 1034 HB2 LYS 42 HB2 LYS 42 0.224 -4.284 -7.274 1035 HB3 LYS 42 HB3 LYS 42 1.933 -4.611 -7.021 1036 HG2 LYS 42 HG2 LYS 42 0.989 -2.131 -8.420 1037 HG3 LYS 42 HG3 LYS 42 1.127 -2.229 -6.663 1038 HD2 LYS 42 HD2 LYS 42 3.412 -2.365 -6.710 1039 HD3 LYS 42 HD3 LYS 42 3.444 -3.092 -8.314 1040 HE2 LYS 42 HE2 LYS 42 2.619 -0.826 -9.166 1041 HE3 LYS 42 HE3 LYS 42 3.050 -0.206 -7.574 1042 HZ1 LYS 42 HZ1 LYS 42 4.834 0.088 -9.186 1043 HZ2 LYS 42 HZ2 LYS 42 4.905 -1.588 -9.440 1044 HZ3 LYS 42 HZ3 LYS 42 5.311 -0.938 -7.924 1045 H MET 43 H MET 43 0.120 -6.756 -8.175 1046 HA MET 43 HA MET 43 2.356 -8.444 -7.824 1047 HB2 MET 43 HB2 MET 43 0.613 -10.292 -7.685 1048 HB3 MET 43 HB3 MET 43 0.478 -8.984 -6.520 1049 HG2 MET 43 HG2 MET 43 -1.236 -7.953 -8.016 1050 HG3 MET 43 HG3 MET 43 -1.184 -9.427 -8.983 1051 HE1 MET 43 HE1 MET 43 -2.430 -9.323 -4.549 1052 HE2 MET 43 HE2 MET 43 -1.462 -8.103 -5.380 1053 HE3 MET 43 HE3 MET 43 -0.764 -9.677 -5.005 1054 H HIS 44 H HIS 44 0.369 -7.791 -10.579 1055 HA HIS 44 HA HIS 44 1.091 -10.145 -12.019 1056 HB2 HIS 44 HB2 HIS 44 -0.461 -7.717 -12.573 1057 HB3 HIS 44 HB3 HIS 44 0.428 -8.319 -13.966 1058 HD1 HIS 44 HD1 HIS 44 -2.658 -8.811 -12.132 1059 HD2 HIS 44 HD2 HIS 44 -0.171 -11.142 -14.518 1060 HE1 HIS 44 HE1 HIS 44 -4.038 -10.801 -12.812 1061 HE2 HIS 44 HE2 HIS 44 -2.533 -12.166 -14.305 1062 H GLU 45 H GLU 45 2.375 -6.840 -11.890 1063 HA GLU 45 HA GLU 45 4.292 -7.323 -13.961 1064 HB2 GLU 45 HB2 GLU 45 5.147 -5.142 -13.510 1065 HB3 GLU 45 HB3 GLU 45 3.397 -5.059 -13.386 1066 HG2 GLU 45 HG2 GLU 45 3.579 -5.151 -10.933 1067 HG3 GLU 45 HG3 GLU 45 5.336 -5.193 -11.081 1068 H PHE 46 H PHE 46 4.223 -7.825 -10.537 1069 HA PHE 46 HA PHE 46 7.091 -8.055 -10.321 1070 HB2 PHE 46 HB2 PHE 46 4.800 -8.285 -8.423 1071 HB3 PHE 46 HB3 PHE 46 6.335 -9.034 -7.981 1072 HD1 PHE 46 HD2 PHE 46 8.436 -7.522 -8.221 1073 HD2 PHE 46 HD1 PHE 46 4.453 -6.055 -7.939 1074 HE1 PHE 46 HE2 PHE 46 9.294 -5.335 -7.491 1075 HE2 PHE 46 HE1 PHE 46 5.304 -3.869 -7.210 1076 HZ PHE 46 HZ PHE 46 7.728 -3.507 -6.986 1077 H SER 47 H SER 47 4.563 -10.087 -11.285 1078 HA SER 47 HA SER 47 5.509 -12.579 -10.380 1079 HB2 SER 47 HB2 SER 47 3.875 -11.917 -12.838 1080 HB3 SER 47 HB3 SER 47 4.112 -13.541 -12.196 1081 HG SER 47 HG SER 47 3.094 -11.500 -10.536 1082 H GLU 48 H GLU 48 6.336 -10.621 -13.157 1083 HA GLU 48 HA GLU 48 7.951 -12.690 -14.358 1084 HB2 GLU 48 HB2 GLU 48 8.528 -10.984 -16.018 1085 HB3 GLU 48 HB3 GLU 48 6.790 -11.093 -15.787 1086 HG2 GLU 48 HG2 GLU 48 6.656 -9.041 -14.774 1087 HG3 GLU 48 HG3 GLU 48 8.330 -9.088 -14.223 1088 H LYS 49 H LYS 49 8.424 -10.673 -11.761 1089 HA LYS 49 HA LYS 49 11.200 -10.039 -12.285 1090 HB2 LYS 49 HB2 LYS 49 9.452 -9.637 -9.860 1091 HB3 LYS 49 HB3 LYS 49 11.139 -9.149 -9.930 1092 HG2 LYS 49 HG2 LYS 49 8.965 -8.134 -11.755 1093 HG3 LYS 49 HG3 LYS 49 9.579 -7.292 -10.332 1094 HD2 LYS 49 HD2 LYS 49 10.989 -6.307 -11.777 1095 HD3 LYS 49 HD3 LYS 49 11.880 -7.826 -11.693 1096 HE2 LYS 49 HE2 LYS 49 10.592 -8.638 -13.650 1097 HE3 LYS 49 HE3 LYS 49 9.809 -7.062 -13.753 1098 HZ1 LYS 49 HZ1 LYS 49 11.662 -7.233 -15.283 1099 HZ2 LYS 49 HZ2 LYS 49 12.727 -7.559 -14.012 1100 HZ3 LYS 49 HZ3 LYS 49 11.968 -6.050 -14.115 1101 H GLN 50 H GLN 50 9.406 -12.596 -10.884 1102 HA GLN 50 HA GLN 50 9.958 -14.520 -9.813 1103 HB2 GLN 50 HB2 GLN 50 11.376 -14.729 -11.860 1104 HB3 GLN 50 HB3 GLN 50 12.716 -14.030 -10.960 1105 HG2 GLN 50 HG2 GLN 50 12.071 -16.024 -9.302 1106 HG3 GLN 50 HG3 GLN 50 11.535 -16.724 -10.829 1107 HE21 GLN 50 HE21 GLN 50 14.261 -15.446 -9.071 1108 HE22 GLN 50 HE22 GLN 50 15.480 -16.193 -10.041 1109 HA PRO 51 HA PRO 51 11.913 -12.210 -6.293 1110 HB2 PRO 51 HB2 PRO 51 9.943 -12.881 -4.486 1111 HB3 PRO 51 HB3 PRO 51 9.991 -11.386 -5.420 1112 HG2 PRO 51 HG2 PRO 51 8.326 -13.798 -5.801 1113 HG3 PRO 51 HG3 PRO 51 7.995 -12.119 -6.243 1114 HD2 PRO 51 HD2 PRO 51 8.752 -14.124 -8.003 1115 HD3 PRO 51 HD3 PRO 51 8.870 -12.385 -8.320 1116 H MET 52 H MET 52 9.964 -14.793 -4.909 1117 HA MET 52 HA MET 52 12.441 -16.287 -4.363 1118 HB2 MET 52 HB2 MET 52 10.002 -16.255 -2.583 1119 HB3 MET 52 HB3 MET 52 11.599 -16.882 -2.204 1120 HG2 MET 52 HG2 MET 52 10.880 -13.987 -2.613 1121 HG3 MET 52 HG3 MET 52 11.162 -14.778 -1.063 1122 HE1 MET 52 HE1 MET 52 13.724 -16.681 -1.847 1123 HE2 MET 52 HE2 MET 52 13.470 -15.801 -0.341 1124 HE3 MET 52 HE3 MET 52 14.977 -15.604 -1.234 1125 H LEU 53 H LEU 53 10.106 -16.426 -6.403 1126 HA LEU 53 HA LEU 53 8.888 -17.998 -7.505 1127 HB2 LEU 53 HB2 LEU 53 11.011 -19.723 -6.243 1128 HB3 LEU 53 HB3 LEU 53 9.812 -20.366 -7.346 1129 HG LEU 53 HG LEU 53 11.617 -18.092 -8.129 1130 HD11 LEU 53 HD11 LEU 53 13.053 -19.937 -7.480 1131 HD12 LEU 53 HD12 LEU 53 13.042 -19.759 -9.234 1132 HD13 LEU 53 HD13 LEU 53 12.110 -21.047 -8.471 1133 HD21 LEU 53 HD21 LEU 53 9.820 -18.256 -9.616 1134 HD22 LEU 53 HD22 LEU 53 9.824 -20.018 -9.570 1135 HD23 LEU 53 HD23 LEU 53 11.117 -19.157 -10.404 1136 H ASP 54 H ASP 54 7.584 -17.174 -5.373 1137 HA ASP 54 HA ASP 54 6.020 -19.463 -4.593 1138 HB2 ASP 54 HB2 ASP 54 7.840 -19.432 -2.903 1139 HB3 ASP 54 HB3 ASP 54 7.389 -17.786 -2.474 1140 H VAL 55 H VAL 55 3.913 -18.869 -4.144 1141 HA VAL 55 HA VAL 55 3.093 -16.317 -5.040 1142 HB VAL 55 HB VAL 55 1.445 -18.391 -3.582 1143 HG11 VAL 55 HG11 VAL 55 0.368 -16.228 -3.464 1144 HG12 VAL 55 HG12 VAL 55 -0.479 -17.246 -4.626 1145 HG13 VAL 55 HG13 VAL 55 0.610 -15.981 -5.194 1146 HG21 VAL 55 HG21 VAL 55 0.698 -19.038 -5.815 1147 HG22 VAL 55 HG22 VAL 55 2.443 -19.231 -5.650 1148 HG23 VAL 55 HG23 VAL 55 1.787 -17.850 -6.531 1149 HA PRO 56 HA PRO 56 1.926 -15.410 -0.330 1150 HB2 PRO 56 HB2 PRO 56 4.168 -16.938 0.897 1151 HB3 PRO 56 HB3 PRO 56 2.535 -16.648 1.508 1152 HG2 PRO 56 HG2 PRO 56 3.227 -19.022 0.502 1153 HG3 PRO 56 HG3 PRO 56 1.617 -18.334 0.224 1154 HD2 PRO 56 HD2 PRO 56 3.928 -18.539 -1.634 1155 HD3 PRO 56 HD3 PRO 56 2.195 -18.650 -1.969 1156 H LYS 57 H LYS 57 5.243 -16.079 -1.330 1157 HA LYS 57 HA LYS 57 6.391 -13.822 -0.016 1158 HB2 LYS 57 HB2 LYS 57 7.535 -15.345 -2.359 1159 HB3 LYS 57 HB3 LYS 57 8.417 -14.378 -1.189 1160 HG2 LYS 57 HG2 LYS 57 6.938 -16.926 -0.561 1161 HG3 LYS 57 HG3 LYS 57 8.675 -16.795 -0.828 1162 HD2 LYS 57 HD2 LYS 57 8.970 -16.284 1.308 1163 HD3 LYS 57 HD3 LYS 57 7.932 -14.870 1.127 1164 HE2 LYS 57 HE2 LYS 57 5.979 -16.173 1.638 1165 HE3 LYS 57 HE3 LYS 57 6.924 -17.661 1.649 1166 HZ1 LYS 57 HZ1 LYS 57 7.372 -15.407 3.523 1167 HZ2 LYS 57 HZ2 LYS 57 8.068 -16.951 3.593 1168 HZ3 LYS 57 HZ3 LYS 57 6.414 -16.752 3.880 1169 H LEU 58 H LEU 58 5.009 -14.401 -3.159 1170 HA LEU 58 HA LEU 58 5.971 -12.029 -4.419 1171 HB2 LEU 58 HB2 LEU 58 5.139 -14.117 -5.564 1172 HB3 LEU 58 HB3 LEU 58 3.516 -13.659 -5.094 1173 HG LEU 58 HG LEU 58 5.139 -11.732 -6.710 1174 HD11 LEU 58 HD11 LEU 58 5.506 -13.567 -8.066 1175 HD12 LEU 58 HD12 LEU 58 3.992 -12.918 -8.706 1176 HD13 LEU 58 HD13 LEU 58 3.969 -14.321 -7.638 1177 HD21 LEU 58 HD21 LEU 58 2.962 -11.121 -7.578 1178 HD22 LEU 58 HD22 LEU 58 2.926 -11.104 -5.814 1179 HD23 LEU 58 HD23 LEU 58 2.207 -12.452 -6.700 1180 H ALA 59 H ALA 59 3.095 -12.929 -2.634 1181 HA ALA 59 HA ALA 59 1.528 -10.664 -3.119 1182 HB1 ALA 59 HB1 ALA 59 1.583 -12.528 -0.754 1183 HB2 ALA 59 HB2 ALA 59 0.584 -12.671 -2.202 1184 HB3 ALA 59 HB3 ALA 59 0.317 -11.343 -1.072 1185 H VAL 60 H VAL 60 3.600 -11.365 -0.294 1186 HA VAL 60 HA VAL 60 3.185 -8.872 0.956 1187 HB VAL 60 HB VAL 60 5.232 -9.343 2.279 1188 HG11 VAL 60 HG11 VAL 60 3.495 -11.791 2.089 1189 HG12 VAL 60 HG12 VAL 60 2.977 -10.283 2.841 1190 HG13 VAL 60 HG13 VAL 60 4.350 -11.171 3.499 1191 HG21 VAL 60 HG21 VAL 60 6.255 -10.616 0.231 1192 HG22 VAL 60 HG22 VAL 60 5.474 -12.011 0.983 1193 HG23 VAL 60 HG23 VAL 60 6.670 -11.076 1.881 1194 H LEU 61 H LEU 61 5.254 -9.791 -1.648 1195 HA LEU 61 HA LEU 61 7.209 -7.776 -1.433 1196 HB2 LEU 61 HB2 LEU 61 7.228 -9.877 -2.884 1197 HB3 LEU 61 HB3 LEU 61 6.235 -8.977 -4.014 1198 HG LEU 61 HG LEU 61 8.119 -7.234 -4.010 1199 HD11 LEU 61 HD11 LEU 61 10.354 -8.218 -3.512 1200 HD12 LEU 61 HD12 LEU 61 9.529 -9.569 -2.733 1201 HD13 LEU 61 HD13 LEU 61 9.353 -7.937 -2.088 1202 HD21 LEU 61 HD21 LEU 61 9.416 -8.549 -5.660 1203 HD22 LEU 61 HD22 LEU 61 7.673 -8.621 -5.920 1204 HD23 LEU 61 HD23 LEU 61 8.511 -9.984 -5.177 1205 H THR 62 H THR 62 3.975 -7.804 -2.803 1206 HA THR 62 HA THR 62 4.313 -5.288 -4.143 1207 HB THR 62 HB THR 62 1.883 -5.367 -4.534 1208 HG1 THR 62 HG1 THR 62 2.004 -7.752 -2.958 1209 HG21 THR 62 HG21 THR 62 1.864 -7.274 -5.983 1210 HG22 THR 62 HG22 THR 62 3.166 -8.041 -5.074 1211 HG23 THR 62 HG23 THR 62 3.484 -6.578 -6.006 1212 H ALA 63 H ALA 63 2.836 -6.373 -1.129 1213 HA ALA 63 HA ALA 63 1.622 -3.988 -0.348 1214 HB1 ALA 63 HB1 ALA 63 2.834 -6.128 1.399 1215 HB2 ALA 63 HB2 ALA 63 1.193 -6.121 0.751 1216 HB3 ALA 63 HB3 ALA 63 1.683 -4.897 1.923 1217 H VAL 64 H VAL 64 4.923 -5.139 0.200 1218 HA VAL 64 HA VAL 64 5.645 -2.894 1.809 1219 HB VAL 64 HB VAL 64 6.698 -5.201 1.872 1220 HG11 VAL 64 HG11 VAL 64 7.084 -5.533 -0.486 1221 HG12 VAL 64 HG12 VAL 64 8.622 -5.567 0.377 1222 HG13 VAL 64 HG13 VAL 64 8.153 -4.135 -0.541 1223 HG21 VAL 64 HG21 VAL 64 8.944 -4.300 2.409 1224 HG22 VAL 64 HG22 VAL 64 7.624 -3.387 3.136 1225 HG23 VAL 64 HG23 VAL 64 8.450 -2.756 1.713 1226 H GLN 65 H GLN 65 5.545 -3.479 -1.596 1227 HA GLN 65 HA GLN 65 7.397 -1.332 -2.185 1228 HB2 GLN 65 HB2 GLN 65 6.968 -3.519 -3.565 1229 HB3 GLN 65 HB3 GLN 65 5.632 -2.600 -4.249 1230 HG2 GLN 65 HG2 GLN 65 8.268 -1.251 -4.196 1231 HG3 GLN 65 HG3 GLN 65 8.094 -2.605 -5.309 1232 HE21 GLN 65 HE21 GLN 65 8.377 0.324 -5.718 1233 HE22 GLN 65 HE22 GLN 65 7.058 0.759 -6.743 1234 H ILE 66 H ILE 66 3.931 -1.930 -2.242 1235 HA ILE 66 HA ILE 66 3.164 0.530 -3.413 1236 HB ILE 66 HB ILE 66 1.669 -1.392 -1.617 1237 HG12 ILE 66 HG12 ILE 66 1.345 -0.787 -4.568 1238 HG13 ILE 66 HG13 ILE 66 2.310 -2.119 -3.934 1239 HG21 ILE 66 HG21 ILE 66 -0.296 -0.171 -1.828 1240 HG22 ILE 66 HG22 ILE 66 0.321 0.776 -3.182 1241 HG23 ILE 66 HG23 ILE 66 0.912 1.084 -1.550 1242 HD11 ILE 66 HD11 ILE 66 0.145 -2.904 -4.654 1243 HD12 ILE 66 HD12 ILE 66 -0.658 -1.749 -3.590 1244 HD13 ILE 66 HD13 ILE 66 0.295 -3.065 -2.903 1245 H ALA 67 H ALA 67 3.709 -0.524 -0.103 1246 HA ALA 67 HA ALA 67 2.732 1.727 1.240 1247 HB1 ALA 67 HB1 ALA 67 4.116 0.973 3.123 1248 HB2 ALA 67 HB2 ALA 67 4.937 -0.163 2.051 1249 HB3 ALA 67 HB3 ALA 67 3.215 -0.354 2.389 1250 H SER 68 H SER 68 6.033 1.008 0.083 1251 HA SER 68 HA SER 68 7.208 3.343 1.144 1252 HB2 SER 68 HB2 SER 68 8.833 2.735 -0.942 1253 HB3 SER 68 HB3 SER 68 8.875 1.900 0.613 1254 HG SER 68 HG SER 68 7.933 0.188 -0.257 1255 H GLU 69 H GLU 69 5.925 2.623 -2.099 1256 HA GLU 69 HA GLU 69 6.618 5.101 -3.243 1257 HB2 GLU 69 HB2 GLU 69 4.712 2.921 -3.966 1258 HB3 GLU 69 HB3 GLU 69 4.623 4.453 -4.828 1259 HG2 GLU 69 HG2 GLU 69 7.077 2.727 -4.581 1260 HG3 GLU 69 HG3 GLU 69 6.014 2.804 -5.986 1261 H TYR 70 H TYR 70 3.984 4.200 -1.184 1262 HA TYR 70 HA TYR 70 2.546 6.655 -1.822 1263 HB2 TYR 70 HB2 TYR 70 1.866 4.139 -0.385 1264 HB3 TYR 70 HB3 TYR 70 1.003 5.606 0.070 1265 HD1 TYR 70 HD2 TYR 70 1.698 3.275 -2.707 1266 HD2 TYR 70 HD1 TYR 70 -0.635 6.572 -1.377 1267 HE1 TYR 70 HE2 TYR 70 0.209 2.992 -4.641 1268 HE2 TYR 70 HE1 TYR 70 -2.132 6.295 -3.306 1269 HH TYR 70 HH TYR 70 -2.267 3.588 -5.159 1270 H LEU 71 H LEU 71 4.626 5.336 0.620 1271 HA LEU 71 HA LEU 71 3.961 7.116 2.721 1272 HB2 LEU 71 HB2 LEU 71 6.288 5.356 2.096 1273 HB3 LEU 71 HB3 LEU 71 6.483 6.575 3.342 1274 HG LEU 71 HG LEU 71 4.195 4.616 3.436 1275 HD11 LEU 71 HD11 LEU 71 6.119 3.198 3.308 1276 HD12 LEU 71 HD12 LEU 71 5.575 3.253 4.982 1277 HD13 LEU 71 HD13 LEU 71 6.987 4.183 4.488 1278 HD21 LEU 71 HD21 LEU 71 5.664 6.016 5.662 1279 HD22 LEU 71 HD22 LEU 71 4.144 5.127 5.758 1280 HD23 LEU 71 HD23 LEU 71 4.216 6.659 4.888 1281 H LYS 72 H LYS 72 6.219 7.288 0.035 1282 HA LYS 72 HA LYS 72 7.441 9.722 0.860 1283 HB2 LYS 72 HB2 LYS 72 8.459 9.754 -1.342 1284 HB3 LYS 72 HB3 LYS 72 8.518 8.123 -0.688 1285 HG2 LYS 72 HG2 LYS 72 6.219 7.969 -2.052 1286 HG3 LYS 72 HG3 LYS 72 7.057 9.182 -3.018 1287 HD2 LYS 72 HD2 LYS 72 8.212 6.503 -2.262 1288 HD3 LYS 72 HD3 LYS 72 7.409 6.842 -3.791 1289 HE2 LYS 72 HE2 LYS 72 9.157 8.792 -3.919 1290 HE3 LYS 72 HE3 LYS 72 10.043 7.791 -2.776 1291 HZ1 LYS 72 HZ1 LYS 72 9.176 6.091 -4.782 1292 HZ2 LYS 72 HZ2 LYS 72 10.763 6.620 -4.491 1293 HZ3 LYS 72 HZ3 LYS 72 9.771 7.471 -5.566 1294 H LEU 73 H LEU 73 4.441 8.983 -0.560 1295 HA LEU 73 HA LEU 73 4.060 11.416 -2.003 1296 HB2 LEU 73 HB2 LEU 73 2.840 9.125 -2.249 1297 HB3 LEU 73 HB3 LEU 73 1.830 9.699 -0.943 1298 HG LEU 73 HG LEU 73 0.880 9.970 -3.248 1299 HD11 LEU 73 HD11 LEU 73 1.242 12.461 -1.595 1300 HD12 LEU 73 HD12 LEU 73 -0.025 11.248 -1.424 1301 HD13 LEU 73 HD13 LEU 73 0.042 12.254 -2.869 1302 HD21 LEU 73 HD21 LEU 73 1.700 11.488 -4.783 1303 HD22 LEU 73 HD22 LEU 73 3.169 10.729 -4.173 1304 HD23 LEU 73 HD23 LEU 73 2.689 12.325 -3.593 1305 H LYS 74 H LYS 74 2.908 10.202 1.142 1306 HA LYS 74 HA LYS 74 1.669 12.678 1.816 1307 HB2 LYS 74 HB2 LYS 74 1.514 11.735 4.120 1308 HB3 LYS 74 HB3 LYS 74 0.829 10.704 2.874 1309 HG2 LYS 74 HG2 LYS 74 2.366 9.071 3.181 1310 HG3 LYS 74 HG3 LYS 74 3.646 10.202 3.621 1311 HD2 LYS 74 HD2 LYS 74 3.057 8.899 5.561 1312 HD3 LYS 74 HD3 LYS 74 2.519 10.560 5.800 1313 HE2 LYS 74 HE2 LYS 74 0.244 9.785 4.962 1314 HE3 LYS 74 HE3 LYS 74 0.858 8.142 5.135 1315 HZ1 LYS 74 HZ1 LYS 74 1.196 8.517 7.463 1316 HZ2 LYS 74 HZ2 LYS 74 -0.398 8.924 7.076 1317 HZ3 LYS 74 HZ3 LYS 74 0.749 10.143 7.324 1318 H GLU 75 H GLU 75 4.855 11.402 2.083 1319 HA GLU 75 HA GLU 75 5.876 13.056 4.112 1320 HB2 GLU 75 HB2 GLU 75 6.988 11.014 3.181 1321 HB3 GLU 75 HB3 GLU 75 7.369 11.934 1.732 1322 HG2 GLU 75 HG2 GLU 75 9.299 11.855 3.146 1323 HG3 GLU 75 HG3 GLU 75 8.679 13.505 3.119 1324 H GLU 76 H GLU 76 5.918 13.441 0.555 1325 HA GLU 76 HA GLU 76 7.142 16.012 0.686 1326 HB2 GLU 76 HB2 GLU 76 6.827 16.159 -1.670 1327 HB3 GLU 76 HB3 GLU 76 7.223 14.485 -1.314 1328 HG2 GLU 76 HG2 GLU 76 4.997 13.785 -1.667 1329 HG3 GLU 76 HG3 GLU 76 4.397 15.444 -1.657 1330 H TYR 77 H TYR 77 3.875 14.845 0.781 1331 HA TYR 77 HA TYR 77 2.462 17.155 0.125 1332 HB2 TYR 77 HB2 TYR 77 1.281 15.081 0.353 1333 HB3 TYR 77 HB3 TYR 77 1.803 14.903 2.024 1334 HD1 TYR 77 HD2 TYR 77 0.150 17.644 0.085 1335 HD2 TYR 77 HD1 TYR 77 0.036 15.101 3.490 1336 HE1 TYR 77 HE2 TYR 77 -1.908 18.760 0.838 1337 HE2 TYR 77 HE1 TYR 77 -2.022 16.208 4.253 1338 HH TYR 77 HH TYR 77 -4.013 17.720 2.613 1339 H GLN 78 H GLN 78 3.437 15.980 3.339 1340 HA GLN 78 HA GLN 78 2.573 18.288 4.721 1341 HB2 GLN 78 HB2 GLN 78 4.649 16.226 5.491 1342 HB3 GLN 78 HB3 GLN 78 3.994 17.438 6.581 1343 HG2 GLN 78 HG2 GLN 78 2.471 15.210 5.254 1344 HG3 GLN 78 HG3 GLN 78 2.928 15.310 6.953 1345 HE21 GLN 78 HE21 GLN 78 0.308 15.004 5.852 1346 HE22 GLN 78 HE22 GLN 78 -0.625 16.368 6.359 1347 H ARG 79 H ARG 79 5.614 17.363 3.238 1348 HA ARG 79 HA ARG 79 7.288 19.325 4.292 1349 HB2 ARG 79 HB2 ARG 79 7.982 17.324 2.963 1350 HB3 ARG 79 HB3 ARG 79 7.430 18.153 1.517 1351 HG2 ARG 79 HG2 ARG 79 9.665 18.614 1.455 1352 HG3 ARG 79 HG3 ARG 79 9.061 20.028 2.319 1353 HD2 ARG 79 HD2 ARG 79 9.940 17.606 3.835 1354 HD3 ARG 79 HD3 ARG 79 11.142 18.736 3.218 1355 HE ARG 79 HE ARG 79 9.119 19.270 5.285 1356 HH11 ARG 79 HH11 ARG 79 11.811 20.428 3.347 1357 HH12 ARG 79 HH12 ARG 79 12.216 21.708 4.447 1358 HH21 ARG 79 HH21 ARG 79 9.664 20.927 6.739 1359 HH22 ARG 79 HH22 ARG 79 10.984 22.000 6.383 1360 H LEU 80 H LEU 80 5.319 19.442 1.307 1361 HA LEU 80 HA LEU 80 6.217 22.108 0.714 1362 HB2 LEU 80 HB2 LEU 80 4.880 22.026 -1.213 1363 HB3 LEU 80 HB3 LEU 80 5.525 20.413 -1.007 1364 HG LEU 80 HG LEU 80 3.083 20.282 0.298 1365 HD11 LEU 80 HD11 LEU 80 2.707 21.840 -2.257 1366 HD12 LEU 80 HD12 LEU 80 2.471 22.480 -0.631 1367 HD13 LEU 80 HD13 LEU 80 1.438 21.181 -1.225 1368 HD21 LEU 80 HD21 LEU 80 4.038 18.554 -1.128 1369 HD22 LEU 80 HD22 LEU 80 3.732 19.544 -2.555 1370 HD23 LEU 80 HD23 LEU 80 2.382 18.923 -1.608 1371 H ARG 81 H ARG 81 3.497 20.718 2.403 1372 HA ARG 81 HA ARG 81 1.932 23.118 2.373 1373 HB2 ARG 81 HB2 ARG 81 1.764 20.618 4.053 1374 HB3 ARG 81 HB3 ARG 81 0.631 21.954 4.199 1375 HG2 ARG 81 HG2 ARG 81 1.117 20.515 1.608 1376 HG3 ARG 81 HG3 ARG 81 -0.098 20.001 2.779 1377 HD2 ARG 81 HD2 ARG 81 -1.241 21.334 1.208 1378 HD3 ARG 81 HD3 ARG 81 -1.034 22.344 2.629 1379 HE ARG 81 HE ARG 81 0.900 22.593 0.451 1380 HH11 ARG 81 HH11 ARG 81 -1.756 23.941 2.291 1381 HH12 ARG 81 HH12 ARG 81 -1.590 25.529 1.613 1382 HH21 ARG 81 HH21 ARG 81 1.120 24.710 -0.455 1383 HH22 ARG 81 HH22 ARG 81 0.039 25.966 0.063 1384 H GLU 82 H GLU 82 4.304 21.695 4.540 1385 HA GLU 82 HA GLU 82 3.876 23.628 6.620 1386 HB2 GLU 82 HB2 GLU 82 5.630 22.554 7.783 1387 HB3 GLU 82 HB3 GLU 82 4.776 21.272 6.936 1388 HG2 GLU 82 HG2 GLU 82 6.488 21.250 5.214 1389 HG3 GLU 82 HG3 GLU 82 7.334 22.567 6.023 1390 H GLN 83 H GLN 83 5.276 23.833 3.627 1391 HA GLN 83 HA GLN 83 7.388 25.666 4.435 1392 HB2 GLN 83 HB2 GLN 83 7.289 23.875 2.424 1393 HB3 GLN 83 HB3 GLN 83 6.743 25.310 1.567 1394 HG2 GLN 83 HG2 GLN 83 9.144 24.999 1.354 1395 HG3 GLN 83 HG3 GLN 83 8.764 26.489 2.214 1396 HE21 GLN 83 HE21 GLN 83 8.602 23.278 3.615 1397 HE22 GLN 83 HE22 GLN 83 9.905 23.503 4.730 1398 H LEU 84 H LEU 84 4.143 25.843 3.949 1399 HA LEU 84 HA LEU 84 4.246 28.573 2.865 1400 HB2 LEU 84 HB2 LEU 84 2.410 26.364 2.546 1401 HB3 LEU 84 HB3 LEU 84 1.565 27.765 3.164 1402 HG LEU 84 HG LEU 84 1.455 27.614 0.717 1403 HD11 LEU 84 HD11 LEU 84 3.058 29.972 1.693 1404 HD12 LEU 84 HD12 LEU 84 1.305 29.801 1.765 1405 HD13 LEU 84 HD13 LEU 84 2.120 29.899 0.204 1406 HD21 LEU 84 HD21 LEU 84 4.441 28.037 0.758 1407 HD22 LEU 84 HD22 LEU 84 3.405 27.956 -0.665 1408 HD23 LEU 84 HD23 LEU 84 3.629 26.528 0.342 1409 H LYS 85 H LYS 85 4.505 27.239 5.719 1410 HA LYS 85 HA LYS 85 2.654 29.071 7.075 1411 HB2 LYS 85 HB2 LYS 85 2.793 27.672 9.016 1412 HB3 LYS 85 HB3 LYS 85 2.485 26.635 7.630 1413 HG2 LYS 85 HG2 LYS 85 5.021 26.267 7.584 1414 HG3 LYS 85 HG3 LYS 85 5.016 26.967 9.201 1415 HD2 LYS 85 HD2 LYS 85 3.140 24.730 8.565 1416 HD3 LYS 85 HD3 LYS 85 4.836 24.376 8.868 1417 HE2 LYS 85 HE2 LYS 85 4.616 25.647 11.021 1418 HE3 LYS 85 HE3 LYS 85 2.882 25.710 10.723 1419 HZ1 LYS 85 HZ1 LYS 85 3.612 23.856 12.181 1420 HZ2 LYS 85 HZ2 LYS 85 4.420 23.180 10.857 1421 HZ3 LYS 85 HZ3 LYS 85 2.743 23.358 10.819 1422 H LYS 86 H LYS 86 3.735 29.545 9.432 1423 HA LYS 86 HA LYS 86 6.195 30.978 8.761 1424 HB2 LYS 86 HB2 LYS 86 4.134 31.332 10.927 1425 HB3 LYS 86 HB3 LYS 86 5.685 32.153 10.985 1426 HG2 LYS 86 HG2 LYS 86 3.976 32.396 8.549 1427 HG3 LYS 86 HG3 LYS 86 3.600 33.350 9.985 1428 HD2 LYS 86 HD2 LYS 86 5.025 34.829 9.039 1429 HD3 LYS 86 HD3 LYS 86 6.246 33.806 9.794 1430 HE2 LYS 86 HE2 LYS 86 6.202 32.475 7.602 1431 HE3 LYS 86 HE3 LYS 86 5.358 33.869 6.931 1432 HZ1 LYS 86 HZ1 LYS 86 7.207 35.256 7.409 1433 HZ2 LYS 86 HZ2 LYS 86 7.808 33.886 6.619 1434 HZ3 LYS 86 HZ3 LYS 86 7.989 34.040 8.293 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 18.680 27.057 0.472 2 H2 GLY 1 H2 GLY 1 18.278 26.929 -1.165 3 H3 GLY 1 H3 GLY 1 19.863 27.301 -0.709 4 HA2 GLY 1 HA3 GLY 1 18.498 24.758 -0.058 5 HA3 GLY 1 HA2 GLY 1 19.574 24.974 -1.432 6 H SER 2 H SER 2 19.339 24.398 1.935 7 HA SER 2 HA SER 2 21.964 25.069 2.729 8 HB2 SER 2 HB2 SER 2 20.523 22.781 4.004 9 HB3 SER 2 HB3 SER 2 21.392 24.122 4.755 10 HG SER 2 HG SER 2 19.661 25.484 4.194 11 H HIS 3 H HIS 3 23.840 23.852 2.811 12 HA HIS 3 HA HIS 3 24.187 21.884 0.803 13 HB2 HIS 3 HB2 HIS 3 25.936 23.503 1.773 14 HB3 HIS 3 HB3 HIS 3 26.092 22.350 3.093 15 HD1 HIS 3 HD1 HIS 3 28.570 21.934 2.368 16 HD2 HIS 3 HD2 HIS 3 25.723 20.836 -0.454 17 HE1 HIS 3 HE1 HIS 3 29.794 20.528 0.687 18 HE2 HIS 3 HE2 HIS 3 28.044 19.832 -0.984 19 H MET 4 H MET 4 23.281 19.958 0.953 20 HA MET 4 HA MET 4 23.608 18.428 3.446 21 HB2 MET 4 HB2 MET 4 21.190 18.636 1.653 22 HB3 MET 4 HB3 MET 4 21.406 17.312 2.787 23 HG2 MET 4 HG2 MET 4 21.332 18.790 4.650 24 HG3 MET 4 HG3 MET 4 21.397 20.205 3.601 25 HE1 MET 4 HE1 MET 4 19.356 21.274 2.421 26 HE2 MET 4 HE2 MET 4 17.898 20.368 2.016 27 HE3 MET 4 HE3 MET 4 19.455 19.876 1.351 28 H THR 5 H THR 5 22.654 16.011 2.606 29 HA THR 5 HA THR 5 24.431 15.320 0.365 30 HB THR 5 HB THR 5 23.750 13.473 2.652 31 HG1 THR 5 HG1 THR 5 25.916 15.309 2.363 32 HG21 THR 5 HG21 THR 5 25.730 12.263 1.893 33 HG22 THR 5 HG22 THR 5 25.998 13.470 0.635 34 HG23 THR 5 HG23 THR 5 24.568 12.440 0.578 35 H GLU 6 H GLU 6 23.136 14.945 -1.341 36 HA GLU 6 HA GLU 6 20.599 13.544 -0.938 37 HB2 GLU 6 HB2 GLU 6 21.739 15.027 -3.310 38 HB3 GLU 6 HB3 GLU 6 20.250 14.099 -3.383 39 HG2 GLU 6 HG2 GLU 6 19.460 16.214 -3.027 40 HG3 GLU 6 HG3 GLU 6 19.535 15.589 -1.380 41 H GLN 7 H GLN 7 20.119 11.615 -1.972 42 HA GLN 7 HA GLN 7 22.353 10.279 -3.327 43 HB2 GLN 7 HB2 GLN 7 22.064 8.271 -2.114 44 HB3 GLN 7 HB3 GLN 7 22.052 9.543 -0.907 45 HG2 GLN 7 HG2 GLN 7 19.537 8.343 -2.034 46 HG3 GLN 7 HG3 GLN 7 20.363 7.701 -0.617 47 HE21 GLN 7 HE21 GLN 7 18.366 10.203 -1.880 48 HE22 GLN 7 HE22 GLN 7 18.039 10.994 -0.374 49 HA PRO 8 HA PRO 8 19.298 9.235 -6.348 50 HB2 PRO 8 HB2 PRO 8 20.475 7.164 -7.579 51 HB3 PRO 8 HB3 PRO 8 21.158 8.789 -7.661 52 HG2 PRO 8 HG2 PRO 8 21.956 6.485 -5.929 53 HG3 PRO 8 HG3 PRO 8 22.982 7.619 -6.825 54 HD2 PRO 8 HD2 PRO 8 22.448 7.836 -4.144 55 HD3 PRO 8 HD3 PRO 8 22.863 9.211 -5.187 56 H LYS 9 H LYS 9 18.299 7.053 -7.351 57 HA LYS 9 HA LYS 9 16.733 5.892 -5.302 58 HB2 LYS 9 HB2 LYS 9 17.155 4.949 -8.147 59 HB3 LYS 9 HB3 LYS 9 15.876 4.401 -7.073 60 HG2 LYS 9 HG2 LYS 9 15.016 6.728 -6.997 61 HG3 LYS 9 HG3 LYS 9 16.240 7.176 -8.185 62 HD2 LYS 9 HD2 LYS 9 15.289 5.471 -9.728 63 HD3 LYS 9 HD3 LYS 9 14.007 5.175 -8.554 64 HE2 LYS 9 HE2 LYS 9 13.170 7.403 -8.811 65 HE3 LYS 9 HE3 LYS 9 14.567 7.873 -9.778 66 HZ1 LYS 9 HZ1 LYS 9 12.586 5.819 -10.587 67 HZ2 LYS 9 HZ2 LYS 9 13.858 6.423 -11.524 68 HZ3 LYS 9 HZ3 LYS 9 12.564 7.428 -11.107 69 H THR 10 H THR 10 17.541 4.516 -3.829 70 HA THR 10 HA THR 10 19.533 2.558 -4.732 71 HB THR 10 HB THR 10 20.283 4.196 -2.988 72 HG1 THR 10 HG1 THR 10 21.066 1.916 -3.236 73 HG21 THR 10 HG21 THR 10 18.331 2.700 -1.238 74 HG22 THR 10 HG22 THR 10 18.208 4.394 -1.716 75 HG23 THR 10 HG23 THR 10 19.530 3.864 -0.678 76 H ARG 11 H ARG 11 19.450 0.431 -3.782 77 HA ARG 11 HA ARG 11 16.698 -0.413 -3.234 78 HB2 ARG 11 HB2 ARG 11 17.573 -2.723 -3.746 79 HB3 ARG 11 HB3 ARG 11 17.573 -1.605 -5.102 80 HG2 ARG 11 HG2 ARG 11 19.920 -1.316 -4.979 81 HG3 ARG 11 HG3 ARG 11 20.011 -2.145 -3.422 82 HD2 ARG 11 HD2 ARG 11 19.615 -4.234 -4.391 83 HD3 ARG 11 HD3 ARG 11 18.950 -3.527 -5.864 84 HE ARG 11 HE ARG 11 21.443 -2.647 -6.005 85 HH11 ARG 11 HH11 ARG 11 20.281 -5.830 -5.109 86 HH12 ARG 11 HH12 ARG 11 21.649 -6.656 -5.773 87 HH21 ARG 11 HH21 ARG 11 23.249 -3.745 -6.885 88 HH22 ARG 11 HH22 ARG 11 23.339 -5.474 -6.774 89 H VAL 12 H VAL 12 16.235 -1.773 -1.469 90 HA VAL 12 HA VAL 12 18.374 -2.109 0.502 91 HB VAL 12 HB VAL 12 17.248 0.014 1.047 92 HG11 VAL 12 HG11 VAL 12 15.064 -0.276 0.187 93 HG12 VAL 12 HG12 VAL 12 14.892 -0.112 1.935 94 HG13 VAL 12 HG13 VAL 12 14.785 -1.703 1.182 95 HG21 VAL 12 HG21 VAL 12 16.785 -2.243 2.984 96 HG22 VAL 12 HG22 VAL 12 16.649 -0.538 3.405 97 HG23 VAL 12 HG23 VAL 12 18.198 -1.195 2.876 98 H SER 13 H SER 13 18.177 -3.878 1.792 99 HA SER 13 HA SER 13 15.986 -5.717 1.163 100 HB2 SER 13 HB2 SER 13 18.583 -6.337 2.591 101 HB3 SER 13 HB3 SER 13 17.433 -7.489 1.910 102 HG SER 13 HG SER 13 19.334 -5.892 0.636 103 H VAL 14 H VAL 14 14.364 -5.760 2.575 104 HA VAL 14 HA VAL 14 14.953 -5.170 5.408 105 HB VAL 14 HB VAL 14 12.577 -4.419 5.599 106 HG11 VAL 14 HG11 VAL 14 14.331 -2.889 3.685 107 HG12 VAL 14 HG12 VAL 14 14.358 -2.793 5.446 108 HG13 VAL 14 HG13 VAL 14 12.950 -2.219 4.554 109 HG21 VAL 14 HG21 VAL 14 11.851 -5.609 3.486 110 HG22 VAL 14 HG22 VAL 14 12.582 -4.274 2.594 111 HG23 VAL 14 HG23 VAL 14 11.243 -3.969 3.697 112 H ARG 15 H ARG 15 13.407 -6.205 6.957 113 HA ARG 15 HA ARG 15 12.753 -8.910 6.006 114 HB2 ARG 15 HB2 ARG 15 14.463 -8.464 7.905 115 HB3 ARG 15 HB3 ARG 15 13.042 -8.177 8.899 116 HG2 ARG 15 HG2 ARG 15 12.252 -10.477 8.052 117 HG3 ARG 15 HG3 ARG 15 13.935 -10.710 7.583 118 HD2 ARG 15 HD2 ARG 15 12.807 -10.270 10.329 119 HD3 ARG 15 HD3 ARG 15 13.749 -11.636 9.735 120 HE ARG 15 HE ARG 15 15.157 -9.137 9.633 121 HH11 ARG 15 HH11 ARG 15 14.326 -11.872 11.641 122 HH12 ARG 15 HH12 ARG 15 15.691 -11.671 12.693 123 HH21 ARG 15 HH21 ARG 15 16.938 -8.862 11.018 124 HH22 ARG 15 HH22 ARG 15 17.168 -9.953 12.349 125 H ILE 16 H ILE 16 10.679 -9.487 5.890 126 HA ILE 16 HA ILE 16 8.723 -8.185 7.652 127 HB ILE 16 HB ILE 16 8.346 -8.566 4.676 128 HG12 ILE 16 HG12 ILE 16 8.304 -5.958 6.174 129 HG13 ILE 16 HG13 ILE 16 9.801 -6.624 5.530 130 HG21 ILE 16 HG21 ILE 16 6.318 -8.957 6.084 131 HG22 ILE 16 HG22 ILE 16 6.165 -7.626 4.940 132 HG23 ILE 16 HG23 ILE 16 6.457 -7.293 6.647 133 HD11 ILE 16 HD11 ILE 16 7.349 -5.938 3.929 134 HD12 ILE 16 HD12 ILE 16 8.860 -6.584 3.287 135 HD13 ILE 16 HD13 ILE 16 8.828 -4.983 4.028 136 H TYR 17 H TYR 17 7.505 -9.643 8.649 137 HA TYR 17 HA TYR 17 6.568 -11.604 9.275 138 HB2 TYR 17 HB2 TYR 17 5.635 -11.055 6.743 139 HB3 TYR 17 HB3 TYR 17 6.214 -12.711 6.586 140 HD1 TYR 17 HD2 TYR 17 4.160 -10.616 8.899 141 HD2 TYR 17 HD1 TYR 17 4.761 -14.437 7.119 142 HE1 TYR 17 HE2 TYR 17 2.107 -11.438 9.978 143 HE2 TYR 17 HE1 TYR 17 2.710 -15.264 8.197 144 HH TYR 17 HH TYR 17 0.413 -13.255 9.603 145 H GLY 18 H GLY 18 9.450 -11.552 8.940 146 HA2 GLY 18 HA2 GLY 18 10.879 -13.328 9.635 147 HA3 GLY 18 HA3 GLY 18 9.847 -14.453 8.777 148 H GLN 19 H GLN 19 9.730 -13.326 6.272 149 HA GLN 19 HA GLN 19 12.372 -14.014 5.311 150 HB2 GLN 19 HB2 GLN 19 9.676 -13.785 4.133 151 HB3 GLN 19 HB3 GLN 19 11.000 -13.357 3.065 152 HG2 GLN 19 HG2 GLN 19 10.934 -15.935 4.594 153 HG3 GLN 19 HG3 GLN 19 10.199 -15.754 3.006 154 HE21 GLN 19 HE21 GLN 19 12.269 -13.913 2.063 155 HE22 GLN 19 HE22 GLN 19 13.672 -14.881 1.775 156 H ASP 20 H ASP 20 13.662 -12.735 3.970 157 HA ASP 20 HA ASP 20 13.304 -9.865 4.391 158 HB2 ASP 20 HB2 ASP 20 15.626 -9.605 4.008 159 HB3 ASP 20 HB3 ASP 20 15.487 -11.065 4.981 160 H TYR 21 H TYR 21 13.346 -8.403 2.676 161 HA TYR 21 HA TYR 21 13.154 -9.538 -0.028 162 HB2 TYR 21 HB2 TYR 21 11.231 -7.504 1.125 163 HB3 TYR 21 HB3 TYR 21 11.220 -8.118 -0.521 164 HD1 TYR 21 HD1 TYR 21 10.835 -10.644 -0.823 165 HD2 TYR 21 HD2 TYR 21 9.985 -8.558 2.784 166 HE1 TYR 21 HE1 TYR 21 9.323 -12.459 -0.142 167 HE2 TYR 21 HE2 TYR 21 8.473 -10.373 3.480 168 HH TYR 21 HH TYR 21 7.094 -12.165 2.303 169 H THR 22 H THR 22 14.315 -8.428 -1.482 170 HA THR 22 HA THR 22 15.494 -5.885 -0.687 171 HB THR 22 HB THR 22 16.098 -7.570 -3.127 172 HG1 THR 22 HG1 THR 22 17.602 -7.373 -0.703 173 HG21 THR 22 HG21 THR 22 18.174 -6.261 -3.216 174 HG22 THR 22 HG22 THR 22 17.633 -5.310 -1.832 175 HG23 THR 22 HG23 THR 22 16.756 -5.222 -3.361 176 H ILE 23 H ILE 23 14.314 -4.163 -1.139 177 HA ILE 23 HA ILE 23 12.890 -4.062 -3.723 178 HB ILE 23 HB ILE 23 11.231 -2.572 -2.622 179 HG12 ILE 23 HG12 ILE 23 12.504 -3.496 -0.033 180 HG13 ILE 23 HG13 ILE 23 12.748 -1.898 -0.730 181 HG21 ILE 23 HG21 ILE 23 11.463 -5.292 -1.338 182 HG22 ILE 23 HG22 ILE 23 10.826 -4.983 -2.953 183 HG23 ILE 23 HG23 ILE 23 9.990 -4.343 -1.539 184 HD11 ILE 23 HD11 ILE 23 10.295 -3.075 0.489 185 HD12 ILE 23 HD12 ILE 23 10.181 -1.724 -0.640 186 HD13 ILE 23 HD13 ILE 23 11.105 -1.552 0.853 187 H VAL 24 H VAL 24 12.243 -1.624 -4.121 188 HA VAL 24 HA VAL 24 14.751 -0.143 -4.139 189 HB VAL 24 HB VAL 24 12.153 0.540 -5.522 190 HG11 VAL 24 HG11 VAL 24 13.579 1.986 -6.921 191 HG12 VAL 24 HG12 VAL 24 14.961 1.583 -5.903 192 HG13 VAL 24 HG13 VAL 24 13.594 2.468 -5.225 193 HG21 VAL 24 HG21 VAL 24 13.037 -1.610 -6.303 194 HG22 VAL 24 HG22 VAL 24 14.592 -0.848 -6.638 195 HG23 VAL 24 HG23 VAL 24 13.159 -0.369 -7.549 196 H GLY 25 H GLY 25 15.118 1.199 -2.485 197 HA2 GLY 25 HA2 GLY 25 12.806 2.453 -1.157 198 HA3 GLY 25 HA3 GLY 25 14.378 2.184 -0.418 199 H ALA 26 H ALA 26 12.999 3.856 -3.234 200 HA ALA 26 HA ALA 26 15.076 5.862 -3.126 201 HB1 ALA 26 HB1 ALA 26 14.266 5.086 -5.282 202 HB2 ALA 26 HB2 ALA 26 13.955 6.810 -5.088 203 HB3 ALA 26 HB3 ALA 26 12.641 5.649 -4.895 204 H GLU 27 H GLU 27 14.563 6.615 -0.953 205 HA GLU 27 HA GLU 27 12.890 8.934 -1.052 206 HB2 GLU 27 HB2 GLU 27 11.122 7.408 -0.576 207 HB3 GLU 27 HB3 GLU 27 12.066 6.573 0.646 208 HG2 GLU 27 HG2 GLU 27 10.806 7.817 2.024 209 HG3 GLU 27 HG3 GLU 27 12.062 9.014 1.715 210 H SER 28 H SER 28 13.818 6.932 1.747 211 HA SER 28 HA SER 28 16.121 8.466 2.384 212 HB2 SER 28 HB2 SER 28 13.514 9.120 3.726 213 HB3 SER 28 HB3 SER 28 15.012 9.222 4.651 214 HG SER 28 HG SER 28 14.769 10.467 2.124 215 HA PRO 29 HA PRO 29 17.198 4.752 4.463 216 HB2 PRO 29 HB2 PRO 29 18.421 5.878 6.716 217 HB3 PRO 29 HB3 PRO 29 19.204 5.497 5.182 218 HG2 PRO 29 HG2 PRO 29 18.139 8.099 6.174 219 HG3 PRO 29 HG3 PRO 29 19.580 7.771 5.194 220 HD2 PRO 29 HD2 PRO 29 17.369 8.767 4.087 221 HD3 PRO 29 HD3 PRO 29 18.348 7.554 3.233 222 H ALA 30 H ALA 30 15.896 7.246 6.670 223 HA ALA 30 HA ALA 30 14.995 5.284 8.560 224 HB1 ALA 30 HB1 ALA 30 14.006 7.162 9.753 225 HB2 ALA 30 HB2 ALA 30 14.306 8.216 8.372 226 HB3 ALA 30 HB3 ALA 30 15.662 7.533 9.269 227 H HIS 31 H HIS 31 13.532 7.114 5.952 228 HA HIS 31 HA HIS 31 10.835 6.542 6.586 229 HB2 HIS 31 HB2 HIS 31 11.844 8.329 4.990 230 HB3 HIS 31 HB3 HIS 31 11.779 7.049 3.786 231 HD1 HIS 31 HD1 HIS 31 9.615 9.362 5.760 232 HD2 HIS 31 HD2 HIS 31 9.194 6.369 2.910 233 HE1 HIS 31 HE1 HIS 31 7.256 9.543 4.938 234 HE2 HIS 31 HE2 HIS 31 7.143 7.946 3.003 235 H ILE 32 H ILE 32 13.230 4.881 4.581 236 HA ILE 32 HA ILE 32 11.345 3.002 3.520 237 HB ILE 32 HB ILE 32 13.224 1.830 2.562 238 HG12 ILE 32 HG12 ILE 32 14.975 3.649 4.245 239 HG13 ILE 32 HG13 ILE 32 14.756 1.922 4.485 240 HG21 ILE 32 HG21 ILE 32 13.771 4.784 2.382 241 HG22 ILE 32 HG22 ILE 32 12.410 3.986 1.595 242 HG23 ILE 32 HG23 ILE 32 14.060 3.555 1.149 243 HD11 ILE 32 HD11 ILE 32 16.793 2.085 3.404 244 HD12 ILE 32 HD12 ILE 32 16.232 3.355 2.320 245 HD13 ILE 32 HD13 ILE 32 15.678 1.695 2.095 246 H ARG 33 H ARG 33 12.976 3.219 6.500 247 HA ARG 33 HA ARG 33 13.077 0.386 6.996 248 HB2 ARG 33 HB2 ARG 33 13.957 2.796 8.381 249 HB3 ARG 33 HB3 ARG 33 13.237 1.625 9.473 250 HG2 ARG 33 HG2 ARG 33 15.628 1.301 9.347 251 HG3 ARG 33 HG3 ARG 33 14.788 -0.087 8.658 252 HD2 ARG 33 HD2 ARG 33 15.299 0.573 6.451 253 HD3 ARG 33 HD3 ARG 33 15.801 2.181 6.965 254 HE ARG 33 HE ARG 33 17.315 -0.312 7.411 255 HH11 ARG 33 HH11 ARG 33 17.169 3.181 7.196 256 HH12 ARG 33 HH12 ARG 33 18.891 3.388 7.275 257 HH21 ARG 33 HH21 ARG 33 19.579 -0.047 7.504 258 HH22 ARG 33 HH22 ARG 33 20.266 1.544 7.428 259 H LEU 34 H LEU 34 10.998 3.071 8.026 260 HA LEU 34 HA LEU 34 9.346 1.492 9.695 261 HB2 LEU 34 HB2 LEU 34 7.787 3.378 9.664 262 HB3 LEU 34 HB3 LEU 34 9.431 3.879 9.995 263 HG LEU 34 HG LEU 34 9.371 4.315 7.334 264 HD11 LEU 34 HD11 LEU 34 6.559 4.862 8.268 265 HD12 LEU 34 HD12 LEU 34 7.031 3.584 7.148 266 HD13 LEU 34 HD13 LEU 34 7.246 5.276 6.698 267 HD21 LEU 34 HD21 LEU 34 10.059 5.946 8.958 268 HD22 LEU 34 HD22 LEU 34 8.402 6.138 9.531 269 HD23 LEU 34 HD23 LEU 34 8.843 6.673 7.910 270 H VAL 35 H VAL 35 9.471 1.891 6.288 271 HA VAL 35 HA VAL 35 6.823 1.319 5.565 272 HB VAL 35 HB VAL 35 9.369 0.581 4.100 273 HG11 VAL 35 HG11 VAL 35 6.535 0.715 3.075 274 HG12 VAL 35 HG12 VAL 35 7.478 -0.755 3.325 275 HG13 VAL 35 HG13 VAL 35 7.973 0.414 2.099 276 HG21 VAL 35 HG21 VAL 35 8.949 3.028 4.585 277 HG22 VAL 35 HG22 VAL 35 7.539 2.898 3.535 278 HG23 VAL 35 HG23 VAL 35 9.149 2.596 2.887 279 H ALA 36 H ALA 36 9.589 -0.829 6.087 280 HA ALA 36 HA ALA 36 8.269 -3.246 5.529 281 HB1 ALA 36 HB1 ALA 36 10.579 -2.898 7.425 282 HB2 ALA 36 HB2 ALA 36 10.747 -2.869 5.670 283 HB3 ALA 36 HB3 ALA 36 10.162 -4.326 6.477 284 H ALA 37 H ALA 37 8.844 -1.541 8.580 285 HA ALA 37 HA ALA 37 7.743 -3.472 10.292 286 HB1 ALA 37 HB1 ALA 37 9.165 -1.624 11.055 287 HB2 ALA 37 HB2 ALA 37 7.647 -1.705 11.953 288 HB3 ALA 37 HB3 ALA 37 7.863 -0.488 10.694 289 H PHE 38 H PHE 38 6.257 -0.746 8.590 290 HA PHE 38 HA PHE 38 3.730 -0.901 9.826 291 HB2 PHE 38 HB2 PHE 38 4.493 1.037 8.495 292 HB3 PHE 38 HB3 PHE 38 4.393 0.060 7.033 293 HD1 PHE 38 HD1 PHE 38 2.300 1.191 9.894 294 HD2 PHE 38 HD2 PHE 38 2.461 0.117 5.784 295 HE1 PHE 38 HE1 PHE 38 -0.059 1.836 9.636 296 HE2 PHE 38 HE2 PHE 38 0.103 0.760 5.521 297 HZ PHE 38 HZ PHE 38 -1.162 1.621 7.448 298 H VAL 39 H VAL 39 4.987 -2.406 6.872 299 HA VAL 39 HA VAL 39 2.552 -3.644 6.126 300 HB VAL 39 HB VAL 39 5.392 -4.402 5.420 301 HG11 VAL 39 HG11 VAL 39 3.864 -6.283 5.060 302 HG12 VAL 39 HG12 VAL 39 4.420 -5.614 3.528 303 HG13 VAL 39 HG13 VAL 39 2.800 -5.242 4.115 304 HG21 VAL 39 HG21 VAL 39 5.318 -2.869 3.773 305 HG22 VAL 39 HG22 VAL 39 4.119 -2.105 4.813 306 HG23 VAL 39 HG23 VAL 39 3.601 -3.120 3.468 307 H ASP 40 H ASP 40 5.410 -4.883 7.853 308 HA ASP 40 HA ASP 40 4.467 -7.495 8.264 309 HB2 ASP 40 HB2 ASP 40 6.787 -7.023 8.657 310 HB3 ASP 40 HB3 ASP 40 6.395 -5.789 9.849 311 H ASP 41 H ASP 41 3.984 -4.514 10.030 312 HA ASP 41 HA ASP 41 2.722 -5.625 12.309 313 HB2 ASP 41 HB2 ASP 41 3.485 -3.048 11.531 314 HB3 ASP 41 HB3 ASP 41 1.731 -2.969 11.665 315 H LYS 42 H LYS 42 1.444 -4.267 9.292 316 HA LYS 42 HA LYS 42 -1.284 -4.637 9.935 317 HB2 LYS 42 HB2 LYS 42 0.241 -4.130 7.418 318 HB3 LYS 42 HB3 LYS 42 -1.438 -4.635 7.297 319 HG2 LYS 42 HG2 LYS 42 -0.855 -2.420 9.163 320 HG3 LYS 42 HG3 LYS 42 -0.690 -2.074 7.439 321 HD2 LYS 42 HD2 LYS 42 -2.965 -2.769 7.034 322 HD3 LYS 42 HD3 LYS 42 -3.137 -3.305 8.711 323 HE2 LYS 42 HE2 LYS 42 -2.738 -0.956 9.436 324 HE3 LYS 42 HE3 LYS 42 -2.752 -0.471 7.739 325 HZ1 LYS 42 HZ1 LYS 42 -4.917 -0.084 8.397 326 HZ2 LYS 42 HZ2 LYS 42 -4.972 -1.439 9.416 327 HZ3 LYS 42 HZ3 LYS 42 -5.044 -1.642 7.743 328 H MET 43 H MET 43 1.121 -6.697 8.406 329 HA MET 43 HA MET 43 -0.555 -8.697 7.427 330 HB2 MET 43 HB2 MET 43 2.290 -8.712 8.375 331 HB3 MET 43 HB3 MET 43 1.507 -10.196 7.852 332 HG2 MET 43 HG2 MET 43 0.916 -8.725 5.744 333 HG3 MET 43 HG3 MET 43 2.337 -7.828 6.275 334 HE1 MET 43 HE1 MET 43 2.260 -12.205 4.843 335 HE2 MET 43 HE2 MET 43 0.902 -11.081 4.798 336 HE3 MET 43 HE3 MET 43 1.460 -11.730 6.340 337 H HIS 44 H HIS 44 1.196 -8.676 10.554 338 HA HIS 44 HA HIS 44 -0.164 -11.000 11.471 339 HB2 HIS 44 HB2 HIS 44 0.918 -10.700 13.569 340 HB3 HIS 44 HB3 HIS 44 2.072 -10.237 12.330 341 HD1 HIS 44 HD1 HIS 44 -0.304 -8.588 14.814 342 HD2 HIS 44 HD2 HIS 44 3.211 -7.798 12.733 343 HE1 HIS 44 HE1 HIS 44 0.521 -6.386 15.690 344 HE2 HIS 44 HE2 HIS 44 2.561 -5.847 14.309 345 H GLU 45 H GLU 45 -1.030 -7.699 11.349 346 HA GLU 45 HA GLU 45 -2.837 -7.579 13.511 347 HB2 GLU 45 HB2 GLU 45 -2.239 -5.502 12.610 348 HB3 GLU 45 HB3 GLU 45 -2.508 -6.036 10.958 349 HG2 GLU 45 HG2 GLU 45 -4.877 -5.904 11.215 350 HG3 GLU 45 HG3 GLU 45 -4.734 -5.650 12.954 351 H PHE 46 H PHE 46 -3.420 -8.148 10.041 352 HA PHE 46 HA PHE 46 -6.158 -8.835 10.517 353 HB2 PHE 46 HB2 PHE 46 -4.414 -8.868 8.068 354 HB3 PHE 46 HB3 PHE 46 -6.065 -9.492 8.043 355 HD1 PHE 46 HD1 PHE 46 -7.950 -7.970 8.619 356 HD2 PHE 46 HD2 PHE 46 -3.983 -6.554 8.035 357 HE1 PHE 46 HE1 PHE 46 -8.811 -5.682 8.344 358 HE2 PHE 46 HE2 PHE 46 -4.836 -4.264 7.755 359 HZ PHE 46 HZ PHE 46 -7.253 -3.825 7.910 360 H SER 47 H SER 47 -3.264 -10.553 10.759 361 HA SER 47 HA SER 47 -4.044 -13.136 9.982 362 HB2 SER 47 HB2 SER 47 -2.154 -12.335 12.215 363 HB3 SER 47 HB3 SER 47 -2.261 -13.937 11.492 364 HG SER 47 HG SER 47 -1.768 -11.692 9.863 365 H GLU 48 H GLU 48 -4.833 -11.208 12.736 366 HA GLU 48 HA GLU 48 -5.730 -13.295 14.456 367 HB2 GLU 48 HB2 GLU 48 -5.011 -11.054 15.240 368 HB3 GLU 48 HB3 GLU 48 -6.423 -10.350 14.463 369 HG2 GLU 48 HG2 GLU 48 -6.888 -10.561 16.780 370 HG3 GLU 48 HG3 GLU 48 -7.847 -11.767 15.923 371 H LYS 49 H LYS 49 -7.145 -11.566 11.811 372 HA LYS 49 HA LYS 49 -9.865 -12.207 12.564 373 HB2 LYS 49 HB2 LYS 49 -8.802 -11.016 9.999 374 HB3 LYS 49 HB3 LYS 49 -10.493 -11.124 10.459 375 HG2 LYS 49 HG2 LYS 49 -8.429 -9.570 12.001 376 HG3 LYS 49 HG3 LYS 49 -9.470 -8.875 10.763 377 HD2 LYS 49 HD2 LYS 49 -10.488 -10.264 13.241 378 HD3 LYS 49 HD3 LYS 49 -10.264 -8.524 13.107 379 HE2 LYS 49 HE2 LYS 49 -12.459 -8.627 12.538 380 HE3 LYS 49 HE3 LYS 49 -11.766 -8.900 10.940 381 HZ1 LYS 49 HZ1 LYS 49 -13.597 -10.455 11.710 382 HZ2 LYS 49 HZ2 LYS 49 -12.450 -11.145 12.743 383 HZ3 LYS 49 HZ3 LYS 49 -12.211 -11.175 11.071 384 H GLN 50 H GLN 50 -7.382 -13.448 10.453 385 HA GLN 50 HA GLN 50 -7.256 -15.254 9.071 386 HB2 GLN 50 HB2 GLN 50 -9.267 -16.267 11.086 387 HB3 GLN 50 HB3 GLN 50 -8.512 -17.285 9.867 388 HG2 GLN 50 HG2 GLN 50 -6.415 -17.122 10.848 389 HG3 GLN 50 HG3 GLN 50 -6.850 -15.677 11.762 390 HE21 GLN 50 HE21 GLN 50 -5.703 -18.228 12.641 391 HE22 GLN 50 HE22 GLN 50 -6.780 -18.834 13.851 392 HA PRO 51 HA PRO 51 -11.054 -13.777 6.771 393 HB2 PRO 51 HB2 PRO 51 -9.641 -13.462 4.413 394 HB3 PRO 51 HB3 PRO 51 -9.964 -12.180 5.584 395 HG2 PRO 51 HG2 PRO 51 -7.503 -13.811 5.186 396 HG3 PRO 51 HG3 PRO 51 -7.659 -12.107 5.634 397 HD2 PRO 51 HD2 PRO 51 -7.045 -14.019 7.433 398 HD3 PRO 51 HD3 PRO 51 -8.001 -12.585 7.860 399 H MET 52 H MET 52 -8.477 -15.722 5.224 400 HA MET 52 HA MET 52 -10.556 -17.652 4.448 401 HB2 MET 52 HB2 MET 52 -8.184 -16.678 2.858 402 HB3 MET 52 HB3 MET 52 -9.083 -18.128 2.437 403 HG2 MET 52 HG2 MET 52 -11.128 -16.765 2.242 404 HG3 MET 52 HG3 MET 52 -10.162 -15.323 2.564 405 HE1 MET 52 HE1 MET 52 -12.083 -15.955 0.010 406 HE2 MET 52 HE2 MET 52 -11.137 -15.263 -1.305 407 HE3 MET 52 HE3 MET 52 -11.297 -14.394 0.224 408 H LEU 53 H LEU 53 -8.321 -17.336 6.619 409 HA LEU 53 HA LEU 53 -6.823 -18.632 7.730 410 HB2 LEU 53 HB2 LEU 53 -8.792 -20.628 6.663 411 HB3 LEU 53 HB3 LEU 53 -7.440 -21.134 7.659 412 HG LEU 53 HG LEU 53 -9.309 -18.997 8.620 413 HD11 LEU 53 HD11 LEU 53 -9.703 -21.974 8.795 414 HD12 LEU 53 HD12 LEU 53 -10.778 -20.799 8.038 415 HD13 LEU 53 HD13 LEU 53 -10.557 -20.796 9.788 416 HD21 LEU 53 HD21 LEU 53 -7.574 -21.043 9.995 417 HD22 LEU 53 HD22 LEU 53 -8.606 -19.869 10.808 418 HD23 LEU 53 HD23 LEU 53 -7.235 -19.318 9.843 419 H ASP 54 H ASP 54 -5.611 -17.781 5.585 420 HA ASP 54 HA ASP 54 -3.786 -19.892 4.917 421 HB2 ASP 54 HB2 ASP 54 -5.697 -20.132 3.260 422 HB3 ASP 54 HB3 ASP 54 -5.237 -18.556 2.631 423 H VAL 55 H VAL 55 -1.787 -19.060 4.582 424 HA VAL 55 HA VAL 55 -1.242 -16.405 5.225 425 HB VAL 55 HB VAL 55 0.552 -18.348 3.772 426 HG11 VAL 55 HG11 VAL 55 1.245 -15.828 5.278 427 HG12 VAL 55 HG12 VAL 55 1.344 -16.054 3.532 428 HG13 VAL 55 HG13 VAL 55 2.400 -16.976 4.601 429 HG21 VAL 55 HG21 VAL 55 1.476 -18.808 5.988 430 HG22 VAL 55 HG22 VAL 55 -0.241 -19.197 5.919 431 HG23 VAL 55 HG23 VAL 55 0.295 -17.716 6.710 432 HA PRO 56 HA PRO 56 -0.249 -15.511 0.506 433 HB2 PRO 56 HB2 PRO 56 -1.787 -17.090 -1.197 434 HB3 PRO 56 HB3 PRO 56 -0.057 -17.278 -0.905 435 HG2 PRO 56 HG2 PRO 56 -2.356 -18.765 0.274 436 HG3 PRO 56 HG3 PRO 56 -0.749 -19.358 -0.182 437 HD2 PRO 56 HD2 PRO 56 -1.407 -18.923 2.384 438 HD3 PRO 56 HD3 PRO 56 0.228 -18.590 1.776 439 H LYS 57 H LYS 57 -3.408 -16.715 1.527 440 HA LYS 57 HA LYS 57 -4.897 -14.852 -0.050 441 HB2 LYS 57 HB2 LYS 57 -5.795 -16.442 2.359 442 HB3 LYS 57 HB3 LYS 57 -6.839 -15.640 1.195 443 HG2 LYS 57 HG2 LYS 57 -5.020 -17.977 0.654 444 HG3 LYS 57 HG3 LYS 57 -6.779 -18.011 0.757 445 HD2 LYS 57 HD2 LYS 57 -6.563 -16.181 -1.144 446 HD3 LYS 57 HD3 LYS 57 -5.019 -16.991 -1.414 447 HE2 LYS 57 HE2 LYS 57 -7.724 -18.323 -1.366 448 HE3 LYS 57 HE3 LYS 57 -6.803 -17.925 -2.815 449 HZ1 LYS 57 HZ1 LYS 57 -5.100 -19.456 -2.158 450 HZ2 LYS 57 HZ2 LYS 57 -6.584 -20.262 -2.126 451 HZ3 LYS 57 HZ3 LYS 57 -5.861 -19.763 -0.681 452 H LEU 58 H LEU 58 -3.382 -14.786 3.041 453 HA LEU 58 HA LEU 58 -4.890 -12.526 4.026 454 HB2 LEU 58 HB2 LEU 58 -4.014 -14.225 5.558 455 HB3 LEU 58 HB3 LEU 58 -2.378 -13.854 5.047 456 HG LEU 58 HG LEU 58 -3.077 -11.421 5.891 457 HD11 LEU 58 HD11 LEU 58 -4.431 -11.603 7.924 458 HD12 LEU 58 HD12 LEU 58 -4.757 -13.295 7.546 459 HD13 LEU 58 HD13 LEU 58 -5.348 -12.022 6.477 460 HD21 LEU 58 HD21 LEU 58 -2.032 -11.997 8.044 461 HD22 LEU 58 HD22 LEU 58 -1.150 -12.658 6.668 462 HD23 LEU 58 HD23 LEU 58 -2.181 -13.709 7.640 463 H ALA 59 H ALA 59 -1.769 -13.162 2.556 464 HA ALA 59 HA ALA 59 -0.631 -10.611 2.959 465 HB1 ALA 59 HB1 ALA 59 0.978 -11.285 1.227 466 HB2 ALA 59 HB2 ALA 59 -0.032 -12.682 0.851 467 HB3 ALA 59 HB3 ALA 59 0.729 -12.545 2.436 468 H VAL 60 H VAL 60 -2.524 -11.962 0.263 469 HA VAL 60 HA VAL 60 -2.248 -9.640 -1.372 470 HB VAL 60 HB VAL 60 -4.115 -10.501 -2.726 471 HG11 VAL 60 HG11 VAL 60 -1.822 -11.356 -3.065 472 HG12 VAL 60 HG12 VAL 60 -3.069 -12.517 -3.519 473 HG13 VAL 60 HG13 VAL 60 -2.199 -12.709 -1.999 474 HG21 VAL 60 HG21 VAL 60 -5.299 -11.465 -0.657 475 HG22 VAL 60 HG22 VAL 60 -4.296 -12.889 -0.931 476 HG23 VAL 60 HG23 VAL 60 -5.415 -12.349 -2.178 477 H LEU 61 H LEU 61 -4.372 -10.561 1.196 478 HA LEU 61 HA LEU 61 -6.432 -8.678 0.711 479 HB2 LEU 61 HB2 LEU 61 -6.595 -10.723 2.163 480 HB3 LEU 61 HB3 LEU 61 -5.628 -9.877 3.356 481 HG LEU 61 HG LEU 61 -7.491 -8.060 3.219 482 HD11 LEU 61 HD11 LEU 61 -8.625 -8.978 1.272 483 HD12 LEU 61 HD12 LEU 61 -9.696 -8.971 2.675 484 HD13 LEU 61 HD13 LEU 61 -8.941 -10.475 2.150 485 HD21 LEU 61 HD21 LEU 61 -8.218 -10.690 4.484 486 HD22 LEU 61 HD22 LEU 61 -8.637 -9.068 5.030 487 HD23 LEU 61 HD23 LEU 61 -6.969 -9.628 5.134 488 H THR 62 H THR 62 -3.553 -8.650 2.793 489 HA THR 62 HA THR 62 -4.086 -6.117 3.931 490 HB THR 62 HB THR 62 -1.380 -6.325 4.151 491 HG1 THR 62 HG1 THR 62 -2.350 -9.007 4.142 492 HG21 THR 62 HG21 THR 62 -1.784 -7.268 6.333 493 HG22 THR 62 HG22 THR 62 -3.385 -7.812 5.836 494 HG23 THR 62 HG23 THR 62 -3.036 -6.086 5.961 495 H ALA 63 H ALA 63 -2.467 -7.142 1.014 496 HA ALA 63 HA ALA 63 -1.066 -4.799 0.405 497 HB1 ALA 63 HB1 ALA 63 -1.068 -5.598 -1.905 498 HB2 ALA 63 HB2 ALA 63 -2.308 -6.784 -1.499 499 HB3 ALA 63 HB3 ALA 63 -0.704 -6.901 -0.775 500 H VAL 64 H VAL 64 -4.404 -5.743 -0.339 501 HA VAL 64 HA VAL 64 -4.922 -3.312 -1.789 502 HB VAL 64 HB VAL 64 -6.049 -5.565 -2.199 503 HG11 VAL 64 HG11 VAL 64 -7.748 -4.669 0.120 504 HG12 VAL 64 HG12 VAL 64 -6.674 -6.066 0.100 505 HG13 VAL 64 HG13 VAL 64 -8.088 -6.026 -0.952 506 HG21 VAL 64 HG21 VAL 64 -6.767 -3.555 -3.323 507 HG22 VAL 64 HG22 VAL 64 -7.741 -3.087 -1.928 508 HG23 VAL 64 HG23 VAL 64 -8.174 -4.515 -2.868 509 H GLN 65 H GLN 65 -5.175 -4.355 1.503 510 HA GLN 65 HA GLN 65 -7.004 -2.294 2.303 511 HB2 GLN 65 HB2 GLN 65 -5.260 -4.222 3.829 512 HB3 GLN 65 HB3 GLN 65 -6.235 -2.997 4.637 513 HG2 GLN 65 HG2 GLN 65 -8.250 -3.973 3.949 514 HG3 GLN 65 HG3 GLN 65 -7.465 -4.916 2.683 515 HE21 GLN 65 HE21 GLN 65 -9.236 -5.785 4.799 516 HE22 GLN 65 HE22 GLN 65 -8.367 -6.963 5.711 517 H ILE 66 H ILE 66 -3.494 -2.773 2.490 518 HA ILE 66 HA ILE 66 -2.904 -0.387 3.856 519 HB ILE 66 HB ILE 66 -1.275 -2.109 1.994 520 HG12 ILE 66 HG12 ILE 66 -0.864 -1.565 4.934 521 HG13 ILE 66 HG13 ILE 66 -1.950 -2.827 4.360 522 HG21 ILE 66 HG21 ILE 66 -0.345 0.053 1.668 523 HG22 ILE 66 HG22 ILE 66 0.707 -0.790 2.803 524 HG23 ILE 66 HG23 ILE 66 -0.433 0.419 3.389 525 HD11 ILE 66 HD11 ILE 66 0.049 -3.746 3.083 526 HD12 ILE 66 HD12 ILE 66 0.065 -3.913 4.837 527 HD13 ILE 66 HD13 ILE 66 1.029 -2.656 4.066 528 H ALA 67 H ALA 67 -3.360 -1.107 0.444 529 HA ALA 67 HA ALA 67 -2.472 1.346 -0.601 530 HB1 ALA 67 HB1 ALA 67 -3.681 0.731 -2.620 531 HB2 ALA 67 HB2 ALA 67 -4.550 -0.525 -1.736 532 HB3 ALA 67 HB3 ALA 67 -2.809 -0.657 -1.970 533 H SER 68 H SER 68 -5.721 0.267 0.391 534 HA SER 68 HA SER 68 -7.022 2.666 -0.362 535 HB2 SER 68 HB2 SER 68 -8.683 1.680 1.522 536 HB3 SER 68 HB3 SER 68 -8.602 1.051 -0.124 537 HG SER 68 HG SER 68 -7.594 -0.705 0.575 538 H GLU 69 H GLU 69 -5.113 1.793 2.347 539 HA GLU 69 HA GLU 69 -6.109 3.660 4.215 540 HB2 GLU 69 HB2 GLU 69 -3.457 2.252 3.963 541 HB3 GLU 69 HB3 GLU 69 -3.816 3.358 5.280 542 HG2 GLU 69 HG2 GLU 69 -5.598 1.028 4.687 543 HG3 GLU 69 HG3 GLU 69 -4.140 0.847 5.661 544 H TYR 70 H TYR 70 -3.715 3.877 1.652 545 HA TYR 70 HA TYR 70 -3.170 6.646 2.454 546 HB2 TYR 70 HB2 TYR 70 -1.642 4.753 0.676 547 HB3 TYR 70 HB3 TYR 70 -1.215 6.449 0.891 548 HD1 TYR 70 HD1 TYR 70 -0.903 7.221 3.364 549 HD2 TYR 70 HD2 TYR 70 -0.711 3.165 2.099 550 HE1 TYR 70 HE1 TYR 70 0.340 6.649 5.404 551 HE2 TYR 70 HE2 TYR 70 0.534 2.581 4.138 552 HH TYR 70 HH TYR 70 1.978 3.732 5.807 553 H LEU 71 H LEU 71 -4.706 4.812 -0.055 554 HA LEU 71 HA LEU 71 -4.540 6.678 -2.147 555 HB2 LEU 71 HB2 LEU 71 -6.306 4.400 -1.494 556 HB3 LEU 71 HB3 LEU 71 -6.950 5.571 -2.625 557 HG LEU 71 HG LEU 71 -4.229 4.350 -3.051 558 HD11 LEU 71 HD11 LEU 71 -5.745 2.462 -2.856 559 HD12 LEU 71 HD12 LEU 71 -5.266 2.696 -4.535 560 HD13 LEU 71 HD13 LEU 71 -6.861 3.217 -3.997 561 HD21 LEU 71 HD21 LEU 71 -4.892 6.359 -4.340 562 HD22 LEU 71 HD22 LEU 71 -6.250 5.450 -5.003 563 HD23 LEU 71 HD23 LEU 71 -4.595 4.945 -5.349 564 H LYS 72 H LYS 72 -6.791 6.415 0.551 565 HA LYS 72 HA LYS 72 -8.397 8.611 -0.375 566 HB2 LYS 72 HB2 LYS 72 -9.665 8.352 1.660 567 HB3 LYS 72 HB3 LYS 72 -9.361 6.772 0.960 568 HG2 LYS 72 HG2 LYS 72 -7.461 6.530 2.602 569 HG3 LYS 72 HG3 LYS 72 -8.061 7.994 3.384 570 HD2 LYS 72 HD2 LYS 72 -10.243 6.901 3.722 571 HD3 LYS 72 HD3 LYS 72 -9.620 5.439 2.960 572 HE2 LYS 72 HE2 LYS 72 -8.627 6.691 5.518 573 HE3 LYS 72 HE3 LYS 72 -9.592 5.225 5.377 574 HZ1 LYS 72 HZ1 LYS 72 -6.764 5.654 4.667 575 HZ2 LYS 72 HZ2 LYS 72 -7.648 4.411 3.934 576 HZ3 LYS 72 HZ3 LYS 72 -7.450 4.426 5.615 577 H LEU 73 H LEU 73 -5.384 8.503 0.881 578 HA LEU 73 HA LEU 73 -5.646 10.941 2.468 579 HB2 LEU 73 HB2 LEU 73 -4.335 8.926 3.287 580 HB3 LEU 73 HB3 LEU 73 -3.174 9.263 2.024 581 HG LEU 73 HG LEU 73 -2.621 10.037 4.397 582 HD11 LEU 73 HD11 LEU 73 -2.511 12.065 2.174 583 HD12 LEU 73 HD12 LEU 73 -1.366 10.749 2.430 584 HD13 LEU 73 HD13 LEU 73 -1.501 12.045 3.619 585 HD21 LEU 73 HD21 LEU 73 -4.368 12.385 3.727 586 HD22 LEU 73 HD22 LEU 73 -3.552 12.013 5.243 587 HD23 LEU 73 HD23 LEU 73 -4.933 11.046 4.729 588 H LYS 74 H LYS 74 -3.900 9.630 -0.330 589 HA LYS 74 HA LYS 74 -2.570 12.027 -1.009 590 HB2 LYS 74 HB2 LYS 74 -2.141 10.965 -3.177 591 HB3 LYS 74 HB3 LYS 74 -1.815 9.866 -1.846 592 HG2 LYS 74 HG2 LYS 74 -3.071 8.368 -2.886 593 HG3 LYS 74 HG3 LYS 74 -4.471 9.382 -2.530 594 HD2 LYS 74 HD2 LYS 74 -4.556 9.025 -4.849 595 HD3 LYS 74 HD3 LYS 74 -3.882 10.646 -4.670 596 HE2 LYS 74 HE2 LYS 74 -1.634 9.753 -4.979 597 HE3 LYS 74 HE3 LYS 74 -2.292 8.126 -5.124 598 HZ1 LYS 74 HZ1 LYS 74 -2.769 10.394 -6.973 599 HZ2 LYS 74 HZ2 LYS 74 -3.521 8.886 -7.091 600 HZ3 LYS 74 HZ3 LYS 74 -1.848 9.010 -7.284 601 H GLU 75 H GLU 75 -5.786 10.889 -1.591 602 HA GLU 75 HA GLU 75 -6.384 12.681 -3.731 603 HB2 GLU 75 HB2 GLU 75 -7.609 10.515 -3.090 604 HB3 GLU 75 HB3 GLU 75 -8.392 11.466 -1.838 605 HG2 GLU 75 HG2 GLU 75 -9.767 11.251 -3.854 606 HG3 GLU 75 HG3 GLU 75 -9.362 12.930 -3.490 607 H GLU 76 H GLU 76 -6.614 12.763 -0.241 608 HA GLU 76 HA GLU 76 -8.212 15.020 0.117 609 HB2 GLU 76 HB2 GLU 76 -7.478 13.406 1.887 610 HB3 GLU 76 HB3 GLU 76 -5.891 14.160 1.850 611 HG2 GLU 76 HG2 GLU 76 -7.117 15.023 3.704 612 HG3 GLU 76 HG3 GLU 76 -6.941 16.300 2.502 613 H TYR 77 H TYR 77 -4.727 14.730 -0.379 614 HA TYR 77 HA TYR 77 -3.993 17.380 0.087 615 HB2 TYR 77 HB2 TYR 77 -2.238 15.816 -0.097 616 HB3 TYR 77 HB3 TYR 77 -2.821 15.209 -1.641 617 HD1 TYR 77 HD2 TYR 77 -1.974 18.626 -0.371 618 HD2 TYR 77 HD1 TYR 77 -1.289 15.633 -3.316 619 HE1 TYR 77 HE2 TYR 77 -0.460 20.148 -1.554 620 HE2 TYR 77 HE1 TYR 77 0.237 17.153 -4.507 621 HH TYR 77 HH TYR 77 1.474 19.107 -4.258 622 H GLN 78 H GLN 78 -5.025 15.821 -2.928 623 HA GLN 78 HA GLN 78 -4.726 18.137 -4.539 624 HB2 GLN 78 HB2 GLN 78 -6.388 15.648 -4.968 625 HB3 GLN 78 HB3 GLN 78 -6.057 16.858 -6.200 626 HG2 GLN 78 HG2 GLN 78 -3.791 16.303 -6.299 627 HG3 GLN 78 HG3 GLN 78 -3.848 15.430 -4.769 628 HE21 GLN 78 HE21 GLN 78 -4.658 13.348 -4.717 629 HE22 GLN 78 HE22 GLN 78 -4.920 12.418 -6.152 630 H ARG 79 H ARG 79 -7.283 16.927 -2.512 631 HA ARG 79 HA ARG 79 -9.364 18.549 -3.623 632 HB2 ARG 79 HB2 ARG 79 -9.186 17.105 -0.973 633 HB3 ARG 79 HB3 ARG 79 -10.638 17.870 -1.606 634 HG2 ARG 79 HG2 ARG 79 -9.178 15.665 -3.036 635 HG3 ARG 79 HG3 ARG 79 -10.500 15.388 -1.903 636 HD2 ARG 79 HD2 ARG 79 -10.777 17.215 -4.270 637 HD3 ARG 79 HD3 ARG 79 -11.092 15.484 -4.376 638 HE ARG 79 HE ARG 79 -12.700 15.970 -2.436 639 HH11 ARG 79 HH11 ARG 79 -11.991 18.247 -5.008 640 HH12 ARG 79 HH12 ARG 79 -13.574 18.965 -4.966 641 HH21 ARG 79 HH21 ARG 79 -14.765 16.941 -2.360 642 HH22 ARG 79 HH22 ARG 79 -15.147 18.230 -3.459 643 H LEU 80 H LEU 80 -7.009 18.861 -1.097 644 HA LEU 80 HA LEU 80 -8.164 21.177 0.110 645 HB2 LEU 80 HB2 LEU 80 -6.735 19.698 1.378 646 HB3 LEU 80 HB3 LEU 80 -5.412 19.962 0.259 647 HG LEU 80 HG LEU 80 -5.485 22.410 0.980 648 HD11 LEU 80 HD11 LEU 80 -7.693 22.389 1.991 649 HD12 LEU 80 HD12 LEU 80 -6.468 22.848 3.175 650 HD13 LEU 80 HD13 LEU 80 -7.147 21.221 3.193 651 HD21 LEU 80 HD21 LEU 80 -3.716 20.912 1.695 652 HD22 LEU 80 HD22 LEU 80 -4.737 20.290 2.991 653 HD23 LEU 80 HD23 LEU 80 -4.190 21.966 3.027 654 H ARG 81 H ARG 81 -5.501 20.602 -2.147 655 HA ARG 81 HA ARG 81 -4.706 23.315 -2.312 656 HB2 ARG 81 HB2 ARG 81 -4.133 20.879 -3.959 657 HB3 ARG 81 HB3 ARG 81 -3.550 22.459 -4.461 658 HG2 ARG 81 HG2 ARG 81 -3.000 21.907 -1.664 659 HG3 ARG 81 HG3 ARG 81 -2.279 20.718 -2.745 660 HD2 ARG 81 HD2 ARG 81 -1.972 23.593 -3.441 661 HD3 ARG 81 HD3 ARG 81 -1.039 22.970 -2.083 662 HE ARG 81 HE ARG 81 -0.266 21.206 -3.746 663 HH11 ARG 81 HH11 ARG 81 -1.087 24.493 -4.656 664 HH12 ARG 81 HH12 ARG 81 -0.065 24.489 -6.054 665 HH21 ARG 81 HH21 ARG 81 1.060 21.196 -5.575 666 HH22 ARG 81 HH22 ARG 81 1.151 22.600 -6.588 667 H GLU 82 H GLU 82 -7.041 21.434 -4.171 668 HA GLU 82 HA GLU 82 -7.265 23.272 -6.316 669 HB2 GLU 82 HB2 GLU 82 -9.262 22.073 -6.946 670 HB3 GLU 82 HB3 GLU 82 -8.040 20.920 -6.434 671 HG2 GLU 82 HG2 GLU 82 -9.135 20.610 -4.326 672 HG3 GLU 82 HG3 GLU 82 -10.285 21.893 -4.688 673 H GLN 83 H GLN 83 -8.744 23.124 -3.153 674 HA GLN 83 HA GLN 83 -10.529 25.331 -3.844 675 HB2 GLN 83 HB2 GLN 83 -11.678 24.916 -1.790 676 HB3 GLN 83 HB3 GLN 83 -11.409 23.367 -2.574 677 HG2 GLN 83 HG2 GLN 83 -9.427 23.053 -1.077 678 HG3 GLN 83 HG3 GLN 83 -9.934 24.505 -0.214 679 HE21 GLN 83 HE21 GLN 83 -10.264 23.375 1.689 680 HE22 GLN 83 HE22 GLN 83 -11.613 22.317 1.906 681 H LEU 84 H LEU 84 -7.484 24.813 -2.525 682 HA LEU 84 HA LEU 84 -7.438 27.028 -0.709 683 HB2 LEU 84 HB2 LEU 84 -5.937 25.066 -0.505 684 HB3 LEU 84 HB3 LEU 84 -5.156 25.538 -2.002 685 HG LEU 84 HG LEU 84 -4.548 27.728 -0.839 686 HD11 LEU 84 HD11 LEU 84 -6.157 27.515 1.020 687 HD12 LEU 84 HD12 LEU 84 -4.501 27.763 1.566 688 HD13 LEU 84 HD13 LEU 84 -5.219 26.156 1.645 689 HD21 LEU 84 HD21 LEU 84 -2.660 26.662 0.440 690 HD22 LEU 84 HD22 LEU 84 -2.813 26.157 -1.241 691 HD23 LEU 84 HD23 LEU 84 -3.377 25.099 0.054 692 H LYS 85 H LYS 85 -6.753 26.484 -4.072 693 HA LYS 85 HA LYS 85 -5.512 29.058 -4.465 694 HB2 LYS 85 HB2 LYS 85 -5.309 28.431 -6.763 695 HB3 LYS 85 HB3 LYS 85 -4.929 27.008 -5.807 696 HG2 LYS 85 HG2 LYS 85 -7.025 26.012 -6.290 697 HG3 LYS 85 HG3 LYS 85 -7.643 27.504 -6.996 698 HD2 LYS 85 HD2 LYS 85 -5.316 25.943 -8.106 699 HD3 LYS 85 HD3 LYS 85 -6.979 25.770 -8.665 700 HE2 LYS 85 HE2 LYS 85 -6.627 28.475 -8.782 701 HE3 LYS 85 HE3 LYS 85 -5.019 27.887 -9.201 702 HZ1 LYS 85 HZ1 LYS 85 -6.400 28.166 -11.156 703 HZ2 LYS 85 HZ2 LYS 85 -7.555 27.102 -10.531 704 HZ3 LYS 85 HZ3 LYS 85 -6.016 26.534 -10.940 705 H LYS 86 H LYS 86 -6.410 30.695 -5.869 706 HA LYS 86 HA LYS 86 -9.215 31.095 -5.343 707 HB2 LYS 86 HB2 LYS 86 -7.249 32.808 -6.870 708 HB3 LYS 86 HB3 LYS 86 -8.878 33.285 -6.418 709 HG2 LYS 86 HG2 LYS 86 -8.176 32.879 -4.015 710 HG3 LYS 86 HG3 LYS 86 -6.523 32.801 -4.627 711 HD2 LYS 86 HD2 LYS 86 -8.407 35.121 -5.022 712 HD3 LYS 86 HD3 LYS 86 -7.139 35.045 -3.798 713 HE2 LYS 86 HE2 LYS 86 -5.539 35.558 -5.273 714 HE3 LYS 86 HE3 LYS 86 -6.170 34.437 -6.476 715 HZ1 LYS 86 HZ1 LYS 86 -7.194 37.170 -5.946 716 HZ2 LYS 86 HZ2 LYS 86 -7.825 36.096 -7.088 717 HZ3 LYS 86 HZ3 LYS 86 -6.260 36.703 -7.272 718 H1 GLY 1 H1 GLY 1 -20.920 25.174 1.059 719 H2 GLY 1 H2 GLY 1 -22.441 25.529 0.419 720 H3 GLY 1 H3 GLY 1 -21.238 24.882 -0.574 721 HA2 GLY 1 HA3 GLY 1 -21.244 22.857 0.826 722 HA3 GLY 1 HA2 GLY 1 -22.642 23.528 1.652 723 H SER 2 H SER 2 -21.467 21.934 -1.145 724 HA SER 2 HA SER 2 -23.839 22.239 -2.719 725 HB2 SER 2 HB2 SER 2 -21.853 20.029 -3.141 726 HB3 SER 2 HB3 SER 2 -22.725 20.988 -4.336 727 HG SER 2 HG SER 2 -20.764 21.873 -4.405 728 H HIS 3 H HIS 3 -25.624 20.983 -2.735 729 HA HIS 3 HA HIS 3 -25.944 19.041 -0.642 730 HB2 HIS 3 HB2 HIS 3 -27.686 20.712 -1.705 731 HB3 HIS 3 HB3 HIS 3 -27.952 19.384 -2.826 732 HD1 HIS 3 HD1 HIS 3 -29.125 20.666 0.303 733 HD2 HIS 3 HD2 HIS 3 -28.596 16.871 -1.312 734 HE1 HIS 3 HE1 HIS 3 -30.530 19.129 1.711 735 HE2 HIS 3 HE2 HIS 3 -30.069 16.820 0.809 736 H MET 4 H MET 4 -24.425 17.451 -1.222 737 HA MET 4 HA MET 4 -25.109 15.887 -3.617 738 HB2 MET 4 HB2 MET 4 -22.521 16.055 -2.067 739 HB3 MET 4 HB3 MET 4 -22.808 14.927 -3.384 740 HG2 MET 4 HG2 MET 4 -23.128 16.785 -4.923 741 HG3 MET 4 HG3 MET 4 -22.880 17.926 -3.604 742 HE1 MET 4 HE1 MET 4 -20.664 18.326 -2.380 743 HE2 MET 4 HE2 MET 4 -19.131 17.541 -2.752 744 HE3 MET 4 HE3 MET 4 -20.418 16.628 -1.966 745 H THR 5 H THR 5 -24.517 13.489 -3.319 746 HA THR 5 HA THR 5 -26.120 12.496 -1.173 747 HB THR 5 HB THR 5 -26.080 11.454 -3.438 748 HG1 THR 5 HG1 THR 5 -26.761 9.768 -2.387 749 HG21 THR 5 HG21 THR 5 -23.680 11.640 -3.893 750 HG22 THR 5 HG22 THR 5 -24.234 9.975 -4.065 751 HG23 THR 5 HG23 THR 5 -23.344 10.464 -2.623 752 H GLU 6 H GLU 6 -25.488 11.407 0.654 753 HA GLU 6 HA GLU 6 -22.630 11.583 1.314 754 HB2 GLU 6 HB2 GLU 6 -25.034 12.250 2.762 755 HB3 GLU 6 HB3 GLU 6 -24.087 11.071 3.660 756 HG2 GLU 6 HG2 GLU 6 -22.790 13.510 2.518 757 HG3 GLU 6 HG3 GLU 6 -23.676 13.591 4.037 758 H GLN 7 H GLN 7 -21.569 9.851 2.219 759 HA GLN 7 HA GLN 7 -22.982 7.318 2.490 760 HB2 GLN 7 HB2 GLN 7 -20.990 7.943 0.379 761 HB3 GLN 7 HB3 GLN 7 -20.836 6.382 1.175 762 HG2 GLN 7 HG2 GLN 7 -23.412 7.336 -0.040 763 HG3 GLN 7 HG3 GLN 7 -22.197 6.439 -0.947 764 HE21 GLN 7 HE21 GLN 7 -24.981 5.785 -0.137 765 HE22 GLN 7 HE22 GLN 7 -24.856 4.251 0.652 766 HA PRO 8 HA PRO 8 -19.968 7.169 5.758 767 HB2 PRO 8 HB2 PRO 8 -20.913 5.042 7.042 768 HB3 PRO 8 HB3 PRO 8 -21.868 6.527 6.951 769 HG2 PRO 8 HG2 PRO 8 -22.154 3.996 5.394 770 HG3 PRO 8 HG3 PRO 8 -23.413 5.052 6.060 771 HD2 PRO 8 HD2 PRO 8 -22.506 5.055 3.420 772 HD3 PRO 8 HD3 PRO 8 -23.427 6.354 4.200 773 H LYS 9 H LYS 9 -18.703 5.228 6.861 774 HA LYS 9 HA LYS 9 -17.037 4.106 4.837 775 HB2 LYS 9 HB2 LYS 9 -17.130 3.539 7.807 776 HB3 LYS 9 HB3 LYS 9 -15.844 3.041 6.715 777 HG2 LYS 9 HG2 LYS 9 -15.379 5.432 6.250 778 HG3 LYS 9 HG3 LYS 9 -16.593 5.861 7.460 779 HD2 LYS 9 HD2 LYS 9 -15.314 4.681 9.175 780 HD3 LYS 9 HD3 LYS 9 -14.108 4.219 7.972 781 HE2 LYS 9 HE2 LYS 9 -13.586 6.580 7.594 782 HE3 LYS 9 HE3 LYS 9 -14.802 7.042 8.785 783 HZ1 LYS 9 HZ1 LYS 9 -12.262 5.591 9.251 784 HZ2 LYS 9 HZ2 LYS 9 -13.492 5.666 10.408 785 HZ3 LYS 9 HZ3 LYS 9 -12.742 7.086 9.882 786 H THR 10 H THR 10 -17.586 2.360 3.664 787 HA THR 10 HA THR 10 -18.940 0.151 5.051 788 HB THR 10 HB THR 10 -20.471 1.531 3.511 789 HG1 THR 10 HG1 THR 10 -21.601 -0.252 3.501 790 HG21 THR 10 HG21 THR 10 -18.873 1.772 1.647 791 HG22 THR 10 HG22 THR 10 -20.383 1.020 1.135 792 HG23 THR 10 HG23 THR 10 -18.945 0.030 1.378 793 H ARG 11 H ARG 11 -18.638 -1.938 3.984 794 HA ARG 11 HA ARG 11 -15.937 -2.118 2.885 795 HB2 ARG 11 HB2 ARG 11 -15.959 -4.444 3.513 796 HB3 ARG 11 HB3 ARG 11 -16.475 -3.471 4.881 797 HG2 ARG 11 HG2 ARG 11 -18.835 -4.045 4.300 798 HG3 ARG 11 HG3 ARG 11 -18.199 -5.154 3.082 799 HD2 ARG 11 HD2 ARG 11 -16.970 -6.351 4.829 800 HD3 ARG 11 HD3 ARG 11 -17.620 -5.247 6.037 801 HE ARG 11 HE ARG 11 -19.522 -6.766 4.428 802 HH11 ARG 11 HH11 ARG 11 -17.883 -6.285 7.480 803 HH12 ARG 11 HH12 ARG 11 -18.970 -7.301 8.373 804 HH21 ARG 11 HH21 ARG 11 -20.969 -8.108 5.608 805 HH22 ARG 11 HH22 ARG 11 -20.720 -8.342 7.312 806 H VAL 12 H VAL 12 -15.495 -3.517 1.085 807 HA VAL 12 HA VAL 12 -17.791 -4.000 -0.682 808 HB VAL 12 HB VAL 12 -16.886 -1.811 -1.303 809 HG11 VAL 12 HG11 VAL 12 -14.290 -3.303 -1.471 810 HG12 VAL 12 HG12 VAL 12 -14.665 -1.832 -0.572 811 HG13 VAL 12 HG13 VAL 12 -14.550 -1.787 -2.332 812 HG21 VAL 12 HG21 VAL 12 -16.189 -3.937 -3.328 813 HG22 VAL 12 HG22 VAL 12 -16.430 -2.223 -3.674 814 HG23 VAL 12 HG23 VAL 12 -17.775 -3.205 -3.094 815 H SER 13 H SER 13 -17.491 -5.628 -2.213 816 HA SER 13 HA SER 13 -15.253 -7.443 -1.683 817 HB2 SER 13 HB2 SER 13 -17.839 -7.957 -3.182 818 HB3 SER 13 HB3 SER 13 -16.639 -9.166 -2.733 819 HG SER 13 HG SER 13 -17.081 -8.640 -0.524 820 H VAL 14 H VAL 14 -13.634 -7.541 -3.116 821 HA VAL 14 HA VAL 14 -14.158 -6.692 -5.891 822 HB VAL 14 HB VAL 14 -11.784 -5.845 -5.937 823 HG11 VAL 14 HG11 VAL 14 -12.339 -3.689 -4.878 824 HG12 VAL 14 HG12 VAL 14 -13.746 -4.444 -4.132 825 HG13 VAL 14 HG13 VAL 14 -13.645 -4.308 -5.886 826 HG21 VAL 14 HG21 VAL 14 -11.040 -7.006 -3.871 827 HG22 VAL 14 HG22 VAL 14 -12.036 -5.892 -2.931 828 HG23 VAL 14 HG23 VAL 14 -10.680 -5.281 -3.874 829 H ARG 15 H ARG 15 -12.280 -7.433 -7.356 830 HA ARG 15 HA ARG 15 -11.637 -10.214 -6.640 831 HB2 ARG 15 HB2 ARG 15 -13.119 -10.012 -8.577 832 HB3 ARG 15 HB3 ARG 15 -11.964 -8.947 -9.368 833 HG2 ARG 15 HG2 ARG 15 -10.361 -10.753 -9.530 834 HG3 ARG 15 HG3 ARG 15 -11.443 -11.826 -8.639 835 HD2 ARG 15 HD2 ARG 15 -12.144 -10.522 -11.262 836 HD3 ARG 15 HD3 ARG 15 -11.464 -12.141 -11.123 837 HE ARG 15 HE ARG 15 -13.493 -12.676 -9.762 838 HH11 ARG 15 HH11 ARG 15 -13.567 -10.056 -12.095 839 HH12 ARG 15 HH12 ARG 15 -15.278 -10.174 -12.354 840 HH21 ARG 15 HH21 ARG 15 -15.744 -12.807 -10.090 841 HH22 ARG 15 HH22 ARG 15 -16.514 -11.735 -11.218 842 H ILE 16 H ILE 16 -9.564 -10.604 -6.196 843 HA ILE 16 HA ILE 16 -7.513 -8.906 -7.466 844 HB ILE 16 HB ILE 16 -7.390 -10.128 -4.701 845 HG12 ILE 16 HG12 ILE 16 -7.514 -7.194 -5.413 846 HG13 ILE 16 HG13 ILE 16 -8.953 -8.139 -5.045 847 HG21 ILE 16 HG21 ILE 16 -5.294 -8.981 -4.447 848 HG22 ILE 16 HG22 ILE 16 -5.466 -8.223 -6.030 849 HG23 ILE 16 HG23 ILE 16 -5.222 -9.965 -5.907 850 HD11 ILE 16 HD11 ILE 16 -7.992 -8.647 -2.824 851 HD12 ILE 16 HD12 ILE 16 -8.271 -6.927 -3.098 852 HD13 ILE 16 HD13 ILE 16 -6.639 -7.582 -3.205 853 H TYR 17 H TYR 17 -6.357 -10.021 -8.852 854 HA TYR 17 HA TYR 17 -5.177 -11.639 -9.887 855 HB2 TYR 17 HB2 TYR 17 -4.335 -11.720 -7.301 856 HB3 TYR 17 HB3 TYR 17 -4.862 -13.384 -7.529 857 HD1 TYR 17 HD2 TYR 17 -2.742 -10.761 -9.127 858 HD2 TYR 17 HD1 TYR 17 -3.419 -14.915 -8.510 859 HE1 TYR 17 HE2 TYR 17 -0.631 -11.272 -10.285 860 HE2 TYR 17 HE1 TYR 17 -1.313 -15.436 -9.664 861 HH TYR 17 HH TYR 17 1.020 -13.061 -10.428 862 H GLY 18 H GLY 18 -8.190 -12.025 -9.071 863 HA2 GLY 18 HA2 GLY 18 -9.396 -13.613 -10.553 864 HA3 GLY 18 HA3 GLY 18 -8.284 -14.839 -9.964 865 H GLN 19 H GLN 19 -8.421 -13.853 -7.189 866 HA GLN 19 HA GLN 19 -10.923 -15.195 -6.497 867 HB2 GLN 19 HB2 GLN 19 -8.303 -14.877 -5.250 868 HB3 GLN 19 HB3 GLN 19 -9.623 -14.595 -4.126 869 HG2 GLN 19 HG2 GLN 19 -9.266 -17.063 -5.815 870 HG3 GLN 19 HG3 GLN 19 -8.851 -16.915 -4.109 871 HE21 GLN 19 HE21 GLN 19 -11.168 -15.303 -3.449 872 HE22 GLN 19 HE22 GLN 19 -12.533 -16.361 -3.490 873 H ASP 20 H ASP 20 -12.379 -14.332 -4.924 874 HA ASP 20 HA ASP 20 -12.568 -11.423 -5.074 875 HB2 ASP 20 HB2 ASP 20 -14.865 -11.691 -4.339 876 HB3 ASP 20 HB3 ASP 20 -14.550 -12.802 -5.667 877 H TYR 21 H TYR 21 -12.511 -10.093 -3.329 878 HA TYR 21 HA TYR 21 -12.201 -11.275 -0.660 879 HB2 TYR 21 HB2 TYR 21 -10.318 -9.228 -1.860 880 HB3 TYR 21 HB3 TYR 21 -10.293 -9.768 -0.187 881 HD1 TYR 21 HD1 TYR 21 -9.631 -12.102 0.340 882 HD2 TYR 21 HD2 TYR 21 -9.322 -10.516 -3.592 883 HE1 TYR 21 HE1 TYR 21 -8.123 -13.941 -0.278 884 HE2 TYR 21 HE2 TYR 21 -7.814 -12.352 -4.221 885 HH TYR 21 HH TYR 21 -7.379 -15.107 -2.250 886 H THR 22 H THR 22 -13.001 -10.019 0.993 887 HA THR 22 HA THR 22 -14.349 -7.537 0.171 888 HB THR 22 HB THR 22 -15.007 -9.379 2.480 889 HG1 THR 22 HG1 THR 22 -15.611 -10.149 0.360 890 HG21 THR 22 HG21 THR 22 -15.480 -6.993 2.946 891 HG22 THR 22 HG22 THR 22 -16.943 -7.971 2.852 892 HG23 THR 22 HG23 THR 22 -16.486 -6.934 1.500 893 H ILE 23 H ILE 23 -13.487 -5.709 0.904 894 HA ILE 23 HA ILE 23 -12.186 -5.702 3.532 895 HB ILE 23 HB ILE 23 -10.328 -4.398 2.821 896 HG12 ILE 23 HG12 ILE 23 -11.545 -3.120 1.032 897 HG13 ILE 23 HG13 ILE 23 -9.908 -3.597 0.615 898 HG21 ILE 23 HG21 ILE 23 -10.804 -6.945 1.399 899 HG22 ILE 23 HG22 ILE 23 -9.598 -6.516 2.612 900 HG23 ILE 23 HG23 ILE 23 -9.389 -5.995 0.942 901 HD11 ILE 23 HD11 ILE 23 -12.378 -4.137 -0.735 902 HD12 ILE 23 HD12 ILE 23 -11.544 -5.642 -0.360 903 HD13 ILE 23 HD13 ILE 23 -10.722 -4.386 -1.281 904 H VAL 24 H VAL 24 -11.878 -3.448 4.356 905 HA VAL 24 HA VAL 24 -14.304 -1.966 3.991 906 HB VAL 24 HB VAL 24 -11.850 -1.310 5.637 907 HG11 VAL 24 HG11 VAL 24 -13.351 0.255 6.829 908 HG12 VAL 24 HG12 VAL 24 -14.597 -0.065 5.622 909 HG13 VAL 24 HG13 VAL 24 -13.085 0.706 5.144 910 HG21 VAL 24 HG21 VAL 24 -14.497 -2.483 6.478 911 HG22 VAL 24 HG22 VAL 24 -13.143 -2.096 7.540 912 HG23 VAL 24 HG23 VAL 24 -12.982 -3.373 6.334 913 H GLY 25 H GLY 25 -14.608 -0.441 2.479 914 HA2 GLY 25 HA2 GLY 25 -12.340 0.487 0.929 915 HA3 GLY 25 HA3 GLY 25 -14.035 0.817 0.603 916 H ALA 26 H ALA 26 -15.011 2.064 2.664 917 HA ALA 26 HA ALA 26 -15.224 4.098 3.647 918 HB1 ALA 26 HB1 ALA 26 -12.258 3.804 4.113 919 HB2 ALA 26 HB2 ALA 26 -13.535 3.179 5.156 920 HB3 ALA 26 HB3 ALA 26 -13.333 4.920 4.956 921 H GLU 27 H GLU 27 -14.743 4.029 0.798 922 HA GLU 27 HA GLU 27 -13.940 6.800 0.459 923 HB2 GLU 27 HB2 GLU 27 -12.204 4.663 -0.218 924 HB3 GLU 27 HB3 GLU 27 -12.817 5.320 -1.729 925 HG2 GLU 27 HG2 GLU 27 -11.314 6.767 0.433 926 HG3 GLU 27 HG3 GLU 27 -10.803 6.457 -1.227 927 H SER 28 H SER 28 -14.052 7.095 -2.173 928 HA SER 28 HA SER 28 -16.832 6.916 -2.743 929 HB2 SER 28 HB2 SER 28 -14.691 7.572 -4.761 930 HB3 SER 28 HB3 SER 28 -16.334 8.203 -4.654 931 HG SER 28 HG SER 28 -14.204 8.728 -2.830 932 HA PRO 29 HA PRO 29 -17.354 2.995 -4.671 933 HB2 PRO 29 HB2 PRO 29 -18.819 3.818 -6.912 934 HB3 PRO 29 HB3 PRO 29 -19.482 3.396 -5.332 935 HG2 PRO 29 HG2 PRO 29 -18.857 6.084 -6.469 936 HG3 PRO 29 HG3 PRO 29 -20.209 5.588 -5.433 937 HD2 PRO 29 HD2 PRO 29 -18.151 6.952 -4.429 938 HD3 PRO 29 HD3 PRO 29 -18.909 5.640 -3.500 939 H ALA 30 H ALA 30 -16.403 5.630 -6.875 940 HA ALA 30 HA ALA 30 -15.392 3.837 -8.860 941 HB1 ALA 30 HB1 ALA 30 -14.849 6.779 -8.495 942 HB2 ALA 30 HB2 ALA 30 -16.178 6.084 -9.425 943 HB3 ALA 30 HB3 ALA 30 -14.511 5.827 -9.939 944 H HIS 31 H HIS 31 -14.019 5.549 -6.137 945 HA HIS 31 HA HIS 31 -11.295 5.161 -6.842 946 HB2 HIS 31 HB2 HIS 31 -12.674 5.937 -4.286 947 HB3 HIS 31 HB3 HIS 31 -10.937 5.651 -4.333 948 HD1 HIS 31 HD1 HIS 31 -12.048 8.427 -3.633 949 HD2 HIS 31 HD2 HIS 31 -10.964 7.241 -7.475 950 HE1 HIS 31 HE1 HIS 31 -11.569 10.551 -4.898 951 HE2 HIS 31 HE2 HIS 31 -10.703 9.787 -7.138 952 H ILE 32 H ILE 32 -13.521 3.391 -4.744 953 HA ILE 32 HA ILE 32 -11.593 1.564 -3.746 954 HB ILE 32 HB ILE 32 -13.452 0.227 -2.935 955 HG12 ILE 32 HG12 ILE 32 -15.244 2.104 -4.507 956 HG13 ILE 32 HG13 ILE 32 -14.902 0.435 -4.940 957 HG21 ILE 32 HG21 ILE 32 -14.403 1.834 -1.452 958 HG22 ILE 32 HG22 ILE 32 -14.099 3.149 -2.587 959 HG23 ILE 32 HG23 ILE 32 -12.749 2.336 -1.795 960 HD11 ILE 32 HD11 ILE 32 -15.889 -0.195 -2.697 961 HD12 ILE 32 HD12 ILE 32 -17.003 0.420 -3.917 962 HD13 ILE 32 HD13 ILE 32 -16.470 1.468 -2.604 963 H ARG 33 H ARG 33 -12.799 1.793 -6.847 964 HA ARG 33 HA ARG 33 -12.789 -1.068 -7.358 965 HB2 ARG 33 HB2 ARG 33 -13.691 1.315 -8.793 966 HB3 ARG 33 HB3 ARG 33 -12.872 0.153 -9.825 967 HG2 ARG 33 HG2 ARG 33 -15.206 -0.320 -9.885 968 HG3 ARG 33 HG3 ARG 33 -14.417 -1.601 -8.963 969 HD2 ARG 33 HD2 ARG 33 -15.241 -0.810 -6.933 970 HD3 ARG 33 HD3 ARG 33 -15.583 0.791 -7.587 971 HE ARG 33 HE ARG 33 -17.261 -1.563 -7.740 972 HH11 ARG 33 HH11 ARG 33 -16.598 1.622 -9.022 973 HH12 ARG 33 HH12 ARG 33 -18.210 1.868 -9.610 974 HH21 ARG 33 HH21 ARG 33 -19.393 -1.252 -8.533 975 HH22 ARG 33 HH22 ARG 33 -19.798 0.235 -9.335 976 H LEU 34 H LEU 34 -10.805 1.768 -8.074 977 HA LEU 34 HA LEU 34 -8.970 0.356 -9.730 978 HB2 LEU 34 HB2 LEU 34 -7.831 2.332 -9.966 979 HB3 LEU 34 HB3 LEU 34 -9.440 2.905 -9.579 980 HG LEU 34 HG LEU 34 -8.250 2.751 -7.099 981 HD11 LEU 34 HD11 LEU 34 -6.100 3.898 -7.331 982 HD12 LEU 34 HD12 LEU 34 -6.212 3.753 -9.084 983 HD13 LEU 34 HD13 LEU 34 -6.071 2.306 -8.086 984 HD21 LEU 34 HD21 LEU 34 -8.462 5.076 -7.078 985 HD22 LEU 34 HD22 LEU 34 -9.663 4.546 -8.255 986 HD23 LEU 34 HD23 LEU 34 -8.128 5.214 -8.802 987 H VAL 35 H VAL 35 -9.309 0.707 -6.321 988 HA VAL 35 HA VAL 35 -6.691 0.355 -5.435 989 HB VAL 35 HB VAL 35 -9.029 -0.975 -4.080 990 HG11 VAL 35 HG11 VAL 35 -6.776 -1.363 -3.172 991 HG12 VAL 35 HG12 VAL 35 -7.806 -0.474 -2.050 992 HG13 VAL 35 HG13 VAL 35 -6.570 0.377 -2.976 993 HG21 VAL 35 HG21 VAL 35 -9.480 1.141 -2.930 994 HG22 VAL 35 HG22 VAL 35 -9.760 1.262 -4.667 995 HG23 VAL 35 HG23 VAL 35 -8.296 1.943 -3.961 996 H ALA 36 H ALA 36 -9.157 -2.083 -6.169 997 HA ALA 36 HA ALA 36 -7.531 -4.341 -5.662 998 HB1 ALA 36 HB1 ALA 36 -9.278 -5.629 -6.538 999 HB2 ALA 36 HB2 ALA 36 -9.830 -4.322 -7.586 1000 HB3 ALA 36 HB3 ALA 36 -10.070 -4.213 -5.843 1001 H ALA 37 H ALA 37 -8.345 -2.642 -8.667 1002 HA ALA 37 HA ALA 37 -7.002 -4.345 -10.444 1003 HB1 ALA 37 HB1 ALA 37 -8.659 -2.638 -11.109 1004 HB2 ALA 37 HB2 ALA 37 -7.171 -2.562 -12.051 1005 HB3 ALA 37 HB3 ALA 37 -7.464 -1.385 -10.771 1006 H PHE 38 H PHE 38 -5.868 -1.700 -8.463 1007 HA PHE 38 HA PHE 38 -3.348 -1.351 -9.712 1008 HB2 PHE 38 HB2 PHE 38 -4.531 0.235 -8.095 1009 HB3 PHE 38 HB3 PHE 38 -3.960 -0.814 -6.805 1010 HD1 PHE 38 HD1 PHE 38 -2.942 1.519 -9.448 1011 HD2 PHE 38 HD2 PHE 38 -1.680 -0.780 -6.102 1012 HE1 PHE 38 HE1 PHE 38 -0.813 2.752 -9.411 1013 HE2 PHE 38 HE2 PHE 38 0.451 0.449 -6.055 1014 HZ PHE 38 HZ PHE 38 0.888 2.220 -7.711 1015 H VAL 39 H VAL 39 -4.455 -3.329 -6.998 1016 HA VAL 39 HA VAL 39 -1.895 -4.319 -6.285 1017 HB VAL 39 HB VAL 39 -4.626 -5.519 -5.787 1018 HG11 VAL 39 HG11 VAL 39 -2.930 -7.228 -5.564 1019 HG12 VAL 39 HG12 VAL 39 -3.508 -6.760 -3.964 1020 HG13 VAL 39 HG13 VAL 39 -1.954 -6.165 -4.548 1021 HG21 VAL 39 HG21 VAL 39 -4.402 -3.320 -4.795 1022 HG22 VAL 39 HG22 VAL 39 -2.867 -3.783 -4.060 1023 HG23 VAL 39 HG23 VAL 39 -4.366 -4.555 -3.541 1024 H ASP 40 H ASP 40 -4.508 -5.594 -8.312 1025 HA ASP 40 HA ASP 40 -3.393 -8.071 -8.943 1026 HB2 ASP 40 HB2 ASP 40 -5.662 -7.699 -9.550 1027 HB3 ASP 40 HB3 ASP 40 -5.253 -6.265 -10.485 1028 H ASP 41 H ASP 41 -3.000 -4.935 -10.553 1029 HA ASP 41 HA ASP 41 -1.372 -5.891 -12.660 1030 HB2 ASP 41 HB2 ASP 41 -2.468 -3.733 -12.848 1031 HB3 ASP 41 HB3 ASP 41 -1.564 -3.122 -11.464 1032 H LYS 42 H LYS 42 -0.575 -4.364 -9.557 1033 HA LYS 42 HA LYS 42 2.199 -4.327 -9.867 1034 HB2 LYS 42 HB2 LYS 42 0.398 -4.390 -7.468 1035 HB3 LYS 42 HB3 LYS 42 2.141 -4.492 -7.264 1036 HG2 LYS 42 HG2 LYS 42 1.051 -2.299 -8.945 1037 HG3 LYS 42 HG3 LYS 42 0.873 -2.185 -7.194 1038 HD2 LYS 42 HD2 LYS 42 3.275 -2.407 -6.903 1039 HD3 LYS 42 HD3 LYS 42 3.486 -2.628 -8.644 1040 HE2 LYS 42 HE2 LYS 42 2.552 -0.364 -9.003 1041 HE3 LYS 42 HE3 LYS 42 2.457 -0.154 -7.257 1042 HZ1 LYS 42 HZ1 LYS 42 4.892 -0.512 -7.188 1043 HZ2 LYS 42 HZ2 LYS 42 4.442 0.889 -8.026 1044 HZ3 LYS 42 HZ3 LYS 42 4.917 -0.499 -8.878 1045 H MET 43 H MET 43 0.160 -6.778 -8.247 1046 HA MET 43 HA MET 43 2.203 -8.571 -7.599 1047 HB2 MET 43 HB2 MET 43 -0.731 -8.923 -8.127 1048 HB3 MET 43 HB3 MET 43 0.291 -10.317 -7.813 1049 HG2 MET 43 HG2 MET 43 1.001 -9.120 -5.688 1050 HG3 MET 43 HG3 MET 43 -0.348 -8.027 -5.989 1051 HE1 MET 43 HE1 MET 43 -0.694 -12.522 -5.033 1052 HE2 MET 43 HE2 MET 43 0.812 -11.605 -5.112 1053 HE3 MET 43 HE3 MET 43 -0.077 -11.972 -6.590 1054 H HIS 44 H HIS 44 0.304 -8.207 -10.525 1055 HA HIS 44 HA HIS 44 1.214 -10.531 -11.847 1056 HB2 HIS 44 HB2 HIS 44 -0.675 -8.620 -12.393 1057 HB3 HIS 44 HB3 HIS 44 0.566 -8.244 -13.580 1058 HD1 HIS 44 HD1 HIS 44 -1.795 -9.072 -14.936 1059 HD2 HIS 44 HD2 HIS 44 0.728 -11.934 -13.294 1060 HE1 HIS 44 HE1 HIS 44 -2.316 -11.206 -16.152 1061 HE2 HIS 44 HE2 HIS 44 -0.638 -12.864 -15.282 1062 H GLU 45 H GLU 45 2.430 -7.197 -11.814 1063 HA GLU 45 HA GLU 45 4.376 -7.668 -13.834 1064 HB2 GLU 45 HB2 GLU 45 5.004 -5.472 -13.593 1065 HB3 GLU 45 HB3 GLU 45 3.366 -5.417 -12.962 1066 HG2 GLU 45 HG2 GLU 45 4.067 -5.072 -10.800 1067 HG3 GLU 45 HG3 GLU 45 5.613 -5.885 -11.059 1068 H PHE 46 H PHE 46 4.389 -8.098 -10.361 1069 HA PHE 46 HA PHE 46 7.267 -8.414 -10.298 1070 HB2 PHE 46 HB2 PHE 46 5.196 -8.936 -8.154 1071 HB3 PHE 46 HB3 PHE 46 6.939 -8.974 -7.910 1072 HD1 PHE 46 HD2 PHE 46 7.923 -6.636 -9.271 1073 HD2 PHE 46 HD1 PHE 46 4.335 -7.125 -7.027 1074 HE1 PHE 46 HE2 PHE 46 7.881 -4.221 -8.816 1075 HE2 PHE 46 HE1 PHE 46 4.291 -4.709 -6.569 1076 HZ PHE 46 HZ PHE 46 6.065 -3.250 -7.466 1077 H SER 47 H SER 47 4.525 -10.369 -10.845 1078 HA SER 47 HA SER 47 5.404 -12.883 -10.010 1079 HB2 SER 47 HB2 SER 47 3.633 -12.140 -12.347 1080 HB3 SER 47 HB3 SER 47 3.832 -13.780 -11.730 1081 HG SER 47 HG SER 47 2.988 -11.620 -10.090 1082 H GLU 48 H GLU 48 5.945 -11.187 -13.072 1083 HA GLU 48 HA GLU 48 7.318 -13.336 -14.325 1084 HB2 GLU 48 HB2 GLU 48 7.989 -11.658 -16.004 1085 HB3 GLU 48 HB3 GLU 48 6.266 -11.613 -15.660 1086 HG2 GLU 48 HG2 GLU 48 6.445 -9.435 -15.303 1087 HG3 GLU 48 HG3 GLU 48 7.450 -9.783 -13.898 1088 H LYS 49 H LYS 49 8.302 -11.095 -11.951 1089 HA LYS 49 HA LYS 49 11.093 -11.098 -12.662 1090 HB2 LYS 49 HB2 LYS 49 9.649 -10.187 -10.166 1091 HB3 LYS 49 HB3 LYS 49 11.379 -9.999 -10.425 1092 HG2 LYS 49 HG2 LYS 49 9.777 -8.943 -12.617 1093 HG3 LYS 49 HG3 LYS 49 9.436 -8.175 -11.065 1094 HD2 LYS 49 HD2 LYS 49 11.172 -6.923 -12.093 1095 HD3 LYS 49 HD3 LYS 49 11.916 -7.855 -10.793 1096 HE2 LYS 49 HE2 LYS 49 13.374 -8.061 -12.625 1097 HE3 LYS 49 HE3 LYS 49 12.489 -9.583 -12.561 1098 HZ1 LYS 49 HZ1 LYS 49 12.023 -7.314 -14.416 1099 HZ2 LYS 49 HZ2 LYS 49 10.980 -8.645 -14.288 1100 HZ3 LYS 49 HZ3 LYS 49 12.577 -8.864 -14.807 1101 H GLN 50 H GLN 50 8.973 -12.880 -10.549 1102 HA GLN 50 HA GLN 50 9.265 -14.634 -9.125 1103 HB2 GLN 50 HB2 GLN 50 11.196 -15.292 -11.343 1104 HB3 GLN 50 HB3 GLN 50 10.844 -16.410 -10.034 1105 HG2 GLN 50 HG2 GLN 50 8.492 -16.417 -10.653 1106 HG3 GLN 50 HG3 GLN 50 8.824 -15.270 -11.950 1107 HE21 GLN 50 HE21 GLN 50 7.690 -17.941 -12.074 1108 HE22 GLN 50 HE22 GLN 50 8.722 -18.856 -13.120 1109 HA PRO 51 HA PRO 51 13.104 -12.841 -7.182 1110 HB2 PRO 51 HB2 PRO 51 11.456 -12.059 -4.939 1111 HB3 PRO 51 HB3 PRO 51 12.387 -11.036 -6.031 1112 HG2 PRO 51 HG2 PRO 51 9.651 -11.107 -5.942 1113 HG3 PRO 51 HG3 PRO 51 10.588 -10.597 -7.356 1114 HD2 PRO 51 HD2 PRO 51 9.216 -13.191 -6.810 1115 HD3 PRO 51 HD3 PRO 51 9.413 -12.314 -8.341 1116 H MET 52 H MET 52 10.423 -14.176 -5.242 1117 HA MET 52 HA MET 52 12.378 -15.876 -3.864 1118 HB2 MET 52 HB2 MET 52 9.575 -15.113 -3.028 1119 HB3 MET 52 HB3 MET 52 10.693 -16.091 -2.088 1120 HG2 MET 52 HG2 MET 52 11.009 -13.191 -2.830 1121 HG3 MET 52 HG3 MET 52 10.678 -13.855 -1.229 1122 HE1 MET 52 HE1 MET 52 13.107 -11.808 -2.217 1123 HE2 MET 52 HE2 MET 52 14.395 -12.393 -1.165 1124 HE3 MET 52 HE3 MET 52 12.764 -12.191 -0.528 1125 H LEU 53 H LEU 53 10.234 -16.030 -6.339 1126 HA LEU 53 HA LEU 53 9.130 -17.663 -7.451 1127 HB2 LEU 53 HB2 LEU 53 11.405 -19.097 -6.147 1128 HB3 LEU 53 HB3 LEU 53 10.213 -20.016 -7.047 1129 HG LEU 53 HG LEU 53 11.611 -17.671 -8.300 1130 HD11 LEU 53 HD11 LEU 53 13.359 -19.156 -7.473 1131 HD12 LEU 53 HD12 LEU 53 13.247 -19.224 -9.230 1132 HD13 LEU 53 HD13 LEU 53 12.573 -20.529 -8.254 1133 HD21 LEU 53 HD21 LEU 53 9.663 -18.505 -9.455 1134 HD22 LEU 53 HD22 LEU 53 10.278 -20.156 -9.368 1135 HD23 LEU 53 HD23 LEU 53 11.112 -18.954 -10.353 1136 H ASP 54 H ASP 54 7.602 -16.941 -5.471 1137 HA ASP 54 HA ASP 54 6.090 -19.269 -4.849 1138 HB2 ASP 54 HB2 ASP 54 7.964 -19.200 -3.069 1139 HB3 ASP 54 HB3 ASP 54 7.112 -17.800 -2.424 1140 H VAL 55 H VAL 55 3.984 -18.707 -4.637 1141 HA VAL 55 HA VAL 55 3.184 -16.077 -5.194 1142 HB VAL 55 HB VAL 55 1.608 -18.464 -4.260 1143 HG11 VAL 55 HG11 VAL 55 0.427 -16.520 -3.429 1144 HG12 VAL 55 HG12 VAL 55 -0.430 -17.192 -4.816 1145 HG13 VAL 55 HG13 VAL 55 0.553 -15.739 -5.007 1146 HG21 VAL 55 HG21 VAL 55 0.755 -18.400 -6.557 1147 HG22 VAL 55 HG22 VAL 55 2.509 -18.564 -6.514 1148 HG23 VAL 55 HG23 VAL 55 1.779 -17.005 -6.893 1149 HA PRO 56 HA PRO 56 1.736 -15.850 -0.461 1150 HB2 PRO 56 HB2 PRO 56 4.030 -17.427 0.610 1151 HB3 PRO 56 HB3 PRO 56 2.379 -17.280 1.225 1152 HG2 PRO 56 HG2 PRO 56 3.151 -19.473 -0.067 1153 HG3 PRO 56 HG3 PRO 56 1.532 -18.794 -0.309 1154 HD2 PRO 56 HD2 PRO 56 3.913 -18.692 -2.092 1155 HD3 PRO 56 HD3 PRO 56 2.192 -18.803 -2.506 1156 H LYS 57 H LYS 57 5.174 -16.259 -1.244 1157 HA LYS 57 HA LYS 57 6.035 -14.053 0.352 1158 HB2 LYS 57 HB2 LYS 57 7.513 -15.362 -1.933 1159 HB3 LYS 57 HB3 LYS 57 8.209 -14.389 -0.646 1160 HG2 LYS 57 HG2 LYS 57 6.941 -17.104 -0.366 1161 HG3 LYS 57 HG3 LYS 57 8.658 -16.719 -0.253 1162 HD2 LYS 57 HD2 LYS 57 8.108 -15.251 1.709 1163 HD3 LYS 57 HD3 LYS 57 6.463 -15.887 1.640 1164 HE2 LYS 57 HE2 LYS 57 7.571 -18.197 1.758 1165 HE3 LYS 57 HE3 LYS 57 9.010 -17.331 2.283 1166 HZ1 LYS 57 HZ1 LYS 57 7.662 -16.379 4.103 1167 HZ2 LYS 57 HZ2 LYS 57 7.788 -18.064 4.187 1168 HZ3 LYS 57 HZ3 LYS 57 6.362 -17.352 3.625 1169 H LEU 58 H LEU 58 5.239 -14.483 -3.055 1170 HA LEU 58 HA LEU 58 6.174 -12.012 -4.012 1171 HB2 LEU 58 HB2 LEU 58 5.477 -13.947 -5.423 1172 HB3 LEU 58 HB3 LEU 58 3.809 -13.606 -5.010 1173 HG LEU 58 HG LEU 58 4.396 -11.227 -6.002 1174 HD11 LEU 58 HD11 LEU 58 6.373 -13.046 -7.353 1175 HD12 LEU 58 HD12 LEU 58 6.736 -11.629 -6.369 1176 HD13 LEU 58 HD13 LEU 58 5.918 -11.438 -7.921 1177 HD21 LEU 58 HD21 LEU 58 3.511 -11.959 -8.133 1178 HD22 LEU 58 HD22 LEU 58 2.663 -12.765 -6.815 1179 HD23 LEU 58 HD23 LEU 58 3.887 -13.639 -7.738 1180 H ALA 59 H ALA 59 3.093 -12.998 -2.626 1181 HA ALA 59 HA ALA 59 1.659 -10.636 -3.078 1182 HB1 ALA 59 HB1 ALA 59 1.377 -12.683 -0.882 1183 HB2 ALA 59 HB2 ALA 59 0.549 -12.677 -2.440 1184 HB3 ALA 59 HB3 ALA 59 0.196 -11.425 -1.248 1185 H VAL 60 H VAL 60 3.727 -11.625 -0.385 1186 HA VAL 60 HA VAL 60 3.236 -9.346 1.237 1187 HB VAL 60 HB VAL 60 5.682 -11.134 1.221 1188 HG11 VAL 60 HG11 VAL 60 4.650 -9.287 3.375 1189 HG12 VAL 60 HG12 VAL 60 6.062 -8.994 2.359 1190 HG13 VAL 60 HG13 VAL 60 6.059 -10.341 3.495 1191 HG21 VAL 60 HG21 VAL 60 4.568 -12.215 3.189 1192 HG22 VAL 60 HG22 VAL 60 3.769 -12.504 1.646 1193 HG23 VAL 60 HG23 VAL 60 3.105 -11.323 2.775 1194 H LEU 61 H LEU 61 5.655 -10.150 -1.196 1195 HA LEU 61 HA LEU 61 7.294 -7.888 -0.927 1196 HB2 LEU 61 HB2 LEU 61 7.956 -9.853 -2.210 1197 HB3 LEU 61 HB3 LEU 61 6.672 -9.558 -3.367 1198 HG LEU 61 HG LEU 61 7.945 -7.238 -3.632 1199 HD11 LEU 61 HD11 LEU 61 10.131 -9.147 -2.824 1200 HD12 LEU 61 HD12 LEU 61 9.607 -7.729 -1.914 1201 HD13 LEU 61 HD13 LEU 61 10.355 -7.531 -3.499 1202 HD21 LEU 61 HD21 LEU 61 9.273 -8.345 -5.477 1203 HD22 LEU 61 HD22 LEU 61 7.531 -8.618 -5.500 1204 HD23 LEU 61 HD23 LEU 61 8.612 -9.878 -4.905 1205 H THR 62 H THR 62 4.471 -8.500 -2.966 1206 HA THR 62 HA THR 62 4.432 -6.053 -4.327 1207 HB THR 62 HB THR 62 2.014 -7.702 -3.566 1208 HG1 THR 62 HG1 THR 62 3.716 -8.931 -4.622 1209 HG21 THR 62 HG21 THR 62 0.850 -6.554 -5.153 1210 HG22 THR 62 HG22 THR 62 2.272 -6.285 -6.158 1211 HG23 THR 62 HG23 THR 62 2.004 -5.293 -4.724 1212 H ALA 63 H ALA 63 2.943 -7.075 -1.292 1213 HA ALA 63 HA ALA 63 1.405 -4.833 -0.736 1214 HB1 ALA 63 HB1 ALA 63 1.216 -6.901 0.517 1215 HB2 ALA 63 HB2 ALA 63 1.520 -5.551 1.609 1216 HB3 ALA 63 HB3 ALA 63 2.827 -6.662 1.197 1217 H VAL 64 H VAL 64 4.799 -5.477 0.147 1218 HA VAL 64 HA VAL 64 5.069 -2.978 1.503 1219 HB VAL 64 HB VAL 64 6.448 -4.986 2.050 1220 HG11 VAL 64 HG11 VAL 64 7.011 -5.773 -0.152 1221 HG12 VAL 64 HG12 VAL 64 8.491 -5.382 0.721 1222 HG13 VAL 64 HG13 VAL 64 7.873 -4.277 -0.506 1223 HG21 VAL 64 HG21 VAL 64 7.107 -2.886 2.942 1224 HG22 VAL 64 HG22 VAL 64 7.843 -2.398 1.417 1225 HG23 VAL 64 HG23 VAL 64 8.564 -3.694 2.371 1226 H GLN 65 H GLN 65 5.605 -4.032 -1.785 1227 HA GLN 65 HA GLN 65 7.143 -1.737 -2.518 1228 HB2 GLN 65 HB2 GLN 65 5.918 -4.027 -3.954 1229 HB3 GLN 65 HB3 GLN 65 6.228 -2.572 -4.896 1230 HG2 GLN 65 HG2 GLN 65 8.528 -2.695 -4.573 1231 HG3 GLN 65 HG3 GLN 65 8.370 -3.723 -3.150 1232 HE21 GLN 65 HE21 GLN 65 9.936 -4.040 -5.624 1233 HE22 GLN 65 HE22 GLN 65 9.471 -5.574 -6.264 1234 H ILE 66 H ILE 66 3.736 -2.477 -2.366 1235 HA ILE 66 HA ILE 66 2.930 -0.138 -3.832 1236 HB ILE 66 HB ILE 66 1.363 -2.000 -2.031 1237 HG12 ILE 66 HG12 ILE 66 1.280 -1.634 -5.034 1238 HG13 ILE 66 HG13 ILE 66 2.203 -2.893 -4.220 1239 HG21 ILE 66 HG21 ILE 66 -0.648 -0.892 -2.702 1240 HG22 ILE 66 HG22 ILE 66 0.233 0.160 -3.808 1241 HG23 ILE 66 HG23 ILE 66 0.452 0.330 -2.066 1242 HD11 ILE 66 HD11 ILE 66 0.187 -3.865 -4.993 1243 HD12 ILE 66 HD12 ILE 66 -0.785 -2.568 -4.302 1244 HD13 ILE 66 HD13 ILE 66 0.046 -3.708 -3.243 1245 H ALA 67 H ALA 67 3.253 -1.067 -0.447 1246 HA ALA 67 HA ALA 67 2.147 1.168 0.785 1247 HB1 ALA 67 HB1 ALA 67 2.858 -0.976 1.881 1248 HB2 ALA 67 HB2 ALA 67 3.291 0.490 2.757 1249 HB3 ALA 67 HB3 ALA 67 4.514 -0.374 1.825 1250 H SER 68 H SER 68 5.513 0.605 -0.227 1251 HA SER 68 HA SER 68 6.547 3.031 0.767 1252 HB2 SER 68 HB2 SER 68 8.284 2.505 -1.193 1253 HB3 SER 68 HB3 SER 68 8.249 1.561 0.297 1254 HG SER 68 HG SER 68 7.308 -0.086 -0.737 1255 H GLU 69 H GLU 69 5.109 2.150 -2.313 1256 HA GLU 69 HA GLU 69 5.744 4.411 -3.800 1257 HB2 GLU 69 HB2 GLU 69 3.474 2.456 -3.906 1258 HB3 GLU 69 HB3 GLU 69 3.525 3.829 -5.002 1259 HG2 GLU 69 HG2 GLU 69 6.017 2.300 -4.861 1260 HG3 GLU 69 HG3 GLU 69 4.633 1.406 -5.493 1261 H TYR 70 H TYR 70 3.070 3.867 -1.563 1262 HA TYR 70 HA TYR 70 1.997 6.510 -2.128 1263 HB2 TYR 70 HB2 TYR 70 1.044 4.187 -0.479 1264 HB3 TYR 70 HB3 TYR 70 0.282 5.771 -0.361 1265 HD1 TYR 70 HD2 TYR 70 0.875 2.876 -2.543 1266 HD2 TYR 70 HD1 TYR 70 -1.062 6.644 -2.165 1267 HE1 TYR 70 HE2 TYR 70 -0.477 2.374 -4.536 1268 HE2 TYR 70 HE1 TYR 70 -2.417 6.154 -4.155 1269 HH TYR 70 HH TYR 70 -2.601 3.058 -5.557 1270 H LEU 71 H LEU 71 3.830 4.886 0.366 1271 HA LEU 71 HA LEU 71 3.414 6.867 2.363 1272 HB2 LEU 71 HB2 LEU 71 5.137 4.504 2.044 1273 HB3 LEU 71 HB3 LEU 71 5.810 5.770 3.054 1274 HG LEU 71 HG LEU 71 3.027 4.705 3.521 1275 HD11 LEU 71 HD11 LEU 71 3.948 3.241 5.253 1276 HD12 LEU 71 HD12 LEU 71 5.580 3.641 4.727 1277 HD13 LEU 71 HD13 LEU 71 4.490 2.771 3.645 1278 HD21 LEU 71 HD21 LEU 71 5.002 6.033 5.377 1279 HD22 LEU 71 HD22 LEU 71 3.343 5.572 5.754 1280 HD23 LEU 71 HD23 LEU 71 3.657 6.843 4.575 1281 H LYS 72 H LYS 72 5.423 6.714 -0.412 1282 HA LYS 72 HA LYS 72 7.210 8.801 0.521 1283 HB2 LYS 72 HB2 LYS 72 8.381 8.525 -1.526 1284 HB3 LYS 72 HB3 LYS 72 7.929 6.910 -1.001 1285 HG2 LYS 72 HG2 LYS 72 5.917 7.152 -2.548 1286 HG3 LYS 72 HG3 LYS 72 6.756 8.547 -3.224 1287 HD2 LYS 72 HD2 LYS 72 8.761 6.862 -3.414 1288 HD3 LYS 72 HD3 LYS 72 7.477 5.655 -3.344 1289 HE2 LYS 72 HE2 LYS 72 7.634 7.927 -5.319 1290 HE3 LYS 72 HE3 LYS 72 8.085 6.258 -5.653 1291 HZ1 LYS 72 HZ1 LYS 72 5.669 7.279 -6.141 1292 HZ2 LYS 72 HZ2 LYS 72 5.405 6.625 -4.604 1293 HZ3 LYS 72 HZ3 LYS 72 5.954 5.631 -5.865 1294 H LEU 73 H LEU 73 4.134 8.650 -0.714 1295 HA LEU 73 HA LEU 73 4.267 11.101 -2.259 1296 HB2 LEU 73 HB2 LEU 73 2.812 9.007 -2.747 1297 HB3 LEU 73 HB3 LEU 73 1.760 9.619 -1.493 1298 HG LEU 73 HG LEU 73 1.050 10.120 -3.837 1299 HD11 LEU 73 HD11 LEU 73 1.550 12.523 -2.098 1300 HD12 LEU 73 HD12 LEU 73 0.202 11.398 -1.949 1301 HD13 LEU 73 HD13 LEU 73 0.356 12.398 -3.393 1302 HD21 LEU 73 HD21 LEU 73 2.143 11.663 -5.194 1303 HD22 LEU 73 HD22 LEU 73 3.437 10.628 -4.593 1304 HD23 LEU 73 HD23 LEU 73 3.182 12.226 -3.888 1305 H LYS 74 H LYS 74 2.831 9.913 0.752 1306 HA LYS 74 HA LYS 74 1.600 12.343 1.492 1307 HB2 LYS 74 HB2 LYS 74 1.377 11.367 3.717 1308 HB3 LYS 74 HB3 LYS 74 0.941 10.201 2.478 1309 HG2 LYS 74 HG2 LYS 74 2.303 8.764 3.464 1310 HG3 LYS 74 HG3 LYS 74 3.657 9.771 2.947 1311 HD2 LYS 74 HD2 LYS 74 3.952 9.546 5.263 1312 HD3 LYS 74 HD3 LYS 74 3.209 11.134 5.075 1313 HE2 LYS 74 HE2 LYS 74 1.015 10.143 5.596 1314 HE3 LYS 74 HE3 LYS 74 1.793 8.577 5.828 1315 HZ1 LYS 74 HZ1 LYS 74 2.131 11.029 7.459 1316 HZ2 LYS 74 HZ2 LYS 74 3.174 9.706 7.576 1317 HZ3 LYS 74 HZ3 LYS 74 1.541 9.525 7.955 1318 H GLU 75 H GLU 75 4.875 11.324 1.602 1319 HA GLU 75 HA GLU 75 5.792 12.968 3.717 1320 HB2 GLU 75 HB2 GLU 75 7.068 11.059 2.787 1321 HB3 GLU 75 HB3 GLU 75 7.290 11.951 1.289 1322 HG2 GLU 75 HG2 GLU 75 9.287 12.059 2.638 1323 HG3 GLU 75 HG3 GLU 75 8.558 13.657 2.501 1324 H GLU 76 H GLU 76 5.726 13.387 0.194 1325 HA GLU 76 HA GLU 76 6.831 15.940 0.033 1326 HB2 GLU 76 HB2 GLU 76 6.534 14.575 -1.940 1327 HB3 GLU 76 HB3 GLU 76 4.790 14.564 -1.726 1328 HG2 GLU 76 HG2 GLU 76 5.101 16.102 -3.424 1329 HG3 GLU 76 HG3 GLU 76 4.946 17.117 -1.993 1330 H TYR 77 H TYR 77 3.507 14.902 0.542 1331 HA TYR 77 HA TYR 77 2.105 17.243 0.261 1332 HB2 TYR 77 HB2 TYR 77 0.967 15.165 0.641 1333 HB3 TYR 77 HB3 TYR 77 1.710 14.978 2.222 1334 HD1 TYR 77 HD2 TYR 77 0.172 18.094 0.909 1335 HD2 TYR 77 HD1 TYR 77 -0.234 14.785 3.550 1336 HE1 TYR 77 HE2 TYR 77 -1.784 19.166 1.943 1337 HE2 TYR 77 HE1 TYR 77 -2.191 15.848 4.588 1338 HH TYR 77 HH TYR 77 -3.506 17.626 4.653 1339 H GLN 78 H GLN 78 3.699 16.102 3.241 1340 HA GLN 78 HA GLN 78 2.987 18.459 4.695 1341 HB2 GLN 78 HB2 GLN 78 4.964 16.264 5.288 1342 HB3 GLN 78 HB3 GLN 78 4.577 17.564 6.405 1343 HG2 GLN 78 HG2 GLN 78 2.123 16.749 6.033 1344 HG3 GLN 78 HG3 GLN 78 2.913 15.258 5.525 1345 HE21 GLN 78 HE21 GLN 78 3.941 17.525 8.024 1346 HE22 GLN 78 HE22 GLN 78 3.802 16.410 9.338 1347 H ARG 79 H ARG 79 5.768 17.489 2.801 1348 HA ARG 79 HA ARG 79 7.567 19.435 3.803 1349 HB2 ARG 79 HB2 ARG 79 7.554 18.012 1.142 1350 HB3 ARG 79 HB3 ARG 79 8.899 18.946 1.780 1351 HG2 ARG 79 HG2 ARG 79 7.750 16.432 2.976 1352 HG3 ARG 79 HG3 ARG 79 9.274 16.578 2.099 1353 HD2 ARG 79 HD2 ARG 79 10.164 18.030 3.825 1354 HD3 ARG 79 HD3 ARG 79 8.620 17.998 4.679 1355 HE ARG 79 HE ARG 79 9.180 15.407 4.633 1356 HH11 ARG 79 HH11 ARG 79 11.237 18.139 5.418 1357 HH12 ARG 79 HH12 ARG 79 12.277 17.214 6.452 1358 HH21 ARG 79 HH21 ARG 79 10.513 14.203 5.994 1359 HH22 ARG 79 HH22 ARG 79 11.874 14.953 6.776 1360 H LEU 80 H LEU 80 5.541 19.406 0.862 1361 HA LEU 80 HA LEU 80 6.391 22.015 0.084 1362 HB2 LEU 80 HB2 LEU 80 4.995 21.812 -1.741 1363 HB3 LEU 80 HB3 LEU 80 5.407 20.150 -1.378 1364 HG LEU 80 HG LEU 80 3.061 20.611 0.070 1365 HD11 LEU 80 HD11 LEU 80 2.751 21.717 -2.717 1366 HD12 LEU 80 HD12 LEU 80 2.749 22.683 -1.240 1367 HD13 LEU 80 HD13 LEU 80 1.480 21.491 -1.516 1368 HD21 LEU 80 HD21 LEU 80 3.673 18.533 -1.040 1369 HD22 LEU 80 HD22 LEU 80 3.434 19.290 -2.617 1370 HD23 LEU 80 HD23 LEU 80 2.065 19.059 -1.532 1371 H ARG 81 H ARG 81 3.915 20.848 2.204 1372 HA ARG 81 HA ARG 81 2.364 23.262 2.127 1373 HB2 ARG 81 HB2 ARG 81 2.290 20.789 3.821 1374 HB3 ARG 81 HB3 ARG 81 1.337 22.201 4.261 1375 HG2 ARG 81 HG2 ARG 81 1.052 21.464 1.462 1376 HG3 ARG 81 HG3 ARG 81 0.555 20.185 2.571 1377 HD2 ARG 81 HD2 ARG 81 -1.239 21.828 1.867 1378 HD3 ARG 81 HD3 ARG 81 -1.050 21.572 3.598 1379 HE ARG 81 HE ARG 81 0.348 23.837 2.414 1380 HH11 ARG 81 HH11 ARG 81 -2.335 22.655 4.323 1381 HH12 ARG 81 HH12 ARG 81 -2.726 24.217 4.970 1382 HH21 ARG 81 HH21 ARG 81 -0.149 25.901 3.306 1383 HH22 ARG 81 HH22 ARG 81 -1.481 26.057 4.404 1384 H GLU 82 H GLU 82 4.869 21.930 4.245 1385 HA GLU 82 HA GLU 82 4.637 24.018 6.176 1386 HB2 GLU 82 HB2 GLU 82 6.655 23.152 7.152 1387 HB3 GLU 82 HB3 GLU 82 5.620 21.808 6.699 1388 HG2 GLU 82 HG2 GLU 82 6.975 21.306 4.809 1389 HG3 GLU 82 HG3 GLU 82 7.911 22.785 5.022 1390 H GLN 83 H GLN 83 6.270 23.663 3.158 1391 HA GLN 83 HA GLN 83 8.066 25.880 3.582 1392 HB2 GLN 83 HB2 GLN 83 8.471 23.842 2.082 1393 HB3 GLN 83 HB3 GLN 83 7.389 24.611 0.932 1394 HG2 GLN 83 HG2 GLN 83 9.694 25.065 0.369 1395 HG3 GLN 83 HG3 GLN 83 8.868 26.552 0.835 1396 HE21 GLN 83 HE21 GLN 83 9.419 27.562 2.758 1397 HE22 GLN 83 HE22 GLN 83 10.867 27.176 3.621 1398 H LEU 84 H LEU 84 4.839 25.461 2.611 1399 HA LEU 84 HA LEU 84 4.667 27.861 1.022 1400 HB2 LEU 84 HB2 LEU 84 3.233 25.965 0.492 1401 HB3 LEU 84 HB3 LEU 84 2.536 26.018 2.099 1402 HG LEU 84 HG LEU 84 1.624 28.294 1.566 1403 HD11 LEU 84 HD11 LEU 84 2.491 27.627 -1.246 1404 HD12 LEU 84 HD12 LEU 84 3.163 28.900 -0.226 1405 HD13 LEU 84 HD13 LEU 84 1.488 28.994 -0.761 1406 HD21 LEU 84 HD21 LEU 84 0.735 25.994 -0.175 1407 HD22 LEU 84 HD22 LEU 84 -0.182 27.479 0.074 1408 HD23 LEU 84 HD23 LEU 84 0.141 26.407 1.436 1409 H LYS 85 H LYS 85 4.059 26.889 4.318 1410 HA LYS 85 HA LYS 85 2.781 29.431 4.928 1411 HB2 LYS 85 HB2 LYS 85 2.463 28.506 7.182 1412 HB3 LYS 85 HB3 LYS 85 1.827 27.435 5.946 1413 HG2 LYS 85 HG2 LYS 85 3.509 25.878 6.241 1414 HG3 LYS 85 HG3 LYS 85 4.580 27.032 7.034 1415 HD2 LYS 85 HD2 LYS 85 1.961 26.277 8.272 1416 HD3 LYS 85 HD3 LYS 85 3.374 25.237 8.459 1417 HE2 LYS 85 HE2 LYS 85 4.626 27.132 9.391 1418 HE3 LYS 85 HE3 LYS 85 3.194 28.145 9.235 1419 HZ1 LYS 85 HZ1 LYS 85 3.354 27.351 11.466 1420 HZ2 LYS 85 HZ2 LYS 85 3.483 25.747 10.948 1421 HZ3 LYS 85 HZ3 LYS 85 2.036 26.590 10.727 1422 H LYS 86 H LYS 86 3.520 30.425 7.088 1423 HA LYS 86 HA LYS 86 6.439 30.770 6.945 1424 HB2 LYS 86 HB2 LYS 86 4.288 32.678 7.896 1425 HB3 LYS 86 HB3 LYS 86 6.014 33.006 7.954 1426 HG2 LYS 86 HG2 LYS 86 4.770 32.284 5.352 1427 HG3 LYS 86 HG3 LYS 86 4.536 33.910 5.999 1428 HD2 LYS 86 HD2 LYS 86 7.242 32.622 5.678 1429 HD3 LYS 86 HD3 LYS 86 6.496 33.639 4.444 1430 HE2 LYS 86 HE2 LYS 86 6.309 35.440 6.176 1431 HE3 LYS 86 HE3 LYS 86 7.276 34.428 7.244 1432 HZ1 LYS 86 HZ1 LYS 86 8.207 35.238 4.557 1433 HZ2 LYS 86 HZ2 LYS 86 9.123 34.603 5.828 1434 HZ3 LYS 86 HZ3 LYS 86 8.498 36.171 5.935 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 39.615 -0.767 -13.618 2 H2 GLY 1 H2 GLY 1 39.362 -2.374 -14.081 3 H3 GLY 1 H3 GLY 1 40.873 -1.889 -13.502 4 HA2 GLY 1 HA3 GLY 1 39.687 -3.112 -11.806 5 HA3 GLY 1 HA2 GLY 1 39.941 -1.440 -11.327 6 H SER 2 H SER 2 38.219 -0.774 -10.219 7 HA SER 2 HA SER 2 35.597 -1.846 -10.675 8 HB2 SER 2 HB2 SER 2 36.058 0.645 -9.081 9 HB3 SER 2 HB3 SER 2 35.003 -0.726 -8.738 10 HG SER 2 HG SER 2 37.039 -0.469 -7.463 11 H HIS 3 H HIS 3 34.060 -1.063 -12.021 12 HA HIS 3 HA HIS 3 34.691 1.326 -13.556 13 HB2 HIS 3 HB2 HIS 3 33.719 -0.922 -14.482 14 HB3 HIS 3 HB3 HIS 3 32.178 -0.274 -13.928 15 HD1 HIS 3 HD1 HIS 3 34.649 -0.037 -16.650 16 HD2 HIS 3 HD2 HIS 3 31.369 2.133 -15.295 17 HE1 HIS 3 HE1 HIS 3 34.040 1.517 -18.528 18 HE2 HIS 3 HE2 HIS 3 32.033 2.797 -17.709 19 H MET 4 H MET 4 33.906 3.257 -13.131 20 HA MET 4 HA MET 4 32.274 3.741 -10.866 21 HB2 MET 4 HB2 MET 4 33.267 5.502 -13.097 22 HB3 MET 4 HB3 MET 4 32.236 6.119 -11.812 23 HG2 MET 4 HG2 MET 4 33.871 6.002 -10.247 24 HG3 MET 4 HG3 MET 4 34.655 4.617 -11.006 25 HE1 MET 4 HE1 MET 4 37.578 7.059 -11.066 26 HE2 MET 4 HE2 MET 4 36.729 5.797 -10.174 27 HE3 MET 4 HE3 MET 4 36.322 7.492 -9.905 28 H THR 5 H THR 5 30.176 4.405 -10.680 29 HA THR 5 HA THR 5 28.504 4.567 -13.070 30 HB THR 5 HB THR 5 27.710 2.808 -10.739 31 HG1 THR 5 HG1 THR 5 29.500 2.302 -12.676 32 HG21 THR 5 HG21 THR 5 26.078 1.911 -12.354 33 HG22 THR 5 HG22 THR 5 26.643 3.074 -13.555 34 HG23 THR 5 HG23 THR 5 25.852 3.638 -12.082 35 H GLU 6 H GLU 6 26.395 5.550 -12.601 36 HA GLU 6 HA GLU 6 26.621 7.689 -10.716 37 HB2 GLU 6 HB2 GLU 6 24.193 6.833 -12.296 38 HB3 GLU 6 HB3 GLU 6 24.466 8.404 -11.558 39 HG2 GLU 6 HG2 GLU 6 26.268 8.863 -13.096 40 HG3 GLU 6 HG3 GLU 6 26.122 7.247 -13.789 41 H GLN 7 H GLN 7 24.356 8.117 -9.474 42 HA GLN 7 HA GLN 7 23.910 5.702 -7.857 43 HB2 GLN 7 HB2 GLN 7 23.342 7.323 -6.002 44 HB3 GLN 7 HB3 GLN 7 25.028 7.279 -6.486 45 HG2 GLN 7 HG2 GLN 7 24.766 9.319 -7.743 46 HG3 GLN 7 HG3 GLN 7 23.038 9.343 -7.401 47 HE21 GLN 7 HE21 GLN 7 23.020 11.274 -6.341 48 HE22 GLN 7 HE22 GLN 7 23.777 11.528 -4.806 49 HA PRO 8 HA PRO 8 19.730 6.645 -9.380 50 HB2 PRO 8 HB2 PRO 8 19.211 4.183 -10.371 51 HB3 PRO 8 HB3 PRO 8 20.176 5.365 -11.256 52 HG2 PRO 8 HG2 PRO 8 21.019 2.893 -9.918 53 HG3 PRO 8 HG3 PRO 8 21.840 3.826 -11.176 54 HD2 PRO 8 HD2 PRO 8 22.304 3.840 -8.322 55 HD3 PRO 8 HD3 PRO 8 23.211 4.679 -9.595 56 H LYS 9 H LYS 9 17.678 4.999 -9.062 57 HA LYS 9 HA LYS 9 17.204 4.825 -6.331 58 HB2 LYS 9 HB2 LYS 9 15.302 3.279 -6.974 59 HB3 LYS 9 HB3 LYS 9 15.311 4.853 -7.753 60 HG2 LYS 9 HG2 LYS 9 15.795 3.982 -9.823 61 HG3 LYS 9 HG3 LYS 9 16.595 2.556 -9.156 62 HD2 LYS 9 HD2 LYS 9 14.590 1.459 -8.766 63 HD3 LYS 9 HD3 LYS 9 13.659 2.956 -8.724 64 HE2 LYS 9 HE2 LYS 9 14.976 1.903 -11.213 65 HE3 LYS 9 HE3 LYS 9 13.324 1.500 -10.752 66 HZ1 LYS 9 HZ1 LYS 9 12.977 4.002 -10.652 67 HZ2 LYS 9 HZ2 LYS 9 13.113 3.303 -12.184 68 HZ3 LYS 9 HZ3 LYS 9 14.425 4.133 -11.512 69 H THR 10 H THR 10 18.441 3.669 -4.986 70 HA THR 10 HA THR 10 19.552 1.138 -5.805 71 HB THR 10 HB THR 10 20.775 2.928 -4.444 72 HG1 THR 10 HG1 THR 10 21.049 0.587 -2.997 73 HG21 THR 10 HG21 THR 10 19.096 1.702 -2.255 74 HG22 THR 10 HG22 THR 10 19.125 3.393 -2.754 75 HG23 THR 10 HG23 THR 10 20.539 2.678 -1.979 76 H ARG 11 H ARG 11 19.407 -0.766 -4.438 77 HA ARG 11 HA ARG 11 16.670 -1.139 -3.481 78 HB2 ARG 11 HB2 ARG 11 16.924 -3.431 -3.890 79 HB3 ARG 11 HB3 ARG 11 17.799 -2.677 -5.215 80 HG2 ARG 11 HG2 ARG 11 19.878 -2.975 -3.734 81 HG3 ARG 11 HG3 ARG 11 18.878 -4.101 -2.816 82 HD2 ARG 11 HD2 ARG 11 20.006 -5.442 -4.367 83 HD3 ARG 11 HD3 ARG 11 18.396 -5.229 -5.051 84 HE ARG 11 HE ARG 11 20.411 -3.342 -5.945 85 HH11 ARG 11 HH11 ARG 11 18.723 -6.346 -6.577 86 HH12 ARG 11 HH12 ARG 11 19.098 -6.349 -8.270 87 HH21 ARG 11 HH21 ARG 11 20.942 -3.360 -8.165 88 HH22 ARG 11 HH22 ARG 11 20.377 -4.661 -9.168 89 H VAL 12 H VAL 12 16.277 -2.219 -1.486 90 HA VAL 12 HA VAL 12 18.522 -2.187 0.408 91 HB VAL 12 HB VAL 12 17.212 -0.086 0.644 92 HG11 VAL 12 HG11 VAL 12 14.951 -0.338 1.785 93 HG12 VAL 12 HG12 VAL 12 14.972 -2.001 1.199 94 HG13 VAL 12 HG13 VAL 12 15.023 -0.663 0.053 95 HG21 VAL 12 HG21 VAL 12 17.105 -1.995 2.973 96 HG22 VAL 12 HG22 VAL 12 16.866 -0.253 3.096 97 HG23 VAL 12 HG23 VAL 12 18.419 -0.896 2.559 98 H SER 13 H SER 13 18.437 -3.732 2.016 99 HA SER 13 HA SER 13 16.541 -5.894 1.557 100 HB2 SER 13 HB2 SER 13 18.873 -6.536 1.661 101 HB3 SER 13 HB3 SER 13 19.071 -5.722 3.211 102 HG SER 13 HG SER 13 17.378 -7.963 2.722 103 H VAL 14 H VAL 14 14.725 -5.931 2.713 104 HA VAL 14 HA VAL 14 14.818 -4.940 5.488 105 HB VAL 14 HB VAL 14 12.382 -4.327 5.193 106 HG11 VAL 14 HG11 VAL 14 14.050 -2.612 5.368 107 HG12 VAL 14 HG12 VAL 14 12.898 -2.155 4.112 108 HG13 VAL 14 HG13 VAL 14 14.478 -2.798 3.668 109 HG21 VAL 14 HG21 VAL 14 13.042 -4.363 2.252 110 HG22 VAL 14 HG22 VAL 14 11.506 -3.935 3.003 111 HG23 VAL 14 HG23 VAL 14 12.081 -5.600 3.061 112 H ARG 15 H ARG 15 13.568 -6.047 6.996 113 HA ARG 15 HA ARG 15 12.855 -8.759 6.168 114 HB2 ARG 15 HB2 ARG 15 14.533 -8.487 7.966 115 HB3 ARG 15 HB3 ARG 15 13.319 -7.680 8.947 116 HG2 ARG 15 HG2 ARG 15 11.941 -9.790 8.744 117 HG3 ARG 15 HG3 ARG 15 13.383 -10.547 8.065 118 HD2 ARG 15 HD2 ARG 15 13.137 -9.272 10.783 119 HD3 ARG 15 HD3 ARG 15 13.246 -10.996 10.440 120 HE ARG 15 HE ARG 15 15.509 -10.162 9.356 121 HH11 ARG 15 HH11 ARG 15 14.069 -9.303 12.428 122 HH12 ARG 15 HH12 ARG 15 15.590 -8.969 13.191 123 HH21 ARG 15 HH21 ARG 15 17.509 -9.725 10.344 124 HH22 ARG 15 HH22 ARG 15 17.557 -9.215 12.002 125 H ILE 16 H ILE 16 10.807 -9.406 6.107 126 HA ILE 16 HA ILE 16 8.805 -7.949 7.698 127 HB ILE 16 HB ILE 16 8.102 -8.953 4.959 128 HG12 ILE 16 HG12 ILE 16 9.012 -6.126 5.512 129 HG13 ILE 16 HG13 ILE 16 10.068 -7.351 4.820 130 HG21 ILE 16 HG21 ILE 16 6.336 -8.364 6.588 131 HG22 ILE 16 HG22 ILE 16 6.297 -7.349 5.147 132 HG23 ILE 16 HG23 ILE 16 6.972 -6.719 6.650 133 HD11 ILE 16 HD11 ILE 16 7.599 -6.141 3.623 134 HD12 ILE 16 HD12 ILE 16 8.354 -7.600 2.982 135 HD13 ILE 16 HD13 ILE 16 9.254 -6.083 3.019 136 H TYR 17 H TYR 17 7.897 -9.334 9.035 137 HA TYR 17 HA TYR 17 6.959 -11.192 9.925 138 HB2 TYR 17 HB2 TYR 17 5.903 -11.012 7.388 139 HB3 TYR 17 HB3 TYR 17 6.503 -12.665 7.433 140 HD1 TYR 17 HD1 TYR 17 4.233 -10.260 9.087 141 HD2 TYR 17 HD2 TYR 17 5.382 -14.334 8.686 142 HE1 TYR 17 HE1 TYR 17 2.218 -10.941 10.322 143 HE2 TYR 17 HE2 TYR 17 3.373 -15.031 9.921 144 HH TYR 17 HH TYR 17 0.755 -13.102 10.437 145 H GLY 18 H GLY 18 9.844 -11.141 9.374 146 HA2 GLY 18 HA2 GLY 18 11.366 -12.765 10.211 147 HA3 GLY 18 HA3 GLY 18 10.272 -14.029 9.680 148 H GLN 19 H GLN 19 10.024 -12.640 6.998 149 HA GLN 19 HA GLN 19 12.513 -13.750 5.901 150 HB2 GLN 19 HB2 GLN 19 9.791 -13.276 4.688 151 HB3 GLN 19 HB3 GLN 19 11.200 -13.667 3.712 152 HG2 GLN 19 HG2 GLN 19 10.167 -15.389 5.950 153 HG3 GLN 19 HG3 GLN 19 9.743 -15.602 4.252 154 HE21 GLN 19 HE21 GLN 19 11.178 -17.343 6.150 155 HE22 GLN 19 HE22 GLN 19 12.678 -17.718 5.385 156 H ASP 20 H ASP 20 13.847 -12.552 4.582 157 HA ASP 20 HA ASP 20 13.261 -9.676 4.552 158 HB2 ASP 20 HB2 ASP 20 15.487 -9.218 4.783 159 HB3 ASP 20 HB3 ASP 20 15.465 -10.803 5.545 160 H TYR 21 H TYR 21 13.359 -8.481 2.712 161 HA TYR 21 HA TYR 21 13.805 -9.905 0.178 162 HB2 TYR 21 HB2 TYR 21 11.526 -7.959 0.567 163 HB3 TYR 21 HB3 TYR 21 11.829 -8.999 -0.816 164 HD1 TYR 21 HD1 TYR 21 11.495 -11.487 -0.572 165 HD2 TYR 21 HD2 TYR 21 10.268 -8.706 2.409 166 HE1 TYR 21 HE1 TYR 21 10.003 -13.188 0.391 167 HE2 TYR 21 HE2 TYR 21 8.775 -10.405 3.384 168 HH TYR 21 HH TYR 21 7.703 -12.419 2.881 169 H THR 22 H THR 22 14.437 -8.554 -1.558 170 HA THR 22 HA THR 22 15.660 -6.048 -0.687 171 HB THR 22 HB THR 22 16.556 -6.424 -3.233 172 HG1 THR 22 HG1 THR 22 17.125 -8.807 -3.087 173 HG21 THR 22 HG21 THR 22 17.962 -5.967 -1.306 174 HG22 THR 22 HG22 THR 22 18.591 -7.362 -2.180 175 HG23 THR 22 HG23 THR 22 17.685 -7.594 -0.686 176 H ILE 23 H ILE 23 14.264 -4.399 -0.884 177 HA ILE 23 HA ILE 23 12.694 -4.193 -3.375 178 HB ILE 23 HB ILE 23 11.126 -2.757 -2.178 179 HG12 ILE 23 HG12 ILE 23 12.753 -3.352 0.306 180 HG13 ILE 23 HG13 ILE 23 12.793 -1.823 -0.564 181 HG21 ILE 23 HG21 ILE 23 11.613 -5.295 -0.630 182 HG22 ILE 23 HG22 ILE 23 10.844 -5.220 -2.214 183 HG23 ILE 23 HG23 ILE 23 10.080 -4.445 -0.828 184 HD11 ILE 23 HD11 ILE 23 10.536 -3.027 0.996 185 HD12 ILE 23 HD12 ILE 23 10.298 -1.696 -0.138 186 HD13 ILE 23 HD13 ILE 23 11.359 -1.490 1.254 187 H VAL 24 H VAL 24 12.061 -1.662 -3.622 188 HA VAL 24 HA VAL 24 14.631 -0.370 -4.044 189 HB VAL 24 HB VAL 24 11.871 0.522 -4.892 190 HG11 VAL 24 HG11 VAL 24 13.005 2.064 -6.372 191 HG12 VAL 24 HG12 VAL 24 14.576 1.490 -5.806 192 HG13 VAL 24 HG13 VAL 24 13.506 2.356 -4.705 193 HG21 VAL 24 HG21 VAL 24 12.507 -1.590 -5.937 194 HG22 VAL 24 HG22 VAL 24 14.028 -0.874 -6.473 195 HG23 VAL 24 HG23 VAL 24 12.498 -0.278 -7.116 196 H GLY 25 H GLY 25 15.431 1.151 -2.736 197 HA2 GLY 25 HA2 GLY 25 13.537 2.653 -1.038 198 HA3 GLY 25 HA3 GLY 25 15.019 1.979 -0.375 199 H ALA 26 H ALA 26 13.675 4.413 -2.512 200 HA ALA 26 HA ALA 26 16.300 5.751 -2.525 201 HB1 ALA 26 HB1 ALA 26 15.515 5.028 -4.744 202 HB2 ALA 26 HB2 ALA 26 15.703 6.777 -4.624 203 HB3 ALA 26 HB3 ALA 26 14.095 6.054 -4.554 204 H GLU 27 H GLU 27 13.603 5.937 -0.808 205 HA GLU 27 HA GLU 27 13.051 8.759 -1.128 206 HB2 GLU 27 HB2 GLU 27 11.386 6.849 -0.435 207 HB3 GLU 27 HB3 GLU 27 11.996 7.155 1.181 208 HG2 GLU 27 HG2 GLU 27 10.960 9.391 -0.514 209 HG3 GLU 27 HG3 GLU 27 9.868 8.355 0.401 210 H SER 28 H SER 28 13.939 6.880 1.795 211 HA SER 28 HA SER 28 16.103 8.683 2.373 212 HB2 SER 28 HB2 SER 28 13.847 8.470 4.384 213 HB3 SER 28 HB3 SER 28 15.291 9.469 4.501 214 HG SER 28 HG SER 28 12.982 9.819 2.943 215 HA PRO 29 HA PRO 29 18.010 4.935 3.706 216 HB2 PRO 29 HB2 PRO 29 19.044 6.734 5.863 217 HB3 PRO 29 HB3 PRO 29 19.910 5.554 4.869 218 HG2 PRO 29 HG2 PRO 29 20.057 8.130 4.289 219 HG3 PRO 29 HG3 PRO 29 19.899 6.929 2.994 220 HD2 PRO 29 HD2 PRO 29 17.870 8.820 4.088 221 HD3 PRO 29 HD3 PRO 29 18.063 8.197 2.437 222 H ALA 30 H ALA 30 16.476 6.887 6.304 223 HA ALA 30 HA ALA 30 16.170 4.416 7.855 224 HB1 ALA 30 HB1 ALA 30 15.699 5.772 9.756 225 HB2 ALA 30 HB2 ALA 30 15.522 7.213 8.755 226 HB3 ALA 30 HB3 ALA 30 17.104 6.460 8.943 227 H HIS 31 H HIS 31 14.296 6.842 6.173 228 HA HIS 31 HA HIS 31 11.766 6.192 7.223 229 HB2 HIS 31 HB2 HIS 31 12.452 8.227 5.806 230 HB3 HIS 31 HB3 HIS 31 12.182 7.185 4.413 231 HD1 HIS 31 HD1 HIS 31 10.295 8.525 7.416 232 HD2 HIS 31 HD2 HIS 31 9.581 7.107 3.575 233 HE1 HIS 31 HE1 HIS 31 7.836 8.830 7.035 234 HE2 HIS 31 HE2 HIS 31 7.485 8.211 4.625 235 H ILE 32 H ILE 32 13.654 4.771 4.645 236 HA ILE 32 HA ILE 32 11.508 3.187 3.590 237 HB ILE 32 HB ILE 32 13.200 2.028 2.274 238 HG12 ILE 32 HG12 ILE 32 15.260 3.686 3.756 239 HG13 ILE 32 HG13 ILE 32 14.976 1.973 4.030 240 HG21 ILE 32 HG21 ILE 32 13.859 3.862 0.917 241 HG22 ILE 32 HG22 ILE 32 13.802 4.973 2.284 242 HG23 ILE 32 HG23 ILE 32 12.310 4.284 1.648 243 HD11 ILE 32 HD11 ILE 32 16.875 2.165 2.649 244 HD12 ILE 32 HD12 ILE 32 16.069 3.303 1.572 245 HD13 ILE 32 HD13 ILE 32 15.556 1.615 1.616 246 H ARG 33 H ARG 33 13.278 2.927 6.416 247 HA ARG 33 HA ARG 33 13.293 0.025 6.469 248 HB2 ARG 33 HB2 ARG 33 13.938 1.967 8.690 249 HB3 ARG 33 HB3 ARG 33 14.287 0.244 8.675 250 HG2 ARG 33 HG2 ARG 33 15.784 0.616 6.735 251 HG3 ARG 33 HG3 ARG 33 15.501 2.349 6.901 252 HD2 ARG 33 HD2 ARG 33 16.255 1.955 9.369 253 HD3 ARG 33 HD3 ARG 33 16.983 0.490 8.709 254 HE ARG 33 HE ARG 33 17.695 2.738 7.144 255 HH11 ARG 33 HH11 ARG 33 18.347 1.207 10.224 256 HH12 ARG 33 HH12 ARG 33 19.948 1.861 10.359 257 HH21 ARG 33 HH21 ARG 33 19.804 3.613 7.321 258 HH22 ARG 33 HH22 ARG 33 20.777 3.235 8.702 259 H LEU 34 H LEU 34 11.545 2.712 7.953 260 HA LEU 34 HA LEU 34 9.940 1.065 9.616 261 HB2 LEU 34 HB2 LEU 34 8.573 3.047 10.000 262 HB3 LEU 34 HB3 LEU 34 10.280 3.392 10.177 263 HG LEU 34 HG LEU 34 9.970 4.177 7.633 264 HD11 LEU 34 HD11 LEU 34 7.289 4.709 8.907 265 HD12 LEU 34 HD12 LEU 34 7.587 3.600 7.567 266 HD13 LEU 34 HD13 LEU 34 7.853 5.331 7.356 267 HD21 LEU 34 HD21 LEU 34 10.889 5.515 9.436 268 HD22 LEU 34 HD22 LEU 34 9.274 5.783 10.088 269 HD23 LEU 34 HD23 LEU 34 9.714 6.457 8.519 270 H VAL 35 H VAL 35 9.878 1.794 6.294 271 HA VAL 35 HA VAL 35 7.172 1.606 5.637 272 HB VAL 35 HB VAL 35 9.599 0.648 4.094 273 HG11 VAL 35 HG11 VAL 35 7.425 -0.442 3.422 274 HG12 VAL 35 HG12 VAL 35 8.253 0.453 2.150 275 HG13 VAL 35 HG13 VAL 35 6.856 1.161 2.961 276 HG21 VAL 35 HG21 VAL 35 9.404 3.099 4.636 277 HG22 VAL 35 HG22 VAL 35 7.948 3.127 3.644 278 HG23 VAL 35 HG23 VAL 35 9.499 2.709 2.919 279 H ALA 36 H ALA 36 9.646 -0.922 5.782 280 HA ALA 36 HA ALA 36 7.905 -3.100 5.314 281 HB1 ALA 36 HB1 ALA 36 9.806 -4.454 6.262 282 HB2 ALA 36 HB2 ALA 36 10.638 -2.929 6.554 283 HB3 ALA 36 HB3 ALA 36 10.216 -3.402 4.907 284 H ALA 37 H ALA 37 9.043 -1.537 8.252 285 HA ALA 37 HA ALA 37 8.112 -3.412 10.122 286 HB1 ALA 37 HB1 ALA 37 9.689 -1.654 10.712 287 HB2 ALA 37 HB2 ALA 37 8.268 -1.590 11.751 288 HB3 ALA 37 HB3 ALA 37 8.449 -0.431 10.437 289 H PHE 38 H PHE 38 6.522 -0.757 8.479 290 HA PHE 38 HA PHE 38 4.161 -0.703 10.043 291 HB2 PHE 38 HB2 PHE 38 4.592 1.215 8.732 292 HB3 PHE 38 HB3 PHE 38 4.873 0.264 7.279 293 HD1 PHE 38 HD1 PHE 38 2.203 1.227 9.677 294 HD2 PHE 38 HD2 PHE 38 3.185 -0.009 5.728 295 HE1 PHE 38 HE1 PHE 38 -0.125 1.613 8.981 296 HE2 PHE 38 HE2 PHE 38 0.862 0.367 5.025 297 HZ PHE 38 HZ PHE 38 -0.799 1.180 6.650 298 H VAL 39 H VAL 39 5.010 -2.336 7.021 299 HA VAL 39 HA VAL 39 2.469 -3.532 6.612 300 HB VAL 39 HB VAL 39 5.151 -4.472 5.579 301 HG11 VAL 39 HG11 VAL 39 3.409 -6.151 5.327 302 HG12 VAL 39 HG12 VAL 39 3.842 -5.470 3.758 303 HG13 VAL 39 HG13 VAL 39 2.354 -4.965 4.558 304 HG21 VAL 39 HG21 VAL 39 3.579 -3.059 3.651 305 HG22 VAL 39 HG22 VAL 39 5.208 -2.711 4.236 306 HG23 VAL 39 HG23 VAL 39 3.807 -2.053 5.081 307 H ASP 40 H ASP 40 5.436 -4.601 8.179 308 HA ASP 40 HA ASP 40 4.850 -7.287 8.627 309 HB2 ASP 40 HB2 ASP 40 7.011 -5.961 9.090 310 HB3 ASP 40 HB3 ASP 40 6.279 -5.543 10.634 311 H ASP 41 H ASP 41 4.181 -4.479 10.694 312 HA ASP 41 HA ASP 41 2.874 -5.941 12.733 313 HB2 ASP 41 HB2 ASP 41 3.857 -3.627 12.954 314 HB3 ASP 41 HB3 ASP 41 2.453 -3.024 12.080 315 H LYS 42 H LYS 42 1.695 -4.277 9.851 316 HA LYS 42 HA LYS 42 -1.045 -4.474 10.498 317 HB2 LYS 42 HB2 LYS 42 0.108 -3.004 8.709 318 HB3 LYS 42 HB3 LYS 42 -0.035 -4.415 7.668 319 HG2 LYS 42 HG2 LYS 42 -2.240 -4.139 7.381 320 HG3 LYS 42 HG3 LYS 42 -2.506 -3.678 9.060 321 HD2 LYS 42 HD2 LYS 42 -1.187 -1.505 8.219 322 HD3 LYS 42 HD3 LYS 42 -1.926 -1.999 6.694 323 HE2 LYS 42 HE2 LYS 42 -3.418 -0.477 7.771 324 HE3 LYS 42 HE3 LYS 42 -4.122 -2.090 7.877 325 HZ1 LYS 42 HZ1 LYS 42 -2.637 -0.702 10.036 326 HZ2 LYS 42 HZ2 LYS 42 -3.283 -2.264 10.152 327 HZ3 LYS 42 HZ3 LYS 42 -4.307 -0.927 9.973 328 H MET 43 H MET 43 1.076 -6.581 8.559 329 HA MET 43 HA MET 43 -0.953 -8.393 7.800 330 HB2 MET 43 HB2 MET 43 2.031 -8.694 8.096 331 HB3 MET 43 HB3 MET 43 1.010 -10.045 7.616 332 HG2 MET 43 HG2 MET 43 0.169 -8.517 5.757 333 HG3 MET 43 HG3 MET 43 1.545 -7.487 6.147 334 HE1 MET 43 HE1 MET 43 4.504 -10.084 5.601 335 HE2 MET 43 HE2 MET 43 3.552 -9.978 7.082 336 HE3 MET 43 HE3 MET 43 4.070 -8.507 6.258 337 H HIS 44 H HIS 44 1.023 -8.073 10.646 338 HA HIS 44 HA HIS 44 0.552 -10.561 11.849 339 HB2 HIS 44 HB2 HIS 44 2.229 -8.715 12.504 340 HB3 HIS 44 HB3 HIS 44 0.893 -7.990 13.390 341 HD1 HIS 44 HD1 HIS 44 3.663 -10.108 13.908 342 HD2 HIS 44 HD2 HIS 44 -0.260 -10.117 15.269 343 HE1 HIS 44 HE1 HIS 44 3.682 -11.494 15.997 344 HE2 HIS 44 HE2 HIS 44 1.277 -11.600 16.728 345 H GLU 45 H GLU 45 -1.184 -7.460 12.190 346 HA GLU 45 HA GLU 45 -3.087 -8.526 14.025 347 HB2 GLU 45 HB2 GLU 45 -4.211 -6.406 13.871 348 HB3 GLU 45 HB3 GLU 45 -2.479 -6.113 13.911 349 HG2 GLU 45 HG2 GLU 45 -2.626 -5.999 11.355 350 HG3 GLU 45 HG3 GLU 45 -4.365 -5.857 11.593 351 H PHE 46 H PHE 46 -2.922 -8.299 10.554 352 HA PHE 46 HA PHE 46 -5.701 -8.869 10.115 353 HB2 PHE 46 HB2 PHE 46 -3.269 -8.764 8.355 354 HB3 PHE 46 HB3 PHE 46 -4.782 -9.420 7.745 355 HD1 PHE 46 HD2 PHE 46 -5.124 -6.783 10.163 356 HD2 PHE 46 HD1 PHE 46 -4.602 -7.616 6.029 357 HE1 PHE 46 HE2 PHE 46 -5.893 -4.516 9.619 358 HE2 PHE 46 HE1 PHE 46 -5.371 -5.346 5.473 359 HZ PHE 46 HZ PHE 46 -6.017 -3.793 7.271 360 H SER 47 H SER 47 -2.880 -10.749 10.736 361 HA SER 47 HA SER 47 -3.575 -13.173 9.529 362 HB2 SER 47 HB2 SER 47 -1.997 -12.664 12.058 363 HB3 SER 47 HB3 SER 47 -2.065 -14.212 11.216 364 HG SER 47 HG SER 47 -1.260 -11.824 9.916 365 H GLU 48 H GLU 48 -4.654 -11.708 12.511 366 HA GLU 48 HA GLU 48 -5.829 -14.045 13.628 367 HB2 GLU 48 HB2 GLU 48 -5.164 -11.764 14.740 368 HB3 GLU 48 HB3 GLU 48 -6.796 -11.289 14.282 369 HG2 GLU 48 HG2 GLU 48 -7.716 -13.137 15.550 370 HG3 GLU 48 HG3 GLU 48 -6.093 -13.672 15.980 371 H LYS 49 H LYS 49 -6.841 -11.823 11.189 372 HA LYS 49 HA LYS 49 -9.655 -12.173 11.480 373 HB2 LYS 49 HB2 LYS 49 -7.974 -11.262 9.141 374 HB3 LYS 49 HB3 LYS 49 -9.727 -11.345 9.083 375 HG2 LYS 49 HG2 LYS 49 -8.183 -9.688 11.062 376 HG3 LYS 49 HG3 LYS 49 -8.796 -9.082 9.526 377 HD2 LYS 49 HD2 LYS 49 -10.462 -10.209 11.777 378 HD3 LYS 49 HD3 LYS 49 -10.283 -8.507 11.379 379 HE2 LYS 49 HE2 LYS 49 -12.126 -8.772 10.142 380 HE3 LYS 49 HE3 LYS 49 -11.082 -9.592 8.985 381 HZ1 LYS 49 HZ1 LYS 49 -11.773 -11.668 9.726 382 HZ2 LYS 49 HZ2 LYS 49 -13.203 -10.772 9.757 383 HZ3 LYS 49 HZ3 LYS 49 -12.366 -11.078 11.195 384 H GLN 50 H GLN 50 -7.161 -13.781 9.586 385 HA GLN 50 HA GLN 50 -7.130 -15.693 8.365 386 HB2 GLN 50 HB2 GLN 50 -9.455 -16.450 10.146 387 HB3 GLN 50 HB3 GLN 50 -8.487 -17.566 9.193 388 HG2 GLN 50 HG2 GLN 50 -6.662 -17.382 10.582 389 HG3 GLN 50 HG3 GLN 50 -7.165 -15.814 11.213 390 HE21 GLN 50 HE21 GLN 50 -8.632 -15.718 12.889 391 HE22 GLN 50 HE22 GLN 50 -9.104 -17.113 13.798 392 HA PRO 51 HA PRO 51 -10.564 -14.034 5.646 393 HB2 PRO 51 HB2 PRO 51 -8.945 -14.301 3.386 394 HB3 PRO 51 HB3 PRO 51 -9.228 -12.808 4.282 395 HG2 PRO 51 HG2 PRO 51 -6.910 -14.667 4.378 396 HG3 PRO 51 HG3 PRO 51 -6.959 -12.911 4.600 397 HD2 PRO 51 HD2 PRO 51 -6.672 -14.644 6.660 398 HD3 PRO 51 HD3 PRO 51 -7.497 -13.083 6.829 399 H MET 52 H MET 52 -8.210 -16.395 4.372 400 HA MET 52 HA MET 52 -10.415 -18.321 4.022 401 HB2 MET 52 HB2 MET 52 -8.111 -18.044 2.089 402 HB3 MET 52 HB3 MET 52 -9.571 -18.997 1.889 403 HG2 MET 52 HG2 MET 52 -9.487 -15.994 1.973 404 HG3 MET 52 HG3 MET 52 -9.506 -16.961 0.503 405 HE1 MET 52 HE1 MET 52 -13.091 -15.420 0.531 406 HE2 MET 52 HE2 MET 52 -11.622 -15.672 -0.413 407 HE3 MET 52 HE3 MET 52 -11.582 -14.652 1.026 408 H LEU 53 H LEU 53 -8.096 -17.821 5.960 409 HA LEU 53 HA LEU 53 -6.537 -18.960 7.141 410 HB2 LEU 53 HB2 LEU 53 -8.251 -21.186 6.080 411 HB3 LEU 53 HB3 LEU 53 -6.852 -21.524 7.084 412 HG LEU 53 HG LEU 53 -8.973 -19.617 8.011 413 HD11 LEU 53 HD11 LEU 53 -8.984 -22.604 8.383 414 HD12 LEU 53 HD12 LEU 53 -10.110 -21.681 7.392 415 HD13 LEU 53 HD13 LEU 53 -10.087 -21.455 9.139 416 HD21 LEU 53 HD21 LEU 53 -8.178 -20.344 10.219 417 HD22 LEU 53 HD22 LEU 53 -6.890 -19.632 9.249 418 HD23 LEU 53 HD23 LEU 53 -6.988 -21.384 9.438 419 H ASP 54 H ASP 54 -5.954 -18.182 4.458 420 HA ASP 54 HA ASP 54 -3.884 -20.145 3.755 421 HB2 ASP 54 HB2 ASP 54 -5.518 -20.233 2.026 422 HB3 ASP 54 HB3 ASP 54 -5.687 -18.484 2.000 423 H VAL 55 H VAL 55 -1.850 -19.349 3.465 424 HA VAL 55 HA VAL 55 -1.184 -16.905 4.657 425 HB VAL 55 HB VAL 55 0.658 -18.375 2.783 426 HG11 VAL 55 HG11 VAL 55 1.108 -16.672 5.229 427 HG12 VAL 55 HG12 VAL 55 1.505 -16.258 3.561 428 HG13 VAL 55 HG13 VAL 55 2.371 -17.560 4.377 429 HG21 VAL 55 HG21 VAL 55 1.357 -19.719 4.723 430 HG22 VAL 55 HG22 VAL 55 -0.316 -20.032 4.263 431 HG23 VAL 55 HG23 VAL 55 0.038 -19.021 5.664 432 HA PRO 56 HA PRO 56 -0.097 -15.145 0.225 433 HB2 PRO 56 HB2 PRO 56 -1.765 -16.314 -1.711 434 HB3 PRO 56 HB3 PRO 56 -0.018 -16.500 -1.570 435 HG2 PRO 56 HG2 PRO 56 -2.187 -18.320 -0.712 436 HG3 PRO 56 HG3 PRO 56 -0.534 -18.696 -1.225 437 HD2 PRO 56 HD2 PRO 56 -1.329 -18.820 1.361 438 HD3 PRO 56 HD3 PRO 56 0.323 -18.385 0.883 439 H LYS 57 H LYS 57 -3.365 -16.445 0.746 440 HA LYS 57 HA LYS 57 -4.753 -14.227 -0.306 441 HB2 LYS 57 HB2 LYS 57 -5.457 -16.656 1.047 442 HB3 LYS 57 HB3 LYS 57 -6.335 -15.320 1.772 443 HG2 LYS 57 HG2 LYS 57 -7.711 -16.176 0.068 444 HG3 LYS 57 HG3 LYS 57 -7.041 -14.672 -0.557 445 HD2 LYS 57 HD2 LYS 57 -6.651 -15.994 -2.366 446 HD3 LYS 57 HD3 LYS 57 -5.174 -16.338 -1.463 447 HE2 LYS 57 HE2 LYS 57 -6.878 -18.164 -0.402 448 HE3 LYS 57 HE3 LYS 57 -7.477 -18.067 -2.058 449 HZ1 LYS 57 HZ1 LYS 57 -5.802 -19.763 -1.898 450 HZ2 LYS 57 HZ2 LYS 57 -4.694 -18.679 -1.215 451 HZ3 LYS 57 HZ3 LYS 57 -5.193 -18.483 -2.825 452 H LEU 58 H LEU 58 -3.258 -14.769 2.780 453 HA LEU 58 HA LEU 58 -4.604 -12.618 4.116 454 HB2 LEU 58 HB2 LEU 58 -3.672 -14.650 5.252 455 HB3 LEU 58 HB3 LEU 58 -2.065 -14.081 4.869 456 HG LEU 58 HG LEU 58 -2.916 -13.744 7.252 457 HD11 LEU 58 HD11 LEU 58 -1.869 -11.357 5.746 458 HD12 LEU 58 HD12 LEU 58 -0.908 -12.668 6.431 459 HD13 LEU 58 HD13 LEU 58 -1.808 -11.587 7.495 460 HD21 LEU 58 HD21 LEU 58 -5.154 -12.873 6.504 461 HD22 LEU 58 HD22 LEU 58 -4.332 -11.367 6.074 462 HD23 LEU 58 HD23 LEU 58 -4.333 -11.929 7.744 463 H ALA 59 H ALA 59 -1.405 -13.139 2.699 464 HA ALA 59 HA ALA 59 -0.269 -10.669 3.345 465 HB1 ALA 59 HB1 ALA 59 0.292 -12.464 0.992 466 HB2 ALA 59 HB2 ALA 59 1.075 -12.519 2.571 467 HB3 ALA 59 HB3 ALA 59 1.316 -11.127 1.514 468 H VAL 60 H VAL 60 -2.016 -11.648 0.387 469 HA VAL 60 HA VAL 60 -1.775 -9.099 -0.848 470 HB VAL 60 HB VAL 60 -2.243 -11.198 -2.113 471 HG11 VAL 60 HG11 VAL 60 -4.527 -12.019 -2.272 472 HG12 VAL 60 HG12 VAL 60 -5.040 -10.856 -1.050 473 HG13 VAL 60 HG13 VAL 60 -3.927 -12.150 -0.620 474 HG21 VAL 60 HG21 VAL 60 -2.564 -9.015 -3.148 475 HG22 VAL 60 HG22 VAL 60 -4.216 -8.955 -2.532 476 HG23 VAL 60 HG23 VAL 60 -3.766 -10.167 -3.729 477 H LEU 61 H LEU 61 -4.054 -10.449 1.427 478 HA LEU 61 HA LEU 61 -6.150 -8.600 1.104 479 HB2 LEU 61 HB2 LEU 61 -6.429 -10.649 2.385 480 HB3 LEU 61 HB3 LEU 61 -5.230 -10.119 3.549 481 HG LEU 61 HG LEU 61 -6.773 -8.201 4.113 482 HD11 LEU 61 HD11 LEU 61 -8.150 -8.181 2.138 483 HD12 LEU 61 HD12 LEU 61 -9.156 -8.532 3.542 484 HD13 LEU 61 HD13 LEU 61 -8.685 -9.833 2.449 485 HD21 LEU 61 HD21 LEU 61 -7.876 -10.964 4.591 486 HD22 LEU 61 HD22 LEU 61 -8.141 -9.531 5.584 487 HD23 LEU 61 HD23 LEU 61 -6.534 -10.250 5.481 488 H THR 62 H THR 62 -3.172 -8.545 2.939 489 HA THR 62 HA THR 62 -3.717 -6.093 4.291 490 HB THR 62 HB THR 62 -0.979 -7.262 3.788 491 HG1 THR 62 HG1 THR 62 -2.395 -8.885 4.649 492 HG21 THR 62 HG21 THR 62 -2.086 -5.683 6.109 493 HG22 THR 62 HG22 THR 62 -1.106 -5.014 4.807 494 HG23 THR 62 HG23 THR 62 -0.417 -6.214 5.902 495 H ALA 63 H ALA 63 -2.092 -7.037 1.330 496 HA ALA 63 HA ALA 63 -0.807 -4.650 0.676 497 HB1 ALA 63 HB1 ALA 63 -0.634 -5.501 -1.542 498 HB2 ALA 63 HB2 ALA 63 -2.021 -6.565 -1.306 499 HB3 ALA 63 HB3 ALA 63 -0.515 -6.876 -0.444 500 H VAL 64 H VAL 64 -4.038 -5.789 -0.276 501 HA VAL 64 HA VAL 64 -4.650 -3.446 -1.743 502 HB VAL 64 HB VAL 64 -5.770 -5.620 -2.126 503 HG11 VAL 64 HG11 VAL 64 -7.141 -4.999 0.481 504 HG12 VAL 64 HG12 VAL 64 -6.162 -6.412 0.089 505 HG13 VAL 64 HG13 VAL 64 -7.728 -6.183 -0.688 506 HG21 VAL 64 HG21 VAL 64 -6.754 -3.668 -3.081 507 HG22 VAL 64 HG22 VAL 64 -7.529 -3.246 -1.556 508 HG23 VAL 64 HG23 VAL 64 -8.052 -4.676 -2.443 509 H GLN 65 H GLN 65 -5.151 -4.358 1.611 510 HA GLN 65 HA GLN 65 -6.945 -2.272 2.257 511 HB2 GLN 65 HB2 GLN 65 -6.138 -4.425 3.604 512 HB3 GLN 65 HB3 GLN 65 -5.022 -3.260 4.310 513 HG2 GLN 65 HG2 GLN 65 -7.952 -2.643 4.197 514 HG3 GLN 65 HG3 GLN 65 -7.316 -3.697 5.461 515 HE21 GLN 65 HE21 GLN 65 -8.507 -0.968 5.528 516 HE22 GLN 65 HE22 GLN 65 -7.341 0.028 6.338 517 H ILE 66 H ILE 66 -3.419 -2.552 2.469 518 HA ILE 66 HA ILE 66 -2.876 -0.042 3.579 519 HB ILE 66 HB ILE 66 -1.246 -1.796 1.739 520 HG12 ILE 66 HG12 ILE 66 -0.790 -1.137 4.650 521 HG13 ILE 66 HG13 ILE 66 -1.799 -2.483 4.134 522 HG21 ILE 66 HG21 ILE 66 0.696 -0.401 2.224 523 HG22 ILE 66 HG22 ILE 66 -0.321 0.713 3.135 524 HG23 ILE 66 HG23 ILE 66 -0.553 0.527 1.399 525 HD11 ILE 66 HD11 ILE 66 0.349 -3.336 4.655 526 HD12 ILE 66 HD12 ILE 66 1.147 -2.118 3.664 527 HD13 ILE 66 HD13 ILE 66 0.180 -3.379 2.901 528 H ALA 67 H ALA 67 -3.327 -1.062 0.231 529 HA ALA 67 HA ALA 67 -2.594 1.309 -1.051 530 HB1 ALA 67 HB1 ALA 67 -2.931 -0.785 -2.249 531 HB2 ALA 67 HB2 ALA 67 -3.925 0.500 -2.939 532 HB3 ALA 67 HB3 ALA 67 -4.657 -0.719 -1.896 533 H SER 68 H SER 68 -5.842 0.220 0.005 534 HA SER 68 HA SER 68 -7.199 2.550 -0.814 535 HB2 SER 68 HB2 SER 68 -8.774 1.679 1.200 536 HB3 SER 68 HB3 SER 68 -8.744 0.928 -0.394 537 HG SER 68 HG SER 68 -7.067 0.109 1.743 538 H GLU 69 H GLU 69 -5.532 1.744 2.177 539 HA GLU 69 HA GLU 69 -6.492 3.831 3.783 540 HB2 GLU 69 HB2 GLU 69 -3.936 2.246 3.826 541 HB3 GLU 69 HB3 GLU 69 -4.270 3.496 5.014 542 HG2 GLU 69 HG2 GLU 69 -6.089 1.157 4.514 543 HG3 GLU 69 HG3 GLU 69 -4.806 1.157 5.721 544 H TYR 70 H TYR 70 -3.761 3.719 1.531 545 HA TYR 70 HA TYR 70 -3.102 6.477 2.202 546 HB2 TYR 70 HB2 TYR 70 -1.719 4.409 0.509 547 HB3 TYR 70 HB3 TYR 70 -1.202 6.090 0.556 548 HD1 TYR 70 HD1 TYR 70 -0.445 7.068 2.751 549 HD2 TYR 70 HD2 TYR 70 -1.126 2.904 2.238 550 HE1 TYR 70 HE1 TYR 70 0.868 6.608 4.778 551 HE2 TYR 70 HE2 TYR 70 0.183 2.435 4.265 552 HH TYR 70 HH TYR 70 1.045 4.809 6.486 553 H LEU 71 H LEU 71 -4.710 4.687 -0.318 554 HA LEU 71 HA LEU 71 -4.459 6.591 -2.381 555 HB2 LEU 71 HB2 LEU 71 -6.227 4.289 -1.842 556 HB3 LEU 71 HB3 LEU 71 -6.881 5.500 -2.927 557 HG LEU 71 HG LEU 71 -4.174 4.228 -3.363 558 HD11 LEU 71 HD11 LEU 71 -5.254 2.782 -5.029 559 HD12 LEU 71 HD12 LEU 71 -6.831 3.355 -4.492 560 HD13 LEU 71 HD13 LEU 71 -5.805 2.433 -3.391 561 HD21 LEU 71 HD21 LEU 71 -6.033 5.780 -5.165 562 HD22 LEU 71 HD22 LEU 71 -4.574 4.953 -5.700 563 HD23 LEU 71 HD23 LEU 71 -4.456 6.295 -4.568 564 H LYS 72 H LYS 72 -6.831 6.219 0.203 565 HA LYS 72 HA LYS 72 -8.416 8.436 -0.669 566 HB2 LYS 72 HB2 LYS 72 -9.675 8.134 1.357 567 HB3 LYS 72 HB3 LYS 72 -9.327 6.556 0.671 568 HG2 LYS 72 HG2 LYS 72 -7.340 6.509 2.304 569 HG3 LYS 72 HG3 LYS 72 -8.166 7.837 3.119 570 HD2 LYS 72 HD2 LYS 72 -10.197 6.382 3.239 571 HD3 LYS 72 HD3 LYS 72 -9.211 5.054 2.629 572 HE2 LYS 72 HE2 LYS 72 -9.186 4.764 4.942 573 HE3 LYS 72 HE3 LYS 72 -7.651 5.559 4.590 574 HZ1 LYS 72 HZ1 LYS 72 -8.539 7.633 5.325 575 HZ2 LYS 72 HZ2 LYS 72 -8.857 6.486 6.524 576 HZ3 LYS 72 HZ3 LYS 72 -10.092 6.985 5.485 577 H LEU 73 H LEU 73 -5.426 8.253 0.749 578 HA LEU 73 HA LEU 73 -5.702 10.722 2.280 579 HB2 LEU 73 HB2 LEU 73 -4.474 8.861 3.299 580 HB3 LEU 73 HB3 LEU 73 -3.356 8.848 1.951 581 HG LEU 73 HG LEU 73 -2.514 11.049 2.592 582 HD11 LEU 73 HD11 LEU 73 -4.595 10.860 4.755 583 HD12 LEU 73 HD12 LEU 73 -4.403 12.121 3.533 584 HD13 LEU 73 HD13 LEU 73 -3.221 11.963 4.830 585 HD21 LEU 73 HD21 LEU 73 -1.469 10.417 4.731 586 HD22 LEU 73 HD22 LEU 73 -1.420 9.121 3.536 587 HD23 LEU 73 HD23 LEU 73 -2.589 9.059 4.853 588 H LYS 74 H LYS 74 -3.923 9.386 -0.494 589 HA LYS 74 HA LYS 74 -2.586 11.833 -1.096 590 HB2 LYS 74 HB2 LYS 74 -1.901 10.780 -3.167 591 HB3 LYS 74 HB3 LYS 74 -1.738 9.634 -1.848 592 HG2 LYS 74 HG2 LYS 74 -3.109 8.193 -2.810 593 HG3 LYS 74 HG3 LYS 74 -4.330 9.427 -3.115 594 HD2 LYS 74 HD2 LYS 74 -1.867 9.007 -4.811 595 HD3 LYS 74 HD3 LYS 74 -3.447 8.311 -5.171 596 HE2 LYS 74 HE2 LYS 74 -3.543 11.182 -4.669 597 HE3 LYS 74 HE3 LYS 74 -2.522 10.754 -6.040 598 HZ1 LYS 74 HZ1 LYS 74 -4.346 9.635 -7.061 599 HZ2 LYS 74 HZ2 LYS 74 -4.870 11.176 -6.616 600 HZ3 LYS 74 HZ3 LYS 74 -5.332 9.835 -5.692 601 H GLU 75 H GLU 75 -5.699 10.532 -1.803 602 HA GLU 75 HA GLU 75 -6.330 12.145 -4.054 603 HB2 GLU 75 HB2 GLU 75 -7.556 10.042 -2.870 604 HB3 GLU 75 HB3 GLU 75 -8.520 11.360 -2.212 605 HG2 GLU 75 HG2 GLU 75 -9.665 10.746 -4.123 606 HG3 GLU 75 HG3 GLU 75 -8.731 12.150 -4.634 607 H GLU 76 H GLU 76 -6.510 12.547 -0.600 608 HA GLU 76 HA GLU 76 -8.097 14.871 -0.507 609 HB2 GLU 76 HB2 GLU 76 -7.293 13.272 1.399 610 HB3 GLU 76 HB3 GLU 76 -5.908 14.352 1.480 611 HG2 GLU 76 HG2 GLU 76 -7.611 14.949 3.112 612 HG3 GLU 76 HG3 GLU 76 -7.378 16.233 1.926 613 H TYR 77 H TYR 77 -4.744 14.332 -1.221 614 HA TYR 77 HA TYR 77 -3.760 16.939 -0.818 615 HB2 TYR 77 HB2 TYR 77 -2.290 14.999 -1.111 616 HB3 TYR 77 HB3 TYR 77 -2.871 14.788 -2.756 617 HD1 TYR 77 HD1 TYR 77 -1.844 17.956 -1.066 618 HD2 TYR 77 HD2 TYR 77 -0.941 15.050 -4.043 619 HE1 TYR 77 HE1 TYR 77 -0.009 19.367 -1.871 620 HE2 TYR 77 HE2 TYR 77 0.897 16.460 -4.864 621 HH TYR 77 HH TYR 77 2.186 18.989 -3.163 622 H GLN 78 H GLN 78 -5.246 15.346 -3.597 623 HA GLN 78 HA GLN 78 -4.948 17.568 -5.361 624 HB2 GLN 78 HB2 GLN 78 -6.756 15.150 -5.478 625 HB3 GLN 78 HB3 GLN 78 -6.585 16.321 -6.778 626 HG2 GLN 78 HG2 GLN 78 -4.345 15.709 -7.171 627 HG3 GLN 78 HG3 GLN 78 -4.251 14.796 -5.666 628 HE21 GLN 78 HE21 GLN 78 -5.384 14.814 -8.945 629 HE22 GLN 78 HE22 GLN 78 -5.765 13.131 -9.036 630 H ARG 79 H ARG 79 -7.393 16.506 -3.098 631 HA ARG 79 HA ARG 79 -9.445 18.264 -4.038 632 HB2 ARG 79 HB2 ARG 79 -9.164 16.855 -1.373 633 HB3 ARG 79 HB3 ARG 79 -10.613 17.667 -1.944 634 HG2 ARG 79 HG2 ARG 79 -10.468 16.055 -3.942 635 HG3 ARG 79 HG3 ARG 79 -9.379 15.124 -2.915 636 HD2 ARG 79 HD2 ARG 79 -12.107 15.995 -2.008 637 HD3 ARG 79 HD3 ARG 79 -11.843 14.492 -2.883 638 HE ARG 79 HE ARG 79 -10.584 15.101 -0.272 639 HH11 ARG 79 HH11 ARG 79 -12.142 12.871 -2.503 640 HH12 ARG 79 HH12 ARG 79 -12.071 11.517 -1.410 641 HH21 ARG 79 HH21 ARG 79 -10.522 13.336 1.179 642 HH22 ARG 79 HH22 ARG 79 -11.154 11.790 0.682 643 H LEU 80 H LEU 80 -6.919 18.404 -1.643 644 HA LEU 80 HA LEU 80 -7.782 20.787 -0.367 645 HB2 LEU 80 HB2 LEU 80 -6.291 19.257 0.739 646 HB3 LEU 80 HB3 LEU 80 -5.097 19.437 -0.532 647 HG LEU 80 HG LEU 80 -5.202 21.985 0.219 648 HD11 LEU 80 HD11 LEU 80 -5.691 22.340 2.477 649 HD12 LEU 80 HD12 LEU 80 -5.741 20.613 2.828 650 HD13 LEU 80 HD13 LEU 80 -7.023 21.354 1.874 651 HD21 LEU 80 HD21 LEU 80 -3.202 20.571 0.215 652 HD22 LEU 80 HD22 LEU 80 -3.698 19.871 1.759 653 HD23 LEU 80 HD23 LEU 80 -3.285 21.582 1.657 654 H ARG 81 H ARG 81 -5.316 20.147 -2.858 655 HA ARG 81 HA ARG 81 -4.433 22.796 -3.126 656 HB2 ARG 81 HB2 ARG 81 -4.441 20.616 -5.213 657 HB3 ARG 81 HB3 ARG 81 -3.504 22.101 -5.290 658 HG2 ARG 81 HG2 ARG 81 -2.490 21.302 -3.048 659 HG3 ARG 81 HG3 ARG 81 -3.136 19.728 -3.514 660 HD2 ARG 81 HD2 ARG 81 -0.887 19.820 -4.290 661 HD3 ARG 81 HD3 ARG 81 -1.939 19.967 -5.695 662 HE ARG 81 HE ARG 81 -0.675 22.311 -4.423 663 HH11 ARG 81 HH11 ARG 81 -1.481 20.443 -7.276 664 HH12 ARG 81 HH12 ARG 81 -0.799 21.592 -8.377 665 HH21 ARG 81 HH21 ARG 81 0.230 23.825 -5.883 666 HH22 ARG 81 HH22 ARG 81 0.160 23.516 -7.589 667 H GLU 82 H GLU 82 -6.970 21.037 -4.889 668 HA GLU 82 HA GLU 82 -7.508 23.146 -6.697 669 HB2 GLU 82 HB2 GLU 82 -9.379 21.891 -7.422 670 HB3 GLU 82 HB3 GLU 82 -8.124 20.729 -7.015 671 HG2 GLU 82 HG2 GLU 82 -9.229 20.370 -4.832 672 HG3 GLU 82 HG3 GLU 82 -10.525 21.445 -5.356 673 H GLN 83 H GLN 83 -8.507 22.533 -3.439 674 HA GLN 83 HA GLN 83 -10.707 24.428 -3.555 675 HB2 GLN 83 HB2 GLN 83 -10.520 22.231 -2.135 676 HB3 GLN 83 HB3 GLN 83 -9.636 23.257 -1.014 677 HG2 GLN 83 HG2 GLN 83 -11.600 24.793 -0.984 678 HG3 GLN 83 HG3 GLN 83 -12.473 23.601 -1.948 679 HE21 GLN 83 HE21 GLN 83 -13.070 21.644 -1.011 680 HE22 GLN 83 HE22 GLN 83 -13.056 21.402 0.705 681 H LEU 84 H LEU 84 -7.385 24.574 -3.147 682 HA LEU 84 HA LEU 84 -7.510 26.947 -1.430 683 HB2 LEU 84 HB2 LEU 84 -5.918 25.082 -0.912 684 HB3 LEU 84 HB3 LEU 84 -5.081 25.454 -2.407 685 HG LEU 84 HG LEU 84 -4.713 27.800 -1.473 686 HD11 LEU 84 HD11 LEU 84 -6.388 27.761 0.287 687 HD12 LEU 84 HD12 LEU 84 -4.783 28.035 0.962 688 HD13 LEU 84 HD13 LEU 84 -5.534 26.447 1.096 689 HD21 LEU 84 HD21 LEU 84 -2.843 26.340 -1.569 690 HD22 LEU 84 HD22 LEU 84 -3.422 25.394 -0.196 691 HD23 LEU 84 HD23 LEU 84 -2.852 27.042 0.049 692 H LYS 85 H LYS 85 -6.568 25.906 -4.655 693 HA LYS 85 HA LYS 85 -5.325 28.340 -5.428 694 HB2 LYS 85 HB2 LYS 85 -5.363 27.463 -7.671 695 HB3 LYS 85 HB3 LYS 85 -4.962 26.155 -6.564 696 HG2 LYS 85 HG2 LYS 85 -7.200 25.286 -6.702 697 HG3 LYS 85 HG3 LYS 85 -7.715 26.658 -7.680 698 HD2 LYS 85 HD2 LYS 85 -6.236 25.964 -9.474 699 HD3 LYS 85 HD3 LYS 85 -5.635 24.626 -8.490 700 HE2 LYS 85 HE2 LYS 85 -7.556 23.407 -8.731 701 HE3 LYS 85 HE3 LYS 85 -8.565 24.837 -8.933 702 HZ1 LYS 85 HZ1 LYS 85 -6.669 23.810 -10.968 703 HZ2 LYS 85 HZ2 LYS 85 -7.747 25.099 -11.159 704 HZ3 LYS 85 HZ3 LYS 85 -8.334 23.525 -10.973 705 H LYS 86 H LYS 86 -8.604 27.470 -5.059 706 HA LYS 86 HA LYS 86 -9.469 29.676 -6.792 707 HB2 LYS 86 HB2 LYS 86 -10.401 27.346 -7.154 708 HB3 LYS 86 HB3 LYS 86 -11.196 27.503 -5.597 709 HG2 LYS 86 HG2 LYS 86 -11.665 29.682 -7.531 710 HG3 LYS 86 HG3 LYS 86 -12.373 28.113 -7.916 711 HD2 LYS 86 HD2 LYS 86 -13.541 28.067 -5.816 712 HD3 LYS 86 HD3 LYS 86 -12.723 29.536 -5.285 713 HE2 LYS 86 HE2 LYS 86 -13.782 30.770 -7.129 714 HE3 LYS 86 HE3 LYS 86 -14.644 29.305 -7.592 715 HZ1 LYS 86 HZ1 LYS 86 -15.848 30.981 -6.136 716 HZ2 LYS 86 HZ2 LYS 86 -14.874 30.422 -4.872 717 HZ3 LYS 86 HZ3 LYS 86 -15.916 29.358 -5.667 718 H1 GLY 1 H1 GLY 1 -37.655 -7.130 15.307 719 H2 GLY 1 H2 GLY 1 -39.319 -7.336 15.091 720 H3 GLY 1 H3 GLY 1 -38.632 -5.799 14.939 721 HA2 GLY 1 HA3 GLY 1 -38.133 -8.110 13.150 722 HA3 GLY 1 HA2 GLY 1 -39.132 -6.716 12.766 723 H SER 2 H SER 2 -38.011 -5.818 11.116 724 HA SER 2 HA SER 2 -35.213 -5.690 10.909 725 HB2 SER 2 HB2 SER 2 -36.251 -3.577 9.398 726 HB3 SER 2 HB3 SER 2 -35.934 -5.219 8.834 727 HG SER 2 HG SER 2 -38.255 -4.031 8.960 728 H HIS 3 H HIS 3 -33.858 -4.556 12.125 729 HA HIS 3 HA HIS 3 -34.779 -2.220 13.587 730 HB2 HIS 3 HB2 HIS 3 -32.318 -3.933 13.685 731 HB3 HIS 3 HB3 HIS 3 -32.312 -2.343 14.436 732 HD1 HIS 3 HD1 HIS 3 -35.600 -3.883 14.757 733 HD2 HIS 3 HD2 HIS 3 -31.989 -4.021 16.821 734 HE1 HIS 3 HE1 HIS 3 -36.145 -4.839 17.018 735 HE2 HIS 3 HE2 HIS 3 -33.934 -5.022 18.203 736 H MET 4 H MET 4 -33.414 -0.250 13.613 737 HA MET 4 HA MET 4 -32.103 0.226 11.022 738 HB2 MET 4 HB2 MET 4 -33.998 2.099 12.458 739 HB3 MET 4 HB3 MET 4 -33.079 2.504 11.015 740 HG2 MET 4 HG2 MET 4 -34.286 0.910 9.710 741 HG3 MET 4 HG3 MET 4 -35.089 0.271 11.145 742 HE1 MET 4 HE1 MET 4 -36.703 0.991 8.611 743 HE2 MET 4 HE2 MET 4 -38.043 1.953 9.232 744 HE3 MET 4 HE3 MET 4 -37.513 0.508 10.096 745 H THR 5 H THR 5 -30.054 0.757 11.347 746 HA THR 5 HA THR 5 -29.333 2.224 13.802 747 HB THR 5 HB THR 5 -27.245 0.700 12.344 748 HG1 THR 5 HG1 THR 5 -29.369 -0.527 13.798 749 HG21 THR 5 HG21 THR 5 -26.871 1.990 14.468 750 HG22 THR 5 HG22 THR 5 -26.393 0.296 14.543 751 HG23 THR 5 HG23 THR 5 -27.901 0.818 15.287 752 H GLU 6 H GLU 6 -26.985 3.242 13.364 753 HA GLU 6 HA GLU 6 -27.350 5.236 11.376 754 HB2 GLU 6 HB2 GLU 6 -24.772 4.605 12.817 755 HB3 GLU 6 HB3 GLU 6 -25.270 6.145 12.131 756 HG2 GLU 6 HG2 GLU 6 -27.160 6.101 13.838 757 HG3 GLU 6 HG3 GLU 6 -26.269 4.794 14.618 758 H GLN 7 H GLN 7 -25.118 5.690 10.042 759 HA GLN 7 HA GLN 7 -24.819 3.304 8.363 760 HB2 GLN 7 HB2 GLN 7 -23.839 5.066 6.732 761 HB3 GLN 7 HB3 GLN 7 -25.577 5.026 6.993 762 HG2 GLN 7 HG2 GLN 7 -25.540 6.947 8.317 763 HG3 GLN 7 HG3 GLN 7 -23.798 6.844 8.566 764 HE21 GLN 7 HE21 GLN 7 -23.408 8.897 7.846 765 HE22 GLN 7 HE22 GLN 7 -23.559 9.360 6.188 766 HA PRO 8 HA PRO 8 -20.680 3.376 10.207 767 HB2 PRO 8 HB2 PRO 8 -20.266 0.732 10.167 768 HB3 PRO 8 HB3 PRO 8 -21.354 1.466 11.348 769 HG2 PRO 8 HG2 PRO 8 -22.001 0.005 8.827 770 HG3 PRO 8 HG3 PRO 8 -22.816 -0.056 10.399 771 HD2 PRO 8 HD2 PRO 8 -23.658 1.446 8.223 772 HD3 PRO 8 HD3 PRO 8 -24.126 1.741 9.907 773 H LYS 9 H LYS 9 -18.638 1.977 9.379 774 HA LYS 9 HA LYS 9 -18.103 2.872 6.759 775 HB2 LYS 9 HB2 LYS 9 -16.604 0.758 8.317 776 HB3 LYS 9 HB3 LYS 9 -15.990 1.695 6.960 777 HG2 LYS 9 HG2 LYS 9 -16.721 3.683 8.630 778 HG3 LYS 9 HG3 LYS 9 -16.295 2.433 9.797 779 HD2 LYS 9 HD2 LYS 9 -14.091 2.218 8.793 780 HD3 LYS 9 HD3 LYS 9 -14.514 3.405 7.556 781 HE2 LYS 9 HE2 LYS 9 -14.421 3.935 10.526 782 HE3 LYS 9 HE3 LYS 9 -13.154 4.371 9.380 783 HZ1 LYS 9 HZ1 LYS 9 -14.624 6.233 9.902 784 HZ2 LYS 9 HZ2 LYS 9 -15.949 5.373 9.304 785 HZ3 LYS 9 HZ3 LYS 9 -14.699 5.829 8.263 786 H THR 10 H THR 10 -18.830 2.043 4.917 787 HA THR 10 HA THR 10 -20.228 -0.408 4.789 788 HB THR 10 HB THR 10 -20.677 1.593 3.347 789 HG1 THR 10 HG1 THR 10 -21.717 0.127 2.263 790 HG21 THR 10 HG21 THR 10 -18.391 2.140 2.711 791 HG22 THR 10 HG22 THR 10 -19.377 1.842 1.279 792 HG23 THR 10 HG23 THR 10 -18.251 0.608 1.846 793 H ARG 11 H ARG 11 -19.760 -2.301 3.674 794 HA ARG 11 HA ARG 11 -16.890 -2.863 3.394 795 HB2 ARG 11 HB2 ARG 11 -17.368 -5.164 3.852 796 HB3 ARG 11 HB3 ARG 11 -18.196 -4.210 5.073 797 HG2 ARG 11 HG2 ARG 11 -20.299 -4.468 3.835 798 HG3 ARG 11 HG3 ARG 11 -19.461 -5.450 2.633 799 HD2 ARG 11 HD2 ARG 11 -20.068 -7.196 3.898 800 HD3 ARG 11 HD3 ARG 11 -18.773 -6.684 4.976 801 HE ARG 11 HE ARG 11 -21.627 -6.009 5.312 802 HH11 ARG 11 HH11 ARG 11 -18.418 -6.485 6.662 803 HH12 ARG 11 HH12 ARG 11 -18.951 -6.276 8.300 804 HH21 ARG 11 HH21 ARG 11 -22.305 -5.745 7.475 805 HH22 ARG 11 HH22 ARG 11 -21.141 -5.856 8.761 806 H VAL 12 H VAL 12 -16.116 -3.821 1.522 807 HA VAL 12 HA VAL 12 -18.056 -4.131 -0.672 808 HB VAL 12 HB VAL 12 -16.945 -1.988 -0.964 809 HG11 VAL 12 HG11 VAL 12 -14.410 -3.590 -0.748 810 HG12 VAL 12 HG12 VAL 12 -14.932 -2.234 0.250 811 HG13 VAL 12 HG13 VAL 12 -14.466 -1.966 -1.429 812 HG21 VAL 12 HG21 VAL 12 -16.061 -4.118 -2.901 813 HG22 VAL 12 HG22 VAL 12 -15.904 -2.389 -3.206 814 HG23 VAL 12 HG23 VAL 12 -17.500 -3.105 -2.992 815 H SER 13 H SER 13 -17.708 -5.799 -2.068 816 HA SER 13 HA SER 13 -15.572 -7.667 -1.339 817 HB2 SER 13 HB2 SER 13 -17.109 -9.124 -2.990 818 HB3 SER 13 HB3 SER 13 -17.465 -8.963 -1.270 819 HG SER 13 HG SER 13 -18.502 -7.175 -3.206 820 H VAL 14 H VAL 14 -13.823 -7.000 -2.466 821 HA VAL 14 HA VAL 14 -14.123 -6.397 -5.319 822 HB VAL 14 HB VAL 14 -11.765 -5.679 -5.250 823 HG11 VAL 14 HG11 VAL 14 -13.415 -4.344 -3.122 824 HG12 VAL 14 HG12 VAL 14 -13.624 -4.103 -4.856 825 HG13 VAL 14 HG13 VAL 14 -12.120 -3.617 -4.070 826 HG21 VAL 14 HG21 VAL 14 -11.300 -7.220 -3.203 827 HG22 VAL 14 HG22 VAL 14 -11.790 -5.806 -2.267 828 HG23 VAL 14 HG23 VAL 14 -10.425 -5.700 -3.376 829 H ARG 15 H ARG 15 -12.215 -7.219 -6.704 830 HA ARG 15 HA ARG 15 -11.631 -10.012 -5.987 831 HB2 ARG 15 HB2 ARG 15 -13.434 -9.499 -7.831 832 HB3 ARG 15 HB3 ARG 15 -12.024 -9.205 -8.841 833 HG2 ARG 15 HG2 ARG 15 -11.252 -11.440 -8.550 834 HG3 ARG 15 HG3 ARG 15 -12.454 -11.747 -7.296 835 HD2 ARG 15 HD2 ARG 15 -13.049 -11.172 -10.195 836 HD3 ARG 15 HD3 ARG 15 -13.094 -12.761 -9.433 837 HE ARG 15 HE ARG 15 -14.806 -11.313 -7.917 838 HH11 ARG 15 HH11 ARG 15 -14.525 -11.870 -11.348 839 HH12 ARG 15 HH12 ARG 15 -16.217 -11.669 -11.661 840 HH21 ARG 15 HH21 ARG 15 -17.064 -11.066 -8.307 841 HH22 ARG 15 HH22 ARG 15 -17.669 -11.229 -9.926 842 H ILE 16 H ILE 16 -9.510 -10.419 -5.930 843 HA ILE 16 HA ILE 16 -7.718 -8.857 -7.675 844 HB ILE 16 HB ILE 16 -6.991 -9.617 -4.847 845 HG12 ILE 16 HG12 ILE 16 -7.597 -6.798 -5.676 846 HG13 ILE 16 HG13 ILE 16 -8.913 -7.864 -5.190 847 HG21 ILE 16 HG21 ILE 16 -5.108 -9.326 -6.327 848 HG22 ILE 16 HG22 ILE 16 -5.186 -7.965 -5.206 849 HG23 ILE 16 HG23 ILE 16 -5.733 -7.770 -6.872 850 HD11 ILE 16 HD11 ILE 16 -6.530 -7.079 -3.537 851 HD12 ILE 16 HD12 ILE 16 -7.760 -8.241 -3.046 852 HD13 ILE 16 HD13 ILE 16 -8.198 -6.555 -3.317 853 H TYR 17 H TYR 17 -6.429 -10.108 -8.864 854 HA TYR 17 HA TYR 17 -5.257 -11.876 -9.646 855 HB2 TYR 17 HB2 TYR 17 -4.523 -11.741 -7.033 856 HB3 TYR 17 HB3 TYR 17 -5.165 -13.379 -7.102 857 HD1 TYR 17 HD1 TYR 17 -2.949 -11.182 -9.185 858 HD2 TYR 17 HD2 TYR 17 -3.616 -15.043 -7.514 859 HE1 TYR 17 HE1 TYR 17 -0.807 -11.953 -10.123 860 HE2 TYR 17 HE2 TYR 17 -1.478 -15.819 -8.449 861 HH TYR 17 HH TYR 17 0.874 -13.698 -9.713 862 H GLY 18 H GLY 18 -8.313 -12.006 -8.742 863 HA2 GLY 18 HA2 GLY 18 -9.725 -13.541 -10.036 864 HA3 GLY 18 HA3 GLY 18 -8.621 -14.822 -9.565 865 H GLN 19 H GLN 19 -8.416 -13.770 -6.813 866 HA GLN 19 HA GLN 19 -10.753 -15.136 -5.773 867 HB2 GLN 19 HB2 GLN 19 -8.181 -14.146 -4.592 868 HB3 GLN 19 HB3 GLN 19 -9.523 -14.581 -3.543 869 HG2 GLN 19 HG2 GLN 19 -8.426 -16.448 -5.617 870 HG3 GLN 19 HG3 GLN 19 -7.788 -16.363 -3.976 871 HE21 GLN 19 HE21 GLN 19 -10.363 -17.421 -5.990 872 HE22 GLN 19 HE22 GLN 19 -11.246 -18.283 -4.780 873 H ASP 20 H ASP 20 -12.091 -14.256 -4.092 874 HA ASP 20 HA ASP 20 -12.563 -11.394 -4.474 875 HB2 ASP 20 HB2 ASP 20 -14.778 -11.803 -3.519 876 HB3 ASP 20 HB3 ASP 20 -14.467 -12.902 -4.857 877 H TYR 21 H TYR 21 -12.524 -9.937 -2.834 878 HA TYR 21 HA TYR 21 -11.841 -10.930 -0.153 879 HB2 TYR 21 HB2 TYR 21 -10.473 -8.631 -1.565 880 HB3 TYR 21 HB3 TYR 21 -10.171 -9.144 0.094 881 HD1 TYR 21 HD1 TYR 21 -8.963 -11.213 0.553 882 HD2 TYR 21 HD2 TYR 21 -9.622 -9.899 -3.433 883 HE1 TYR 21 HE1 TYR 21 -7.281 -12.813 -0.247 884 HE2 TYR 21 HE2 TYR 21 -7.944 -11.500 -4.247 885 HH TYR 21 HH TYR 21 -6.097 -12.768 -3.493 886 H THR 22 H THR 22 -13.243 -10.179 1.295 887 HA THR 22 HA THR 22 -14.871 -7.852 0.681 888 HB THR 22 HB THR 22 -15.221 -9.168 3.292 889 HG1 THR 22 HG1 THR 22 -15.426 -11.147 2.560 890 HG21 THR 22 HG21 THR 22 -17.087 -8.578 0.987 891 HG22 THR 22 HG22 THR 22 -16.827 -7.549 2.397 892 HG23 THR 22 HG23 THR 22 -17.579 -9.134 2.587 893 H ILE 23 H ILE 23 -13.900 -5.966 1.115 894 HA ILE 23 HA ILE 23 -12.550 -5.684 3.723 895 HB ILE 23 HB ILE 23 -11.108 -3.936 2.637 896 HG12 ILE 23 HG12 ILE 23 -12.076 -5.196 0.059 897 HG13 ILE 23 HG13 ILE 23 -12.600 -3.619 0.644 898 HG21 ILE 23 HG21 ILE 23 -10.796 -6.703 1.481 899 HG22 ILE 23 HG22 ILE 23 -10.371 -6.258 3.132 900 HG23 ILE 23 HG23 ILE 23 -9.521 -5.520 1.775 901 HD11 ILE 23 HD11 ILE 23 -10.937 -3.206 -0.955 902 HD12 ILE 23 HD12 ILE 23 -9.881 -4.452 -0.296 903 HD13 ILE 23 HD13 ILE 23 -10.155 -2.963 0.608 904 H VAL 24 H VAL 24 -12.189 -3.083 3.957 905 HA VAL 24 HA VAL 24 -14.921 -2.018 3.969 906 HB VAL 24 HB VAL 24 -12.457 -1.122 5.486 907 HG11 VAL 24 HG11 VAL 24 -13.971 0.347 6.734 908 HG12 VAL 24 HG12 VAL 24 -15.295 -0.114 5.665 909 HG13 VAL 24 HG13 VAL 24 -13.913 0.773 5.023 910 HG21 VAL 24 HG21 VAL 24 -14.943 -2.558 6.409 911 HG22 VAL 24 HG22 VAL 24 -13.648 -1.973 7.456 912 HG23 VAL 24 HG23 VAL 24 -13.324 -3.245 6.278 913 H GLY 25 H GLY 25 -15.492 -0.366 2.653 914 HA2 GLY 25 HA2 GLY 25 -13.298 1.080 1.286 915 HA3 GLY 25 HA3 GLY 25 -14.801 0.637 0.491 916 H ALA 26 H ALA 26 -13.681 2.436 3.357 917 HA ALA 26 HA ALA 26 -16.007 4.157 3.221 918 HB1 ALA 26 HB1 ALA 26 -15.101 3.344 5.383 919 HB2 ALA 26 HB2 ALA 26 -15.242 5.100 5.286 920 HB3 ALA 26 HB3 ALA 26 -13.664 4.333 5.106 921 H GLU 27 H GLU 27 -15.583 5.115 1.166 922 HA GLU 27 HA GLU 27 -14.339 7.648 1.340 923 HB2 GLU 27 HB2 GLU 27 -12.246 6.563 1.013 924 HB3 GLU 27 HB3 GLU 27 -12.892 5.499 -0.221 925 HG2 GLU 27 HG2 GLU 27 -11.463 7.150 -1.222 926 HG3 GLU 27 HG3 GLU 27 -13.128 7.421 -1.727 927 H SER 28 H SER 28 -14.675 5.434 -1.443 928 HA SER 28 HA SER 28 -17.185 6.578 -2.240 929 HB2 SER 28 HB2 SER 28 -15.301 6.878 -4.468 930 HB3 SER 28 HB3 SER 28 -16.550 7.982 -3.902 931 HG SER 28 HG SER 28 -15.078 8.627 -2.235 932 HA PRO 29 HA PRO 29 -17.529 2.393 -3.669 933 HB2 PRO 29 HB2 PRO 29 -19.489 2.901 -5.591 934 HB3 PRO 29 HB3 PRO 29 -19.778 2.512 -3.893 935 HG2 PRO 29 HG2 PRO 29 -19.738 5.156 -5.254 936 HG3 PRO 29 HG3 PRO 29 -20.766 4.589 -3.928 937 HD2 PRO 29 HD2 PRO 29 -18.714 6.260 -3.496 938 HD3 PRO 29 HD3 PRO 29 -19.134 4.991 -2.327 939 H ALA 30 H ALA 30 -17.232 5.028 -6.046 940 HA ALA 30 HA ALA 30 -16.382 3.211 -8.123 941 HB1 ALA 30 HB1 ALA 30 -16.413 6.221 -8.026 942 HB2 ALA 30 HB2 ALA 30 -17.646 5.180 -8.733 943 HB3 ALA 30 HB3 ALA 30 -16.038 5.258 -9.453 944 H HIS 31 H HIS 31 -14.894 5.013 -5.612 945 HA HIS 31 HA HIS 31 -12.277 5.161 -6.798 946 HB2 HIS 31 HB2 HIS 31 -13.516 5.955 -4.253 947 HB3 HIS 31 HB3 HIS 31 -11.876 5.352 -4.073 948 HD1 HIS 31 HD1 HIS 31 -13.168 8.391 -3.907 949 HD2 HIS 31 HD2 HIS 31 -10.541 6.789 -6.705 950 HE1 HIS 31 HE1 HIS 31 -11.916 10.350 -4.862 951 HE2 HIS 31 HE2 HIS 31 -10.166 9.332 -6.362 952 H ILE 32 H ILE 32 -13.857 3.159 -4.375 953 HA ILE 32 HA ILE 32 -11.634 1.545 -3.756 954 HB ILE 32 HB ILE 32 -13.178 0.042 -2.655 955 HG12 ILE 32 HG12 ILE 32 -15.333 1.626 -4.080 956 HG13 ILE 32 HG13 ILE 32 -14.973 -0.082 -4.272 957 HG21 ILE 32 HG21 ILE 32 -14.179 2.828 -2.170 958 HG22 ILE 32 HG22 ILE 32 -12.536 2.339 -1.758 959 HG23 ILE 32 HG23 ILE 32 -13.909 1.532 -1.005 960 HD11 ILE 32 HD11 ILE 32 -15.592 -0.321 -1.825 961 HD12 ILE 32 HD12 ILE 32 -16.897 0.009 -2.960 962 HD13 ILE 32 HD13 ILE 32 -16.262 1.305 -1.951 963 H ARG 33 H ARG 33 -13.558 1.570 -6.543 964 HA ARG 33 HA ARG 33 -13.441 -1.204 -7.188 965 HB2 ARG 33 HB2 ARG 33 -13.839 1.208 -8.966 966 HB3 ARG 33 HB3 ARG 33 -14.011 -0.458 -9.496 967 HG2 ARG 33 HG2 ARG 33 -15.633 0.704 -7.257 968 HG3 ARG 33 HG3 ARG 33 -16.133 0.783 -8.946 969 HD2 ARG 33 HD2 ARG 33 -15.918 -1.719 -9.021 970 HD3 ARG 33 HD3 ARG 33 -15.682 -1.683 -7.275 971 HE ARG 33 HE ARG 33 -17.971 -0.330 -7.528 972 HH11 ARG 33 HH11 ARG 33 -16.958 -3.404 -8.871 973 HH12 ARG 33 HH12 ARG 33 -18.567 -4.031 -8.973 974 HH21 ARG 33 HH21 ARG 33 -20.090 -1.154 -7.657 975 HH22 ARG 33 HH22 ARG 33 -20.356 -2.754 -8.277 976 H LEU 34 H LEU 34 -11.442 1.602 -7.994 977 HA LEU 34 HA LEU 34 -9.710 0.077 -9.712 978 HB2 LEU 34 HB2 LEU 34 -8.619 2.075 -10.188 979 HB3 LEU 34 HB3 LEU 34 -10.281 2.557 -9.919 980 HG LEU 34 HG LEU 34 -9.110 2.831 -7.416 981 HD11 LEU 34 HD11 LEU 34 -7.226 3.873 -9.529 982 HD12 LEU 34 HD12 LEU 34 -6.891 2.544 -8.418 983 HD13 LEU 34 HD13 LEU 34 -7.118 4.179 -7.795 984 HD21 LEU 34 HD21 LEU 34 -9.340 5.239 -7.877 985 HD22 LEU 34 HD22 LEU 34 -10.755 4.320 -8.389 986 HD23 LEU 34 HD23 LEU 34 -9.581 4.874 -9.584 987 H VAL 35 H VAL 35 -9.859 0.717 -6.350 988 HA VAL 35 HA VAL 35 -7.176 0.684 -5.599 989 HB VAL 35 HB VAL 35 -9.527 -0.517 -4.116 990 HG11 VAL 35 HG11 VAL 35 -7.393 -1.353 -3.265 991 HG12 VAL 35 HG12 VAL 35 -8.165 -0.275 -2.104 992 HG13 VAL 35 HG13 VAL 35 -6.812 0.301 -3.079 993 HG21 VAL 35 HG21 VAL 35 -9.615 1.597 -2.924 994 HG22 VAL 35 HG22 VAL 35 -9.791 1.868 -4.658 995 HG23 VAL 35 HG23 VAL 35 -8.256 2.206 -3.864 996 H ALA 36 H ALA 36 -9.411 -2.029 -6.059 997 HA ALA 36 HA ALA 36 -7.516 -4.046 -5.436 998 HB1 ALA 36 HB1 ALA 36 -9.886 -4.448 -5.243 999 HB2 ALA 36 HB2 ALA 36 -9.179 -5.585 -6.391 1000 HB3 ALA 36 HB3 ALA 36 -10.098 -4.198 -6.975 1001 H ALA 37 H ALA 37 -8.620 -2.593 -8.457 1002 HA ALA 37 HA ALA 37 -7.316 -4.332 -10.234 1003 HB1 ALA 37 HB1 ALA 37 -9.087 -2.756 -10.901 1004 HB2 ALA 37 HB2 ALA 37 -7.648 -2.610 -11.910 1005 HB3 ALA 37 HB3 ALA 37 -7.968 -1.417 -10.652 1006 H PHE 38 H PHE 38 -6.226 -1.442 -8.558 1007 HA PHE 38 HA PHE 38 -3.791 -1.082 -9.929 1008 HB2 PHE 38 HB2 PHE 38 -4.837 0.620 -8.455 1009 HB3 PHE 38 HB3 PHE 38 -4.460 -0.380 -7.058 1010 HD1 PHE 38 HD1 PHE 38 -3.012 1.658 -9.761 1011 HD2 PHE 38 HD2 PHE 38 -2.295 -0.384 -6.096 1012 HE1 PHE 38 HE1 PHE 38 -0.819 2.759 -9.579 1013 HE2 PHE 38 HE2 PHE 38 -0.102 0.711 -5.907 1014 HZ PHE 38 HZ PHE 38 0.639 2.287 -7.649 1015 H VAL 39 H VAL 39 -4.576 -2.821 -6.944 1016 HA VAL 39 HA VAL 39 -1.930 -3.707 -6.429 1017 HB VAL 39 HB VAL 39 -4.550 -4.873 -5.472 1018 HG11 VAL 39 HG11 VAL 39 -2.686 -6.424 -5.191 1019 HG12 VAL 39 HG12 VAL 39 -3.225 -5.799 -3.632 1020 HG13 VAL 39 HG13 VAL 39 -1.754 -5.169 -4.375 1021 HG21 VAL 39 HG21 VAL 39 -3.423 -2.368 -4.963 1022 HG22 VAL 39 HG22 VAL 39 -3.077 -3.341 -3.532 1023 HG23 VAL 39 HG23 VAL 39 -4.741 -3.146 -4.089 1024 H ASP 40 H ASP 40 -4.709 -5.129 -8.074 1025 HA ASP 40 HA ASP 40 -3.763 -7.713 -8.466 1026 HB2 ASP 40 HB2 ASP 40 -6.059 -7.076 -8.997 1027 HB3 ASP 40 HB3 ASP 40 -5.495 -6.044 -10.307 1028 H ASP 41 H ASP 41 -3.341 -4.847 -10.519 1029 HA ASP 41 HA ASP 41 -1.796 -6.207 -12.488 1030 HB2 ASP 41 HB2 ASP 41 -2.785 -3.530 -12.133 1031 HB3 ASP 41 HB3 ASP 41 -1.080 -3.474 -12.561 1032 H LYS 42 H LYS 42 -0.980 -4.362 -9.613 1033 HA LYS 42 HA LYS 42 1.798 -4.213 -10.092 1034 HB2 LYS 42 HB2 LYS 42 0.234 -3.003 -8.331 1035 HB3 LYS 42 HB3 LYS 42 0.753 -4.328 -7.298 1036 HG2 LYS 42 HG2 LYS 42 2.940 -3.618 -7.257 1037 HG3 LYS 42 HG3 LYS 42 2.796 -2.742 -8.782 1038 HD2 LYS 42 HD2 LYS 42 1.388 -1.071 -7.698 1039 HD3 LYS 42 HD3 LYS 42 1.512 -1.949 -6.173 1040 HE2 LYS 42 HE2 LYS 42 3.058 -0.113 -6.140 1041 HE3 LYS 42 HE3 LYS 42 3.963 -1.622 -6.238 1042 HZ1 LYS 42 HZ1 LYS 42 4.428 -1.255 -8.500 1043 HZ2 LYS 42 HZ2 LYS 42 4.740 0.221 -7.724 1044 HZ3 LYS 42 HZ3 LYS 42 3.317 0.012 -8.621 1045 H MET 43 H MET 43 -0.161 -6.578 -8.271 1046 HA MET 43 HA MET 43 2.144 -8.108 -7.538 1047 HB2 MET 43 HB2 MET 43 0.618 -9.733 -6.640 1048 HB3 MET 43 HB3 MET 43 0.007 -8.138 -6.241 1049 HG2 MET 43 HG2 MET 43 -1.557 -8.317 -8.152 1050 HG3 MET 43 HG3 MET 43 -1.003 -9.972 -8.393 1051 HE1 MET 43 HE1 MET 43 -0.587 -10.726 -5.146 1052 HE2 MET 43 HE2 MET 43 -1.107 -11.805 -6.442 1053 HE3 MET 43 HE3 MET 43 -2.088 -11.639 -4.986 1054 H HIS 44 H HIS 44 0.128 -7.912 -10.313 1055 HA HIS 44 HA HIS 44 0.731 -10.508 -11.362 1056 HB2 HIS 44 HB2 HIS 44 -0.765 -8.141 -12.275 1057 HB3 HIS 44 HB3 HIS 44 0.052 -9.009 -13.567 1058 HD1 HIS 44 HD1 HIS 44 -3.113 -8.900 -11.997 1059 HD2 HIS 44 HD2 HIS 44 -0.611 -12.000 -13.216 1060 HE1 HIS 44 HE1 HIS 44 -4.588 -10.922 -12.216 1061 HE2 HIS 44 HE2 HIS 44 -3.078 -12.774 -13.003 1062 H GLU 45 H GLU 45 2.184 -7.303 -11.589 1063 HA GLU 45 HA GLU 45 4.010 -8.073 -13.663 1064 HB2 GLU 45 HB2 GLU 45 4.975 -5.931 -13.478 1065 HB3 GLU 45 HB3 GLU 45 3.261 -5.691 -13.169 1066 HG2 GLU 45 HG2 GLU 45 3.646 -5.467 -10.813 1067 HG3 GLU 45 HG3 GLU 45 5.329 -5.962 -10.989 1068 H PHE 46 H PHE 46 4.022 -8.072 -10.169 1069 HA PHE 46 HA PHE 46 6.795 -8.517 -9.846 1070 HB2 PHE 46 HB2 PHE 46 4.422 -8.581 -8.120 1071 HB3 PHE 46 HB3 PHE 46 5.667 -9.733 -7.655 1072 HD1 PHE 46 HD1 PHE 46 8.150 -8.370 -8.199 1073 HD2 PHE 46 HD2 PHE 46 4.498 -6.818 -6.646 1074 HE1 PHE 46 HE1 PHE 46 9.396 -6.580 -7.069 1075 HE2 PHE 46 HE2 PHE 46 5.744 -5.025 -5.514 1076 HZ PHE 46 HZ PHE 46 8.193 -4.904 -5.725 1077 H SER 47 H SER 47 4.225 -10.529 -10.856 1078 HA SER 47 HA SER 47 5.208 -13.052 -10.064 1079 HB2 SER 47 HB2 SER 47 3.466 -12.360 -12.444 1080 HB3 SER 47 HB3 SER 47 3.659 -13.962 -11.730 1081 HG SER 47 HG SER 47 2.880 -11.882 -10.033 1082 H GLU 48 H GLU 48 6.227 -10.824 -12.437 1083 HA GLU 48 HA GLU 48 7.576 -12.754 -14.108 1084 HB2 GLU 48 HB2 GLU 48 6.628 -10.381 -14.727 1085 HB3 GLU 48 HB3 GLU 48 8.181 -9.817 -14.128 1086 HG2 GLU 48 HG2 GLU 48 8.987 -10.181 -16.152 1087 HG3 GLU 48 HG3 GLU 48 8.813 -11.908 -15.841 1088 H LYS 49 H LYS 49 8.231 -10.943 -11.269 1089 HA LYS 49 HA LYS 49 11.102 -10.990 -11.502 1090 HB2 LYS 49 HB2 LYS 49 9.131 -9.960 -9.551 1091 HB3 LYS 49 HB3 LYS 49 10.675 -10.457 -8.877 1092 HG2 LYS 49 HG2 LYS 49 10.502 -8.601 -11.224 1093 HG3 LYS 49 HG3 LYS 49 10.409 -8.019 -9.561 1094 HD2 LYS 49 HD2 LYS 49 12.656 -9.804 -10.412 1095 HD3 LYS 49 HD3 LYS 49 12.708 -8.080 -10.777 1096 HE2 LYS 49 HE2 LYS 49 12.579 -7.512 -8.461 1097 HE3 LYS 49 HE3 LYS 49 12.260 -9.184 -8.008 1098 HZ1 LYS 49 HZ1 LYS 49 14.561 -8.508 -7.587 1099 HZ2 LYS 49 HZ2 LYS 49 14.784 -8.215 -9.236 1100 HZ3 LYS 49 HZ3 LYS 49 14.475 -9.785 -8.693 1101 H GLN 50 H GLN 50 8.707 -12.674 -9.487 1102 HA GLN 50 HA GLN 50 8.764 -14.627 -8.341 1103 HB2 GLN 50 HB2 GLN 50 10.748 -15.149 -10.522 1104 HB3 GLN 50 HB3 GLN 50 10.489 -16.343 -9.262 1105 HG2 GLN 50 HG2 GLN 50 8.410 -16.878 -10.001 1106 HG3 GLN 50 HG3 GLN 50 8.097 -15.261 -10.625 1107 HE21 GLN 50 HE21 GLN 50 8.589 -14.785 -12.706 1108 HE22 GLN 50 HE22 GLN 50 9.191 -15.939 -13.844 1109 HA PRO 51 HA PRO 51 12.285 -13.017 -5.749 1110 HB2 PRO 51 HB2 PRO 51 10.795 -13.248 -3.418 1111 HB3 PRO 51 HB3 PRO 51 10.994 -11.775 -4.368 1112 HG2 PRO 51 HG2 PRO 51 8.710 -13.675 -4.278 1113 HG3 PRO 51 HG3 PRO 51 8.714 -11.927 -4.548 1114 HD2 PRO 51 HD2 PRO 51 8.361 -13.752 -6.536 1115 HD3 PRO 51 HD3 PRO 51 9.079 -12.152 -6.800 1116 H MET 52 H MET 52 10.102 -15.248 -4.028 1117 HA MET 52 HA MET 52 12.388 -17.076 -3.732 1118 HB2 MET 52 HB2 MET 52 9.992 -16.847 -1.900 1119 HB3 MET 52 HB3 MET 52 11.446 -17.794 -1.623 1120 HG2 MET 52 HG2 MET 52 11.227 -14.796 -1.684 1121 HG3 MET 52 HG3 MET 52 11.490 -15.808 -0.267 1122 HE1 MET 52 HE1 MET 52 14.910 -13.937 -0.637 1123 HE2 MET 52 HE2 MET 52 13.536 -14.277 0.417 1124 HE3 MET 52 HE3 MET 52 13.322 -13.271 -1.018 1125 H LEU 53 H LEU 53 10.138 -16.836 -5.776 1126 HA LEU 53 HA LEU 53 8.741 -18.160 -6.984 1127 HB2 LEU 53 HB2 LEU 53 10.578 -20.268 -5.843 1128 HB3 LEU 53 HB3 LEU 53 9.393 -20.585 -7.098 1129 HG LEU 53 HG LEU 53 11.555 -18.520 -7.449 1130 HD11 LEU 53 HD11 LEU 53 11.665 -21.454 -8.123 1131 HD12 LEU 53 HD12 LEU 53 12.681 -20.602 -6.960 1132 HD13 LEU 53 HD13 LEU 53 12.812 -20.237 -8.681 1133 HD21 LEU 53 HD21 LEU 53 9.626 -18.449 -8.967 1134 HD22 LEU 53 HD22 LEU 53 9.934 -20.123 -9.419 1135 HD23 LEU 53 HD23 LEU 53 11.115 -18.873 -9.805 1136 H ASP 54 H ASP 54 7.319 -17.388 -5.083 1137 HA ASP 54 HA ASP 54 5.634 -19.580 -4.343 1138 HB2 ASP 54 HB2 ASP 54 7.378 -19.663 -2.571 1139 HB3 ASP 54 HB3 ASP 54 6.995 -18.002 -2.144 1140 H VAL 55 H VAL 55 3.562 -18.867 -3.762 1141 HA VAL 55 HA VAL 55 2.796 -16.387 -4.858 1142 HB VAL 55 HB VAL 55 1.051 -18.009 -3.022 1143 HG11 VAL 55 HG11 VAL 55 0.432 -16.279 -5.418 1144 HG12 VAL 55 HG12 VAL 55 0.186 -15.828 -3.729 1145 HG13 VAL 55 HG13 VAL 55 -0.746 -17.150 -4.437 1146 HG21 VAL 55 HG21 VAL 55 0.377 -19.313 -4.974 1147 HG22 VAL 55 HG22 VAL 55 2.095 -19.521 -4.641 1148 HG23 VAL 55 HG23 VAL 55 1.571 -18.473 -5.958 1149 HA PRO 56 HA PRO 56 1.763 -14.845 -0.349 1150 HB2 PRO 56 HB2 PRO 56 3.347 -15.994 1.609 1151 HB3 PRO 56 HB3 PRO 56 1.658 -16.402 1.298 1152 HG2 PRO 56 HG2 PRO 56 4.140 -17.804 0.419 1153 HG3 PRO 56 HG3 PRO 56 2.594 -18.483 0.960 1154 HD2 PRO 56 HD2 PRO 56 3.266 -18.398 -1.637 1155 HD3 PRO 56 HD3 PRO 56 1.590 -18.162 -1.103 1156 H LYS 57 H LYS 57 5.000 -15.992 -1.124 1157 HA LYS 57 HA LYS 57 6.400 -13.863 0.131 1158 HB2 LYS 57 HB2 LYS 57 7.356 -15.505 -2.214 1159 HB3 LYS 57 HB3 LYS 57 8.343 -14.656 -1.034 1160 HG2 LYS 57 HG2 LYS 57 6.602 -17.051 -0.487 1161 HG3 LYS 57 HG3 LYS 57 8.359 -17.053 -0.638 1162 HD2 LYS 57 HD2 LYS 57 8.343 -15.365 1.281 1163 HD3 LYS 57 HD3 LYS 57 6.662 -15.848 1.525 1164 HE2 LYS 57 HE2 LYS 57 9.068 -17.659 1.578 1165 HE3 LYS 57 HE3 LYS 57 8.148 -17.114 2.980 1166 HZ1 LYS 57 HZ1 LYS 57 6.844 -18.615 0.785 1167 HZ2 LYS 57 HZ2 LYS 57 6.344 -18.434 2.393 1168 HZ3 LYS 57 HZ3 LYS 57 7.667 -19.418 2.026 1169 H LEU 58 H LEU 58 4.662 -14.158 -2.793 1170 HA LEU 58 HA LEU 58 5.948 -11.902 -4.086 1171 HB2 LEU 58 HB2 LEU 58 5.013 -13.973 -5.260 1172 HB3 LEU 58 HB3 LEU 58 3.425 -13.300 -4.945 1173 HG LEU 58 HG LEU 58 4.668 -11.187 -6.131 1174 HD11 LEU 58 HD11 LEU 58 6.660 -12.527 -6.584 1175 HD12 LEU 58 HD12 LEU 58 5.853 -12.034 -8.070 1176 HD13 LEU 58 HD13 LEU 58 5.676 -13.683 -7.478 1177 HD21 LEU 58 HD21 LEU 58 2.437 -12.040 -6.633 1178 HD22 LEU 58 HD22 LEU 58 3.146 -13.415 -7.481 1179 HD23 LEU 58 HD23 LEU 58 3.365 -11.783 -8.110 1180 H ALA 59 H ALA 59 2.827 -12.730 -2.644 1181 HA ALA 59 HA ALA 59 1.497 -10.323 -3.121 1182 HB1 ALA 59 HB1 ALA 59 0.268 -12.249 -2.440 1183 HB2 ALA 59 HB2 ALA 59 0.043 -11.001 -1.212 1184 HB3 ALA 59 HB3 ALA 59 1.154 -12.340 -0.916 1185 H VAL 60 H VAL 60 3.436 -11.322 -0.305 1186 HA VAL 60 HA VAL 60 3.054 -8.931 1.151 1187 HB VAL 60 HB VAL 60 3.900 -10.972 2.239 1188 HG11 VAL 60 HG11 VAL 60 6.344 -11.497 2.025 1189 HG12 VAL 60 HG12 VAL 60 6.374 -10.456 0.603 1190 HG13 VAL 60 HG13 VAL 60 5.368 -11.903 0.617 1191 HG21 VAL 60 HG21 VAL 60 4.263 -8.860 3.353 1192 HG22 VAL 60 HG22 VAL 60 5.749 -8.600 2.439 1193 HG23 VAL 60 HG23 VAL 60 5.653 -9.912 3.614 1194 H LEU 61 H LEU 61 5.317 -9.850 -1.353 1195 HA LEU 61 HA LEU 61 7.119 -7.699 -1.052 1196 HB2 LEU 61 HB2 LEU 61 7.472 -9.841 -2.362 1197 HB3 LEU 61 HB3 LEU 61 6.461 -9.149 -3.613 1198 HG LEU 61 HG LEU 61 8.091 -7.286 -3.851 1199 HD11 LEU 61 HD11 LEU 61 9.538 -8.877 -1.758 1200 HD12 LEU 61 HD12 LEU 61 9.191 -7.148 -1.795 1201 HD13 LEU 61 HD13 LEU 61 10.398 -7.827 -2.884 1202 HD21 LEU 61 HD21 LEU 61 9.698 -8.545 -5.100 1203 HD22 LEU 61 HD22 LEU 61 8.132 -9.342 -5.262 1204 HD23 LEU 61 HD23 LEU 61 9.349 -10.005 -4.171 1205 H THR 62 H THR 62 4.083 -8.106 -2.746 1206 HA THR 62 HA THR 62 4.218 -5.636 -4.178 1207 HB THR 62 HB THR 62 1.679 -7.102 -3.458 1208 HG1 THR 62 HG1 THR 62 3.712 -8.200 -4.655 1209 HG21 THR 62 HG21 THR 62 0.838 -6.183 -5.514 1210 HG22 THR 62 HG22 THR 62 2.432 -5.563 -5.943 1211 HG23 THR 62 HG23 THR 62 1.553 -4.869 -4.581 1212 H ALA 63 H ALA 63 2.784 -6.735 -1.159 1213 HA ALA 63 HA ALA 63 1.332 -4.470 -0.441 1214 HB1 ALA 63 HB1 ALA 63 2.743 -6.451 1.347 1215 HB2 ALA 63 HB2 ALA 63 1.099 -6.590 0.724 1216 HB3 ALA 63 HB3 ALA 63 1.505 -5.310 1.866 1217 H VAL 64 H VAL 64 4.690 -5.323 0.347 1218 HA VAL 64 HA VAL 64 5.152 -2.963 1.836 1219 HB VAL 64 HB VAL 64 6.469 -5.074 2.071 1220 HG11 VAL 64 HG11 VAL 64 7.819 -4.103 -0.442 1221 HG12 VAL 64 HG12 VAL 64 6.884 -5.586 -0.256 1222 HG13 VAL 64 HG13 VAL 64 8.412 -5.396 0.601 1223 HG21 VAL 64 HG21 VAL 64 8.610 -3.917 2.503 1224 HG22 VAL 64 HG22 VAL 64 7.210 -3.052 3.137 1225 HG23 VAL 64 HG23 VAL 64 7.982 -2.506 1.650 1226 H GLN 65 H GLN 65 5.593 -3.754 -1.581 1227 HA GLN 65 HA GLN 65 7.132 -1.468 -2.233 1228 HB2 GLN 65 HB2 GLN 65 6.750 -3.531 -3.693 1229 HB3 GLN 65 HB3 GLN 65 5.195 -2.820 -4.109 1230 HG2 GLN 65 HG2 GLN 65 6.461 -0.766 -4.846 1231 HG3 GLN 65 HG3 GLN 65 7.937 -1.715 -4.683 1232 HE21 GLN 65 HE21 GLN 65 8.461 -1.680 -6.817 1233 HE22 GLN 65 HE22 GLN 65 7.549 -2.501 -8.035 1234 H ILE 66 H ILE 66 3.663 -2.115 -2.221 1235 HA ILE 66 HA ILE 66 2.776 0.327 -3.261 1236 HB ILE 66 HB ILE 66 1.485 -1.599 -1.322 1237 HG12 ILE 66 HG12 ILE 66 0.794 -0.980 -4.200 1238 HG13 ILE 66 HG13 ILE 66 1.910 -2.259 -3.725 1239 HG21 ILE 66 HG21 ILE 66 -0.590 -0.423 -1.523 1240 HG22 ILE 66 HG22 ILE 66 0.110 0.723 -2.664 1241 HG23 ILE 66 HG23 ILE 66 0.636 0.721 -0.982 1242 HD11 ILE 66 HD11 ILE 66 -0.206 -3.253 -4.124 1243 HD12 ILE 66 HD12 ILE 66 -1.027 -2.068 -3.109 1244 HD13 ILE 66 HD13 ILE 66 0.053 -3.257 -2.380 1245 H ALA 67 H ALA 67 3.478 -0.693 0.047 1246 HA ALA 67 HA ALA 67 2.670 1.621 1.381 1247 HB1 ALA 67 HB1 ALA 67 3.158 -0.452 2.552 1248 HB2 ALA 67 HB2 ALA 67 4.124 0.873 3.206 1249 HB3 ALA 67 HB3 ALA 67 4.863 -0.311 2.126 1250 H SER 68 H SER 68 5.909 0.740 0.122 1251 HA SER 68 HA SER 68 7.167 3.115 0.959 1252 HB2 SER 68 HB2 SER 68 8.700 2.416 -1.145 1253 HB3 SER 68 HB3 SER 68 8.779 1.598 0.415 1254 HG SER 68 HG SER 68 7.110 0.780 -1.731 1255 H GLU 69 H GLU 69 5.484 2.305 -2.047 1256 HA GLU 69 HA GLU 69 6.240 4.669 -3.427 1257 HB2 GLU 69 HB2 GLU 69 4.297 2.474 -3.888 1258 HB3 GLU 69 HB3 GLU 69 4.006 3.988 -4.733 1259 HG2 GLU 69 HG2 GLU 69 6.250 3.886 -5.693 1260 HG3 GLU 69 HG3 GLU 69 6.538 2.364 -4.852 1261 H TYR 70 H TYR 70 3.545 3.884 -1.303 1262 HA TYR 70 HA TYR 70 2.260 6.417 -1.918 1263 HB2 TYR 70 HB2 TYR 70 1.512 4.022 -0.292 1264 HB3 TYR 70 HB3 TYR 70 0.661 5.544 -0.055 1265 HD1 TYR 70 HD2 TYR 70 1.393 2.862 -2.469 1266 HD2 TYR 70 HD1 TYR 70 -0.900 6.356 -1.687 1267 HE1 TYR 70 HE2 TYR 70 -0.035 2.345 -4.400 1268 HE2 TYR 70 HE1 TYR 70 -2.336 5.848 -3.617 1269 HH TYR 70 HH TYR 70 -2.315 2.850 -5.182 1270 H LEU 71 H LEU 71 4.110 4.970 0.711 1271 HA LEU 71 HA LEU 71 3.576 6.957 2.630 1272 HB2 LEU 71 HB2 LEU 71 5.534 4.791 2.330 1273 HB3 LEU 71 HB3 LEU 71 6.109 6.148 3.277 1274 HG LEU 71 HG LEU 71 3.470 4.819 3.879 1275 HD11 LEU 71 HD11 LEU 71 5.155 3.065 4.010 1276 HD12 LEU 71 HD12 LEU 71 4.581 3.512 5.615 1277 HD13 LEU 71 HD13 LEU 71 6.150 4.084 5.053 1278 HD21 LEU 71 HD21 LEU 71 5.332 6.321 5.709 1279 HD22 LEU 71 HD22 LEU 71 3.660 5.848 6.007 1280 HD23 LEU 71 HD23 LEU 71 4.023 7.090 4.811 1281 H LYS 72 H LYS 72 5.906 6.791 0.018 1282 HA LYS 72 HA LYS 72 7.385 9.088 0.836 1283 HB2 LYS 72 HB2 LYS 72 8.513 8.928 -1.261 1284 HB3 LYS 72 HB3 LYS 72 8.248 7.290 -0.684 1285 HG2 LYS 72 HG2 LYS 72 6.286 7.126 -2.188 1286 HG3 LYS 72 HG3 LYS 72 6.684 8.726 -2.816 1287 HD2 LYS 72 HD2 LYS 72 8.908 7.848 -3.497 1288 HD3 LYS 72 HD3 LYS 72 8.394 6.240 -2.979 1289 HE2 LYS 72 HE2 LYS 72 6.505 6.389 -4.590 1290 HE3 LYS 72 HE3 LYS 72 7.154 7.929 -5.152 1291 HZ1 LYS 72 HZ1 LYS 72 8.605 5.341 -5.251 1292 HZ2 LYS 72 HZ2 LYS 72 9.154 6.817 -5.860 1293 HZ3 LYS 72 HZ3 LYS 72 7.818 6.061 -6.563 1294 H LEU 73 H LEU 73 4.453 8.594 -0.928 1295 HA LEU 73 HA LEU 73 4.437 11.167 -2.192 1296 HB2 LEU 73 HB2 LEU 73 3.294 9.211 -3.166 1297 HB3 LEU 73 HB3 LEU 73 2.200 9.179 -1.800 1298 HG LEU 73 HG LEU 73 1.208 11.278 -2.469 1299 HD11 LEU 73 HD11 LEU 73 1.902 12.264 -4.696 1300 HD12 LEU 73 HD12 LEU 73 3.375 11.307 -4.553 1301 HD13 LEU 73 HD13 LEU 73 2.998 12.536 -3.345 1302 HD21 LEU 73 HD21 LEU 73 0.243 10.607 -4.617 1303 HD22 LEU 73 HD22 LEU 73 0.330 9.252 -3.491 1304 HD23 LEU 73 HD23 LEU 73 1.503 9.389 -4.800 1305 H LYS 74 H LYS 74 2.779 9.708 0.604 1306 HA LYS 74 HA LYS 74 1.403 12.126 1.252 1307 HB2 LYS 74 HB2 LYS 74 0.776 11.033 3.330 1308 HB3 LYS 74 HB3 LYS 74 0.568 9.926 1.984 1309 HG2 LYS 74 HG2 LYS 74 1.990 8.457 2.841 1310 HG3 LYS 74 HG3 LYS 74 3.192 9.694 3.211 1311 HD2 LYS 74 HD2 LYS 74 0.720 9.279 4.877 1312 HD3 LYS 74 HD3 LYS 74 2.221 8.408 5.183 1313 HE2 LYS 74 HE2 LYS 74 2.510 11.314 4.881 1314 HE3 LYS 74 HE3 LYS 74 1.562 10.809 6.276 1315 HZ1 LYS 74 HZ1 LYS 74 3.854 10.994 6.885 1316 HZ2 LYS 74 HZ2 LYS 74 4.347 9.972 5.631 1317 HZ3 LYS 74 HZ3 LYS 74 3.428 9.361 6.917 1318 H GLU 75 H GLU 75 4.559 10.926 1.806 1319 HA GLU 75 HA GLU 75 5.206 12.423 4.120 1320 HB2 GLU 75 HB2 GLU 75 6.492 10.494 2.666 1321 HB3 GLU 75 HB3 GLU 75 7.409 11.932 2.234 1322 HG2 GLU 75 HG2 GLU 75 8.359 10.738 4.150 1323 HG3 GLU 75 HG3 GLU 75 7.870 12.384 4.549 1324 H GLU 76 H GLU 76 5.522 13.055 0.654 1325 HA GLU 76 HA GLU 76 6.731 15.616 1.067 1326 HB2 GLU 76 HB2 GLU 76 6.814 15.846 -1.243 1327 HB3 GLU 76 HB3 GLU 76 6.925 14.107 -1.021 1328 HG2 GLU 76 HG2 GLU 76 4.671 13.795 -1.688 1329 HG3 GLU 76 HG3 GLU 76 4.347 15.528 -1.626 1330 H TYR 77 H TYR 77 3.515 14.388 0.924 1331 HA TYR 77 HA TYR 77 2.073 16.691 0.242 1332 HB2 TYR 77 HB2 TYR 77 0.907 14.604 0.321 1333 HB3 TYR 77 HB3 TYR 77 1.382 14.324 1.992 1334 HD1 TYR 77 HD1 TYR 77 -0.298 17.094 0.135 1335 HD2 TYR 77 HD2 TYR 77 -0.382 14.459 3.466 1336 HE1 TYR 77 HE1 TYR 77 -2.393 18.134 0.882 1337 HE2 TYR 77 HE2 TYR 77 -2.485 15.485 4.230 1338 HH TYR 77 HH TYR 77 -4.446 17.246 2.414 1339 H GLN 78 H GLN 78 3.131 15.468 3.393 1340 HA GLN 78 HA GLN 78 2.224 17.898 4.709 1341 HB2 GLN 78 HB2 GLN 78 3.458 15.327 5.689 1342 HB3 GLN 78 HB3 GLN 78 3.257 16.719 6.748 1343 HG2 GLN 78 HG2 GLN 78 0.885 16.657 6.501 1344 HG3 GLN 78 HG3 GLN 78 0.995 15.433 5.238 1345 HE21 GLN 78 HE21 GLN 78 1.378 16.063 8.652 1346 HE22 GLN 78 HE22 GLN 78 1.251 14.417 9.171 1347 H ARG 79 H ARG 79 4.687 17.357 2.793 1348 HA ARG 79 HA ARG 79 6.760 18.597 4.450 1349 HB2 ARG 79 HB2 ARG 79 7.086 16.495 2.934 1350 HB3 ARG 79 HB3 ARG 79 7.180 17.670 1.633 1351 HG2 ARG 79 HG2 ARG 79 9.056 18.762 2.731 1352 HG3 ARG 79 HG3 ARG 79 8.958 17.609 4.060 1353 HD2 ARG 79 HD2 ARG 79 9.376 16.766 1.201 1354 HD3 ARG 79 HD3 ARG 79 10.712 17.142 2.286 1355 HE ARG 79 HE ARG 79 9.228 15.297 3.650 1356 HH11 ARG 79 HH11 ARG 79 10.752 15.395 0.499 1357 HH12 ARG 79 HH12 ARG 79 11.072 13.689 0.454 1358 HH21 ARG 79 HH21 ARG 79 9.664 13.040 3.605 1359 HH22 ARG 79 HH22 ARG 79 10.440 12.334 2.214 1360 H LEU 80 H LEU 80 5.233 19.018 1.227 1361 HA LEU 80 HA LEU 80 6.455 21.597 0.963 1362 HB2 LEU 80 HB2 LEU 80 5.624 21.723 -1.178 1363 HB3 LEU 80 HB3 LEU 80 5.822 20.008 -0.948 1364 HG LEU 80 HG LEU 80 3.853 20.260 -2.176 1365 HD11 LEU 80 HD11 LEU 80 2.020 19.518 -0.735 1366 HD12 LEU 80 HD12 LEU 80 3.008 19.886 0.676 1367 HD13 LEU 80 HD13 LEU 80 3.522 18.639 -0.460 1368 HD21 LEU 80 HD21 LEU 80 1.981 21.730 -1.537 1369 HD22 LEU 80 HD22 LEU 80 3.457 22.603 -1.951 1370 HD23 LEU 80 HD23 LEU 80 2.992 22.411 -0.262 1371 H ARG 81 H ARG 81 3.733 20.503 2.617 1372 HA ARG 81 HA ARG 81 2.208 22.938 2.362 1373 HB2 ARG 81 HB2 ARG 81 1.896 20.417 3.952 1374 HB3 ARG 81 HB3 ARG 81 0.943 21.835 4.365 1375 HG2 ARG 81 HG2 ARG 81 0.194 21.875 1.946 1376 HG3 ARG 81 HG3 ARG 81 0.924 20.277 1.795 1377 HD2 ARG 81 HD2 ARG 81 -1.485 20.157 2.257 1378 HD3 ARG 81 HD3 ARG 81 -0.523 19.413 3.531 1379 HE ARG 81 HE ARG 81 -1.027 22.116 4.165 1380 HH11 ARG 81 HH11 ARG 81 -2.714 19.034 3.983 1381 HH12 ARG 81 HH12 ARG 81 -3.871 19.469 5.195 1382 HH21 ARG 81 HH21 ARG 81 -2.563 22.682 5.725 1383 HH22 ARG 81 HH22 ARG 81 -3.791 21.543 6.181 1384 H GLU 82 H GLU 82 4.265 21.437 4.838 1385 HA GLU 82 HA GLU 82 3.935 23.480 6.764 1386 HB2 GLU 82 HB2 GLU 82 6.058 22.564 7.750 1387 HB3 GLU 82 HB3 GLU 82 4.792 21.371 7.499 1388 HG2 GLU 82 HG2 GLU 82 5.992 20.217 5.997 1389 HG3 GLU 82 HG3 GLU 82 6.666 21.671 5.262 1390 H GLN 83 H GLN 83 5.755 23.242 3.882 1391 HA GLN 83 HA GLN 83 7.613 25.352 4.531 1392 HB2 GLN 83 HB2 GLN 83 8.206 23.455 3.023 1393 HB3 GLN 83 HB3 GLN 83 7.033 24.058 1.859 1394 HG2 GLN 83 HG2 GLN 83 8.308 26.183 1.764 1395 HG3 GLN 83 HG3 GLN 83 9.530 25.443 2.797 1396 HE21 GLN 83 HE21 GLN 83 10.804 23.791 1.981 1397 HE22 GLN 83 HE22 GLN 83 10.957 23.496 0.285 1398 H LEU 84 H LEU 84 4.599 24.959 2.768 1399 HA LEU 84 HA LEU 84 4.608 27.469 1.461 1400 HB2 LEU 84 HB2 LEU 84 3.175 25.614 0.749 1401 HB3 LEU 84 HB3 LEU 84 2.301 25.693 2.266 1402 HG LEU 84 HG LEU 84 1.581 28.028 1.645 1403 HD11 LEU 84 HD11 LEU 84 1.715 28.705 -0.676 1404 HD12 LEU 84 HD12 LEU 84 2.650 27.266 -1.070 1405 HD13 LEU 84 HD13 LEU 84 3.328 28.495 -0.002 1406 HD21 LEU 84 HD21 LEU 84 0.725 25.754 -0.151 1407 HD22 LEU 84 HD22 LEU 84 -0.118 27.293 -0.010 1408 HD23 LEU 84 HD23 LEU 84 0.004 26.229 1.389 1409 H LYS 85 H LYS 85 3.301 26.355 4.539 1410 HA LYS 85 HA LYS 85 2.091 28.866 5.182 1411 HB2 LYS 85 HB2 LYS 85 1.657 27.882 7.376 1412 HB3 LYS 85 HB3 LYS 85 1.207 26.775 6.087 1413 HG2 LYS 85 HG2 LYS 85 2.368 25.230 7.173 1414 HG3 LYS 85 HG3 LYS 85 3.822 26.079 6.658 1415 HD2 LYS 85 HD2 LYS 85 3.608 27.477 8.749 1416 HD3 LYS 85 HD3 LYS 85 2.348 26.357 9.272 1417 HE2 LYS 85 HE2 LYS 85 4.043 24.510 8.899 1418 HE3 LYS 85 HE3 LYS 85 5.252 25.780 8.751 1419 HZ1 LYS 85 HZ1 LYS 85 5.086 24.828 10.998 1420 HZ2 LYS 85 HZ2 LYS 85 3.505 25.411 11.116 1421 HZ3 LYS 85 HZ3 LYS 85 4.799 26.492 10.969 1422 H LYS 86 H LYS 86 5.288 28.027 5.055 1423 HA LYS 86 HA LYS 86 6.064 29.471 7.460 1424 HB2 LYS 86 HB2 LYS 86 7.252 27.369 6.640 1425 HB3 LYS 86 HB3 LYS 86 7.916 28.367 5.352 1426 HG2 LYS 86 HG2 LYS 86 8.932 29.836 7.044 1427 HG3 LYS 86 HG3 LYS 86 8.309 28.779 8.311 1428 HD2 LYS 86 HD2 LYS 86 9.640 26.936 7.450 1429 HD3 LYS 86 HD3 LYS 86 10.219 27.951 6.124 1430 HE2 LYS 86 HE2 LYS 86 11.171 29.499 7.846 1431 HE3 LYS 86 HE3 LYS 86 10.741 28.309 9.072 1432 HZ1 LYS 86 HZ1 LYS 86 13.019 28.032 8.465 1433 HZ2 LYS 86 HZ2 LYS 86 12.637 27.931 6.825 1434 HZ3 LYS 86 HZ3 LYS 86 12.157 26.703 7.879 Start of MODEL 11 1 H1 GLY 1 H1 GLY 1 17.778 22.081 -15.263 2 H2 GLY 1 H2 GLY 1 18.817 20.754 -15.343 3 H3 GLY 1 H3 GLY 1 17.357 20.633 -14.506 4 HA2 GLY 1 HA3 GLY 1 17.127 19.519 -16.593 5 HA3 GLY 1 HA2 GLY 1 16.132 20.966 -16.577 6 H SER 2 H SER 2 19.410 19.903 -17.464 7 HA SER 2 HA SER 2 19.122 21.268 -20.016 8 HB2 SER 2 HB2 SER 2 21.709 21.981 -19.288 9 HB3 SER 2 HB3 SER 2 20.309 23.054 -19.331 10 HG SER 2 HG SER 2 21.713 22.565 -17.253 11 H HIS 3 H HIS 3 20.424 18.809 -18.053 12 HA HIS 3 HA HIS 3 21.686 17.577 -20.396 13 HB2 HIS 3 HB2 HIS 3 22.997 18.235 -17.803 14 HB3 HIS 3 HB3 HIS 3 23.377 16.677 -18.522 15 HD1 HIS 3 HD1 HIS 3 25.584 18.744 -18.242 16 HD2 HIS 3 HD2 HIS 3 23.207 18.394 -21.630 17 HE1 HIS 3 HE1 HIS 3 26.931 19.737 -20.114 18 HE2 HIS 3 HE2 HIS 3 25.492 19.479 -22.165 19 H MET 4 H MET 4 22.294 15.192 -19.720 20 HA MET 4 HA MET 4 19.890 13.867 -19.131 21 HB2 MET 4 HB2 MET 4 21.601 12.798 -20.461 22 HB3 MET 4 HB3 MET 4 22.743 12.874 -19.126 23 HG2 MET 4 HG2 MET 4 21.345 11.329 -17.847 24 HG3 MET 4 HG3 MET 4 20.211 11.246 -19.192 25 HE1 MET 4 HE1 MET 4 22.279 7.787 -18.889 26 HE2 MET 4 HE2 MET 4 20.696 8.518 -18.625 27 HE3 MET 4 HE3 MET 4 22.041 8.916 -17.555 28 H THR 5 H THR 5 18.925 14.109 -17.213 29 HA THR 5 HA THR 5 20.541 13.679 -14.786 30 HB THR 5 HB THR 5 17.977 15.262 -14.893 31 HG1 THR 5 HG1 THR 5 19.704 16.168 -16.249 32 HG21 THR 5 HG21 THR 5 18.748 14.414 -12.691 33 HG22 THR 5 HG22 THR 5 18.738 16.174 -12.787 34 HG23 THR 5 HG23 THR 5 20.260 15.292 -12.920 35 H GLU 6 H GLU 6 19.777 12.263 -13.255 36 HA GLU 6 HA GLU 6 17.234 10.898 -13.813 37 HB2 GLU 6 HB2 GLU 6 18.346 8.769 -13.057 38 HB3 GLU 6 HB3 GLU 6 18.902 9.385 -14.607 39 HG2 GLU 6 HG2 GLU 6 20.990 9.613 -13.884 40 HG3 GLU 6 HG3 GLU 6 20.478 10.388 -12.386 41 H GLN 7 H GLN 7 16.392 9.712 -11.920 42 HA GLN 7 HA GLN 7 16.753 11.313 -9.523 43 HB2 GLN 7 HB2 GLN 7 14.796 9.076 -10.090 44 HB3 GLN 7 HB3 GLN 7 14.778 10.115 -8.673 45 HG2 GLN 7 HG2 GLN 7 13.233 11.219 -9.873 46 HG3 GLN 7 HG3 GLN 7 14.655 11.982 -10.579 47 HE21 GLN 7 HE21 GLN 7 12.120 9.644 -11.061 48 HE22 GLN 7 HE22 GLN 7 12.320 9.486 -12.770 49 HA PRO 8 HA PRO 8 19.534 8.344 -7.732 50 HB2 PRO 8 HB2 PRO 8 19.299 9.189 -5.133 51 HB3 PRO 8 HB3 PRO 8 20.315 9.983 -6.342 52 HG2 PRO 8 HG2 PRO 8 17.578 10.719 -5.385 53 HG3 PRO 8 HG3 PRO 8 18.957 11.769 -5.755 54 HD2 PRO 8 HD2 PRO 8 16.895 11.453 -7.458 55 HD3 PRO 8 HD3 PRO 8 18.557 11.710 -8.027 56 H LYS 9 H LYS 9 18.614 6.356 -7.844 57 HA LYS 9 HA LYS 9 16.713 5.645 -5.713 58 HB2 LYS 9 HB2 LYS 9 15.652 4.065 -7.186 59 HB3 LYS 9 HB3 LYS 9 15.709 5.613 -8.012 60 HG2 LYS 9 HG2 LYS 9 17.859 4.715 -9.101 61 HG3 LYS 9 HG3 LYS 9 17.310 3.141 -8.540 62 HD2 LYS 9 HD2 LYS 9 16.495 3.304 -10.727 63 HD3 LYS 9 HD3 LYS 9 15.106 3.677 -9.707 64 HE2 LYS 9 HE2 LYS 9 15.238 5.973 -10.183 65 HE3 LYS 9 HE3 LYS 9 16.877 5.838 -10.818 66 HZ1 LYS 9 HZ1 LYS 9 16.022 5.579 -12.826 67 HZ2 LYS 9 HZ2 LYS 9 14.449 5.684 -12.208 68 HZ3 LYS 9 HZ3 LYS 9 15.212 4.181 -12.327 69 H THR 10 H THR 10 16.916 3.483 -4.871 70 HA THR 10 HA THR 10 19.246 1.935 -5.577 71 HB THR 10 HB THR 10 20.094 3.698 -3.975 72 HG1 THR 10 HG1 THR 10 21.463 2.088 -3.826 73 HG21 THR 10 HG21 THR 10 18.455 2.153 -1.958 74 HG22 THR 10 HG22 THR 10 18.089 3.781 -2.529 75 HG23 THR 10 HG23 THR 10 19.567 3.479 -1.617 76 H ARG 11 H ARG 11 19.387 -0.035 -4.073 77 HA ARG 11 HA ARG 11 16.643 -0.956 -3.548 78 HB2 ARG 11 HB2 ARG 11 19.130 -2.473 -4.319 79 HB3 ARG 11 HB3 ARG 11 17.673 -3.264 -3.739 80 HG2 ARG 11 HG2 ARG 11 16.423 -2.277 -5.615 81 HG3 ARG 11 HG3 ARG 11 17.927 -1.575 -6.215 82 HD2 ARG 11 HD2 ARG 11 18.888 -3.776 -6.487 83 HD3 ARG 11 HD3 ARG 11 17.456 -4.520 -5.780 84 HE ARG 11 HE ARG 11 16.722 -2.956 -8.012 85 HH11 ARG 11 HH11 ARG 11 18.317 -5.966 -7.205 86 HH12 ARG 11 HH12 ARG 11 17.901 -6.733 -8.701 87 HH21 ARG 11 HH21 ARG 11 16.163 -3.971 -9.984 88 HH22 ARG 11 HH22 ARG 11 16.664 -5.607 -10.277 89 H VAL 12 H VAL 12 16.139 -1.981 -1.655 90 HA VAL 12 HA VAL 12 18.250 -2.127 0.391 91 HB VAL 12 HB VAL 12 16.912 -0.086 0.749 92 HG11 VAL 12 HG11 VAL 12 14.806 -0.734 -0.196 93 HG12 VAL 12 HG12 VAL 12 14.559 -0.310 1.498 94 HG13 VAL 12 HG13 VAL 12 14.606 -2.004 1.011 95 HG21 VAL 12 HG21 VAL 12 16.670 -2.284 2.785 96 HG22 VAL 12 HG22 VAL 12 16.213 -0.612 3.118 97 HG23 VAL 12 HG23 VAL 12 17.879 -1.004 2.695 98 H SER 13 H SER 13 18.157 -3.859 1.746 99 HA SER 13 HA SER 13 16.134 -5.890 1.131 100 HB2 SER 13 HB2 SER 13 18.645 -6.419 2.698 101 HB3 SER 13 HB3 SER 13 17.715 -7.526 1.691 102 HG SER 13 HG SER 13 19.858 -6.227 0.997 103 H VAL 14 H VAL 14 14.509 -6.036 2.562 104 HA VAL 14 HA VAL 14 15.100 -5.427 5.387 105 HB VAL 14 HB VAL 14 12.652 -4.757 5.554 106 HG11 VAL 14 HG11 VAL 14 13.126 -2.448 4.754 107 HG12 VAL 14 HG12 VAL 14 14.616 -3.056 4.033 108 HG13 VAL 14 HG13 VAL 14 14.390 -3.127 5.780 109 HG21 VAL 14 HG21 VAL 14 12.910 -4.278 2.591 110 HG22 VAL 14 HG22 VAL 14 11.494 -4.043 3.612 111 HG23 VAL 14 HG23 VAL 14 12.071 -5.672 3.276 112 H ARG 15 H ARG 15 13.697 -6.483 6.948 113 HA ARG 15 HA ARG 15 12.942 -9.165 6.031 114 HB2 ARG 15 HB2 ARG 15 14.711 -9.050 7.736 115 HB3 ARG 15 HB3 ARG 15 13.613 -8.195 8.811 116 HG2 ARG 15 HG2 ARG 15 12.314 -10.574 8.001 117 HG3 ARG 15 HG3 ARG 15 13.961 -10.999 8.469 118 HD2 ARG 15 HD2 ARG 15 12.718 -11.169 10.446 119 HD3 ARG 15 HD3 ARG 15 13.542 -9.618 10.575 120 HE ARG 15 HE ARG 15 10.931 -9.361 9.438 121 HH11 ARG 15 HH11 ARG 15 12.702 -9.652 12.426 122 HH12 ARG 15 HH12 ARG 15 11.449 -8.944 13.392 123 HH21 ARG 15 HH21 ARG 15 9.234 -8.453 10.713 124 HH22 ARG 15 HH22 ARG 15 9.487 -8.255 12.421 125 H ILE 16 H ILE 16 10.864 -9.704 5.985 126 HA ILE 16 HA ILE 16 8.995 -8.378 7.828 127 HB ILE 16 HB ILE 16 8.577 -8.821 4.867 128 HG12 ILE 16 HG12 ILE 16 7.840 -6.227 5.845 129 HG13 ILE 16 HG13 ILE 16 9.479 -6.599 6.369 130 HG21 ILE 16 HG21 ILE 16 6.585 -9.492 6.147 131 HG22 ILE 16 HG22 ILE 16 6.301 -8.063 5.153 132 HG23 ILE 16 HG23 ILE 16 6.547 -7.894 6.892 133 HD11 ILE 16 HD11 ILE 16 9.395 -5.398 4.227 134 HD12 ILE 16 HD12 ILE 16 8.506 -6.751 3.527 135 HD13 ILE 16 HD13 ILE 16 10.160 -6.980 4.093 136 H TYR 17 H TYR 17 7.866 -9.805 8.961 137 HA TYR 17 HA TYR 17 6.923 -11.735 9.701 138 HB2 TYR 17 HB2 TYR 17 5.921 -11.467 7.246 139 HB3 TYR 17 HB3 TYR 17 6.835 -12.946 6.978 140 HD1 TYR 17 HD1 TYR 17 4.697 -11.653 9.765 141 HD2 TYR 17 HD2 TYR 17 5.475 -14.804 7.017 142 HE1 TYR 17 HE1 TYR 17 2.840 -12.946 10.728 143 HE2 TYR 17 HE2 TYR 17 3.622 -16.106 7.972 144 HH TYR 17 HH TYR 17 1.314 -14.760 10.059 145 H GLY 18 H GLY 18 9.914 -11.528 8.911 146 HA2 GLY 18 HA2 GLY 18 11.482 -13.071 9.926 147 HA3 GLY 18 HA3 GLY 18 10.460 -14.386 9.368 148 H GLN 19 H GLN 19 10.098 -13.166 6.707 149 HA GLN 19 HA GLN 19 12.617 -14.123 5.582 150 HB2 GLN 19 HB2 GLN 19 9.851 -14.081 4.726 151 HB3 GLN 19 HB3 GLN 19 10.903 -13.420 3.485 152 HG2 GLN 19 HG2 GLN 19 11.295 -16.092 4.809 153 HG3 GLN 19 HG3 GLN 19 10.489 -15.843 3.264 154 HE21 GLN 19 HE21 GLN 19 12.295 -13.740 2.407 155 HE22 GLN 19 HE22 GLN 19 13.788 -14.513 2.002 156 H ASP 20 H ASP 20 13.894 -12.930 4.159 157 HA ASP 20 HA ASP 20 13.556 -10.035 4.388 158 HB2 ASP 20 HB2 ASP 20 15.883 -9.833 3.814 159 HB3 ASP 20 HB3 ASP 20 15.737 -11.065 5.061 160 H TYR 21 H TYR 21 13.397 -8.698 2.645 161 HA TYR 21 HA TYR 21 13.254 -9.967 -0.009 162 HB2 TYR 21 HB2 TYR 21 11.284 -7.917 1.020 163 HB3 TYR 21 HB3 TYR 21 11.263 -8.687 -0.562 164 HD1 TYR 21 HD1 TYR 21 10.861 -11.195 -0.669 165 HD2 TYR 21 HD2 TYR 21 10.204 -8.897 2.852 166 HE1 TYR 21 HE1 TYR 21 9.434 -12.987 0.226 167 HE2 TYR 21 HE2 TYR 21 8.776 -10.688 3.757 168 HH TYR 21 HH TYR 21 7.486 -12.557 3.027 169 H THR 22 H THR 22 13.865 -8.690 -1.735 170 HA THR 22 HA THR 22 15.355 -6.281 -1.006 171 HB THR 22 HB THR 22 15.421 -7.464 -3.754 172 HG1 THR 22 HG1 THR 22 16.340 -8.676 -1.408 173 HG21 THR 22 HG21 THR 22 16.652 -5.431 -3.412 174 HG22 THR 22 HG22 THR 22 17.806 -6.756 -3.561 175 HG23 THR 22 HG23 THR 22 17.429 -6.092 -1.973 176 H ILE 23 H ILE 23 14.267 -4.418 -1.224 177 HA ILE 23 HA ILE 23 12.429 -4.166 -3.514 178 HB ILE 23 HB ILE 23 11.153 -2.501 -2.091 179 HG12 ILE 23 HG12 ILE 23 12.576 -3.906 0.185 180 HG13 ILE 23 HG13 ILE 23 12.963 -2.279 -0.362 181 HG21 ILE 23 HG21 ILE 23 11.142 -5.381 -1.196 182 HG22 ILE 23 HG22 ILE 23 10.326 -4.747 -2.625 183 HG23 ILE 23 HG23 ILE 23 9.817 -4.232 -1.018 184 HD11 ILE 23 HD11 ILE 23 10.531 -3.268 1.054 185 HD12 ILE 23 HD12 ILE 23 10.476 -1.784 0.101 186 HD13 ILE 23 HD13 ILE 23 11.594 -1.920 1.459 187 H VAL 24 H VAL 24 11.960 -1.730 -3.905 188 HA VAL 24 HA VAL 24 14.578 -0.450 -4.153 189 HB VAL 24 HB VAL 24 11.988 0.298 -5.523 190 HG11 VAL 24 HG11 VAL 24 13.441 1.553 -7.059 191 HG12 VAL 24 HG12 VAL 24 14.839 1.122 -6.073 192 HG13 VAL 24 HG13 VAL 24 13.569 2.142 -5.401 193 HG21 VAL 24 HG21 VAL 24 12.665 -1.935 -6.191 194 HG22 VAL 24 HG22 VAL 24 14.295 -1.359 -6.537 195 HG23 VAL 24 HG23 VAL 24 12.936 -0.797 -7.510 196 H GLY 25 H GLY 25 15.092 1.327 -3.010 197 HA2 GLY 25 HA2 GLY 25 13.148 2.395 -1.132 198 HA3 GLY 25 HA3 GLY 25 14.851 2.821 -1.231 199 H ALA 26 H ALA 26 15.527 4.409 -2.715 200 HA ALA 26 HA ALA 26 15.404 6.363 -3.860 201 HB1 ALA 26 HB1 ALA 26 12.732 5.339 -4.810 202 HB2 ALA 26 HB2 ALA 26 14.290 4.990 -5.561 203 HB3 ALA 26 HB3 ALA 26 13.671 6.642 -5.538 204 H GLU 27 H GLU 27 14.788 6.580 -1.228 205 HA GLU 27 HA GLU 27 13.114 8.923 -1.219 206 HB2 GLU 27 HB2 GLU 27 11.336 7.422 -0.898 207 HB3 GLU 27 HB3 GLU 27 12.277 6.373 0.143 208 HG2 GLU 27 HG2 GLU 27 10.477 7.692 1.267 209 HG3 GLU 27 HG3 GLU 27 12.079 7.848 1.973 210 H SER 28 H SER 28 14.035 6.705 1.418 211 HA SER 28 HA SER 28 16.302 8.220 2.208 212 HB2 SER 28 HB2 SER 28 15.237 9.844 3.367 213 HB3 SER 28 HB3 SER 28 13.690 9.010 3.261 214 HG SER 28 HG SER 28 14.772 9.339 5.425 215 HA PRO 29 HA PRO 29 17.358 4.298 3.933 216 HB2 PRO 29 HB2 PRO 29 18.602 5.949 6.084 217 HB3 PRO 29 HB3 PRO 29 19.299 4.638 5.125 218 HG2 PRO 29 HG2 PRO 29 19.916 7.170 4.597 219 HG3 PRO 29 HG3 PRO 29 19.670 6.006 3.283 220 HD2 PRO 29 HD2 PRO 29 17.880 8.185 4.247 221 HD3 PRO 29 HD3 PRO 29 18.129 7.566 2.602 222 H ALA 30 H ALA 30 16.418 6.753 6.355 223 HA ALA 30 HA ALA 30 15.507 4.800 8.227 224 HB1 ALA 30 HB1 ALA 30 14.716 6.683 9.533 225 HB2 ALA 30 HB2 ALA 30 14.945 7.758 8.154 226 HB3 ALA 30 HB3 ALA 30 16.339 7.002 8.920 227 H HIS 31 H HIS 31 13.954 6.855 5.824 228 HA HIS 31 HA HIS 31 11.284 6.374 6.547 229 HB2 HIS 31 HB2 HIS 31 12.670 7.381 4.136 230 HB3 HIS 31 HB3 HIS 31 11.056 6.736 3.878 231 HD1 HIS 31 HD1 HIS 31 11.745 9.758 3.507 232 HD2 HIS 31 HD2 HIS 31 10.091 8.075 6.939 233 HE1 HIS 31 HE1 HIS 31 10.585 11.635 4.696 234 HE2 HIS 31 HE2 HIS 31 9.363 10.537 6.604 235 H ILE 32 H ILE 32 13.289 4.758 4.106 236 HA ILE 32 HA ILE 32 11.293 2.861 3.394 237 HB ILE 32 HB ILE 32 13.011 1.710 2.131 238 HG12 ILE 32 HG12 ILE 32 14.983 3.563 3.503 239 HG13 ILE 32 HG13 ILE 32 14.846 1.833 3.770 240 HG21 ILE 32 HG21 ILE 32 13.596 3.466 0.613 241 HG22 ILE 32 HG22 ILE 32 13.426 4.684 1.875 242 HG23 ILE 32 HG23 ILE 32 12.005 3.823 1.284 243 HD11 ILE 32 HD11 ILE 32 16.675 2.059 2.364 244 HD12 ILE 32 HD12 ILE 32 15.891 3.292 1.379 245 HD13 ILE 32 HD13 ILE 32 15.364 1.613 1.271 246 H ARG 33 H ARG 33 13.502 3.010 6.000 247 HA ARG 33 HA ARG 33 13.692 0.199 6.470 248 HB2 ARG 33 HB2 ARG 33 15.245 2.125 7.271 249 HB3 ARG 33 HB3 ARG 33 14.094 2.280 8.591 250 HG2 ARG 33 HG2 ARG 33 14.979 0.548 9.659 251 HG3 ARG 33 HG3 ARG 33 14.874 -0.470 8.221 252 HD2 ARG 33 HD2 ARG 33 17.191 -0.210 9.020 253 HD3 ARG 33 HD3 ARG 33 16.963 0.416 7.390 254 HE ARG 33 HE ARG 33 16.795 2.315 9.600 255 HH11 ARG 33 HH11 ARG 33 18.656 0.975 6.955 256 HH12 ARG 33 HH12 ARG 33 19.754 2.317 6.880 257 HH21 ARG 33 HH21 ARG 33 18.235 4.090 9.503 258 HH22 ARG 33 HH22 ARG 33 19.515 4.090 8.328 259 H LEU 34 H LEU 34 11.632 2.806 7.711 260 HA LEU 34 HA LEU 34 10.356 1.076 9.611 261 HB2 LEU 34 HB2 LEU 34 9.133 2.909 10.316 262 HB3 LEU 34 HB3 LEU 34 10.642 3.613 9.777 263 HG LEU 34 HG LEU 34 9.085 3.776 7.516 264 HD11 LEU 34 HD11 LEU 34 6.945 4.698 8.210 265 HD12 LEU 34 HD12 LEU 34 7.337 4.389 9.900 266 HD13 LEU 34 HD13 LEU 34 7.111 3.041 8.787 267 HD21 LEU 34 HD21 LEU 34 10.591 5.472 8.598 268 HD22 LEU 34 HD22 LEU 34 9.247 5.884 9.662 269 HD23 LEU 34 HD23 LEU 34 9.099 6.121 7.922 270 H VAL 35 H VAL 35 9.944 1.672 6.275 271 HA VAL 35 HA VAL 35 7.195 1.247 5.938 272 HB VAL 35 HB VAL 35 9.453 0.433 4.093 273 HG11 VAL 35 HG11 VAL 35 7.744 0.480 2.321 274 HG12 VAL 35 HG12 VAL 35 6.504 0.741 3.547 275 HG13 VAL 35 HG13 VAL 35 7.425 -0.763 3.529 276 HG21 VAL 35 HG21 VAL 35 9.311 2.864 4.684 277 HG22 VAL 35 HG22 VAL 35 7.706 2.879 3.950 278 HG23 VAL 35 HG23 VAL 35 9.120 2.507 2.967 279 H ALA 36 H ALA 36 9.889 -1.017 6.134 280 HA ALA 36 HA ALA 36 8.486 -3.376 5.596 281 HB1 ALA 36 HB1 ALA 36 10.863 -3.088 7.423 282 HB2 ALA 36 HB2 ALA 36 10.959 -3.121 5.661 283 HB3 ALA 36 HB3 ALA 36 10.359 -4.529 6.540 284 H ALA 37 H ALA 37 9.184 -1.778 8.688 285 HA ALA 37 HA ALA 37 7.927 -3.734 10.302 286 HB1 ALA 37 HB1 ALA 37 8.461 -0.831 10.925 287 HB2 ALA 37 HB2 ALA 37 9.597 -2.160 11.163 288 HB3 ALA 37 HB3 ALA 37 8.101 -2.101 12.094 289 H PHE 38 H PHE 38 6.725 -1.081 8.442 290 HA PHE 38 HA PHE 38 4.269 -0.694 9.822 291 HB2 PHE 38 HB2 PHE 38 5.300 0.952 8.240 292 HB3 PHE 38 HB3 PHE 38 4.898 -0.128 6.911 293 HD1 PHE 38 HD2 PHE 38 3.348 1.771 9.706 294 HD2 PHE 38 HD1 PHE 38 2.857 0.077 5.832 295 HE1 PHE 38 HE2 PHE 38 1.135 2.833 9.523 296 HE2 PHE 38 HE1 PHE 38 0.647 1.136 5.644 297 HZ PHE 38 HZ PHE 38 -0.217 2.516 7.493 298 H VAL 39 H VAL 39 5.129 -2.522 6.890 299 HA VAL 39 HA VAL 39 2.500 -3.618 6.604 300 HB VAL 39 HB VAL 39 4.114 -3.257 4.704 301 HG11 VAL 39 HG11 VAL 39 5.826 -4.839 4.233 302 HG12 VAL 39 HG12 VAL 39 5.364 -5.835 5.611 303 HG13 VAL 39 HG13 VAL 39 6.088 -4.249 5.873 304 HG21 VAL 39 HG21 VAL 39 3.442 -5.286 3.494 305 HG22 VAL 39 HG22 VAL 39 2.110 -4.571 4.402 306 HG23 VAL 39 HG23 VAL 39 2.927 -6.006 5.018 307 H ASP 40 H ASP 40 5.479 -4.634 8.135 308 HA ASP 40 HA ASP 40 4.930 -7.356 8.502 309 HB2 ASP 40 HB2 ASP 40 7.132 -6.236 8.907 310 HB3 ASP 40 HB3 ASP 40 6.462 -5.534 10.372 311 H ASP 41 H ASP 41 4.205 -4.568 10.563 312 HA ASP 41 HA ASP 41 2.999 -6.038 12.648 313 HB2 ASP 41 HB2 ASP 41 3.046 -3.172 11.826 314 HB3 ASP 41 HB3 ASP 41 1.808 -3.677 12.966 315 H LYS 42 H LYS 42 1.677 -4.432 9.796 316 HA LYS 42 HA LYS 42 -1.038 -4.770 10.393 317 HB2 LYS 42 HB2 LYS 42 -0.080 -3.249 8.662 318 HB3 LYS 42 HB3 LYS 42 0.208 -4.656 7.649 319 HG2 LYS 42 HG2 LYS 42 -2.143 -5.101 7.497 320 HG3 LYS 42 HG3 LYS 42 -2.502 -3.832 8.668 321 HD2 LYS 42 HD2 LYS 42 -1.061 -3.230 6.106 322 HD3 LYS 42 HD3 LYS 42 -2.823 -3.308 6.172 323 HE2 LYS 42 HE2 LYS 42 -1.143 -1.557 7.960 324 HE3 LYS 42 HE3 LYS 42 -1.872 -1.010 6.451 325 HZ1 LYS 42 HZ1 LYS 42 -3.400 -0.389 8.049 326 HZ2 LYS 42 HZ2 LYS 42 -3.197 -1.795 8.966 327 HZ3 LYS 42 HZ3 LYS 42 -4.038 -1.857 7.496 328 H MET 43 H MET 43 1.216 -6.896 8.638 329 HA MET 43 HA MET 43 -0.846 -8.729 7.891 330 HB2 MET 43 HB2 MET 43 0.827 -10.069 6.953 331 HB3 MET 43 HB3 MET 43 1.429 -8.429 6.766 332 HG2 MET 43 HG2 MET 43 2.820 -8.763 8.787 333 HG3 MET 43 HG3 MET 43 2.284 -10.444 8.829 334 HE1 MET 43 HE1 MET 43 2.552 -12.042 6.686 335 HE2 MET 43 HE2 MET 43 3.688 -11.741 5.370 336 HE3 MET 43 HE3 MET 43 2.184 -10.823 5.465 337 H HIS 44 H HIS 44 0.859 -8.169 10.784 338 HA HIS 44 HA HIS 44 0.567 -10.855 11.802 339 HB2 HIS 44 HB2 HIS 44 1.621 -8.283 12.874 340 HB3 HIS 44 HB3 HIS 44 1.064 -9.480 14.037 341 HD1 HIS 44 HD1 HIS 44 3.787 -8.773 11.603 342 HD2 HIS 44 HD2 HIS 44 2.631 -11.838 14.162 343 HE1 HIS 44 HE1 HIS 44 5.763 -10.317 11.746 344 HE2 HIS 44 HE2 HIS 44 5.099 -12.067 13.429 345 H GLU 45 H GLU 45 -1.134 -7.769 12.084 346 HA GLU 45 HA GLU 45 -2.951 -8.672 14.082 347 HB2 GLU 45 HB2 GLU 45 -4.168 -6.638 13.709 348 HB3 GLU 45 HB3 GLU 45 -2.455 -6.260 13.611 349 HG2 GLU 45 HG2 GLU 45 -2.563 -6.175 11.199 350 HG3 GLU 45 HG3 GLU 45 -4.243 -6.706 11.223 351 H PHE 46 H PHE 46 -2.971 -8.664 10.564 352 HA PHE 46 HA PHE 46 -5.684 -9.443 10.290 353 HB2 PHE 46 HB2 PHE 46 -3.334 -9.259 8.479 354 HB3 PHE 46 HB3 PHE 46 -4.678 -10.275 7.964 355 HD1 PHE 46 HD1 PHE 46 -7.063 -9.069 8.463 356 HD2 PHE 46 HD2 PHE 46 -3.368 -7.120 7.671 357 HE1 PHE 46 HE1 PHE 46 -8.285 -7.080 7.696 358 HE2 PHE 46 HE2 PHE 46 -4.583 -5.126 6.900 359 HZ PHE 46 HZ PHE 46 -7.044 -5.106 6.907 360 H SER 47 H SER 47 -2.784 -11.181 10.993 361 HA SER 47 HA SER 47 -3.591 -13.757 10.156 362 HB2 SER 47 HB2 SER 47 -1.676 -12.935 12.355 363 HB3 SER 47 HB3 SER 47 -1.850 -14.577 11.738 364 HG SER 47 HG SER 47 -1.109 -12.317 10.170 365 H GLU 48 H GLU 48 -4.481 -11.764 12.795 366 HA GLU 48 HA GLU 48 -5.416 -13.827 14.538 367 HB2 GLU 48 HB2 GLU 48 -4.722 -11.542 15.271 368 HB3 GLU 48 HB3 GLU 48 -6.143 -10.892 14.469 369 HG2 GLU 48 HG2 GLU 48 -7.597 -12.036 15.979 370 HG3 GLU 48 HG3 GLU 48 -6.241 -12.902 16.700 371 H LYS 49 H LYS 49 -6.757 -11.920 11.937 372 HA LYS 49 HA LYS 49 -9.477 -12.736 12.481 373 HB2 LYS 49 HB2 LYS 49 -8.280 -11.224 10.158 374 HB3 LYS 49 HB3 LYS 49 -9.996 -11.507 10.385 375 HG2 LYS 49 HG2 LYS 49 -8.296 -10.047 12.389 376 HG3 LYS 49 HG3 LYS 49 -9.137 -9.239 11.067 377 HD2 LYS 49 HD2 LYS 49 -10.600 -11.012 13.007 378 HD3 LYS 49 HD3 LYS 49 -10.275 -9.319 13.369 379 HE2 LYS 49 HE2 LYS 49 -11.496 -8.631 11.397 380 HE3 LYS 49 HE3 LYS 49 -11.741 -10.313 10.925 381 HZ1 LYS 49 HZ1 LYS 49 -12.709 -9.286 13.519 382 HZ2 LYS 49 HZ2 LYS 49 -13.208 -10.665 12.677 383 HZ3 LYS 49 HZ3 LYS 49 -13.633 -9.130 12.114 384 H GLN 50 H GLN 50 -7.068 -13.343 9.938 385 HA GLN 50 HA GLN 50 -6.789 -15.045 8.463 386 HB2 GLN 50 HB2 GLN 50 -8.535 -16.431 10.483 387 HB3 GLN 50 HB3 GLN 50 -7.941 -17.249 9.046 388 HG2 GLN 50 HG2 GLN 50 -5.822 -17.380 9.823 389 HG3 GLN 50 HG3 GLN 50 -5.938 -15.867 10.725 390 HE21 GLN 50 HE21 GLN 50 -6.512 -15.913 12.833 391 HE22 GLN 50 HE22 GLN 50 -6.838 -17.360 13.724 392 HA PRO 51 HA PRO 51 -10.653 -13.758 6.245 393 HB2 PRO 51 HB2 PRO 51 -9.315 -13.750 3.806 394 HB3 PRO 51 HB3 PRO 51 -9.573 -12.341 4.836 395 HG2 PRO 51 HG2 PRO 51 -7.160 -14.065 4.545 396 HG3 PRO 51 HG3 PRO 51 -7.272 -12.318 4.822 397 HD2 PRO 51 HD2 PRO 51 -6.631 -14.037 6.790 398 HD3 PRO 51 HD3 PRO 51 -7.575 -12.566 7.096 399 H MET 52 H MET 52 -8.224 -15.942 4.784 400 HA MET 52 HA MET 52 -10.390 -17.893 4.361 401 HB2 MET 52 HB2 MET 52 -8.060 -17.255 2.544 402 HB3 MET 52 HB3 MET 52 -9.101 -18.656 2.342 403 HG2 MET 52 HG2 MET 52 -11.018 -16.931 2.273 404 HG3 MET 52 HG3 MET 52 -9.737 -15.763 1.963 405 HE1 MET 52 HE1 MET 52 -11.126 -19.140 -0.832 406 HE2 MET 52 HE2 MET 52 -11.996 -18.529 0.575 407 HE3 MET 52 HE3 MET 52 -10.535 -19.493 0.791 408 H LEU 53 H LEU 53 -8.205 -17.381 6.422 409 HA LEU 53 HA LEU 53 -6.708 -18.517 7.699 410 HB2 LEU 53 HB2 LEU 53 -8.582 -20.648 6.742 411 HB3 LEU 53 HB3 LEU 53 -7.201 -21.082 7.730 412 HG LEU 53 HG LEU 53 -8.095 -19.338 9.406 413 HD11 LEU 53 HD11 LEU 53 -10.598 -19.805 7.793 414 HD12 LEU 53 HD12 LEU 53 -9.705 -18.287 7.893 415 HD13 LEU 53 HD13 LEU 53 -10.488 -18.945 9.329 416 HD21 LEU 53 HD21 LEU 53 -9.634 -20.992 10.384 417 HD22 LEU 53 HD22 LEU 53 -8.116 -21.709 9.848 418 HD23 LEU 53 HD23 LEU 53 -9.576 -21.910 8.879 419 H ASP 54 H ASP 54 -5.439 -17.805 5.484 420 HA ASP 54 HA ASP 54 -3.549 -19.948 5.101 421 HB2 ASP 54 HB2 ASP 54 -5.421 -20.215 3.347 422 HB3 ASP 54 HB3 ASP 54 -4.758 -18.760 2.612 423 H VAL 55 H VAL 55 -1.538 -19.203 4.348 424 HA VAL 55 HA VAL 55 -0.899 -16.563 5.063 425 HB VAL 55 HB VAL 55 0.821 -18.400 3.392 426 HG11 VAL 55 HG11 VAL 55 1.551 -16.138 5.256 427 HG12 VAL 55 HG12 VAL 55 1.592 -16.074 3.494 428 HG13 VAL 55 HG13 VAL 55 2.681 -17.155 4.363 429 HG21 VAL 55 HG21 VAL 55 1.778 -19.167 5.508 430 HG22 VAL 55 HG22 VAL 55 0.061 -19.554 5.402 431 HG23 VAL 55 HG23 VAL 55 0.601 -18.201 6.396 432 HA PRO 56 HA PRO 56 -0.256 -15.567 0.327 433 HB2 PRO 56 HB2 PRO 56 -1.832 -17.117 -1.341 434 HB3 PRO 56 HB3 PRO 56 -0.096 -17.321 -1.105 435 HG2 PRO 56 HG2 PRO 56 -2.365 -18.807 0.122 436 HG3 PRO 56 HG3 PRO 56 -0.791 -19.412 -0.423 437 HD2 PRO 56 HD2 PRO 56 -1.338 -19.028 2.174 438 HD3 PRO 56 HD3 PRO 56 0.279 -18.721 1.509 439 H LYS 57 H LYS 57 -3.282 -16.764 1.641 440 HA LYS 57 HA LYS 57 -4.884 -14.857 0.165 441 HB2 LYS 57 HB2 LYS 57 -5.687 -16.643 2.462 442 HB3 LYS 57 HB3 LYS 57 -6.775 -15.769 1.397 443 HG2 LYS 57 HG2 LYS 57 -4.975 -18.061 0.663 444 HG3 LYS 57 HG3 LYS 57 -6.736 -18.076 0.758 445 HD2 LYS 57 HD2 LYS 57 -6.666 -16.255 -1.039 446 HD3 LYS 57 HD3 LYS 57 -4.974 -16.707 -1.255 447 HE2 LYS 57 HE2 LYS 57 -6.086 -19.134 -1.348 448 HE3 LYS 57 HE3 LYS 57 -7.442 -18.181 -1.944 449 HZ1 LYS 57 HZ1 LYS 57 -6.183 -18.824 -3.811 450 HZ2 LYS 57 HZ2 LYS 57 -4.721 -18.373 -3.098 451 HZ3 LYS 57 HZ3 LYS 57 -5.832 -17.187 -3.564 452 H LEU 58 H LEU 58 -2.877 -14.659 2.748 453 HA LEU 58 HA LEU 58 -4.457 -12.664 4.202 454 HB2 LEU 58 HB2 LEU 58 -3.270 -14.558 5.388 455 HB3 LEU 58 HB3 LEU 58 -1.758 -13.808 4.915 456 HG LEU 58 HG LEU 58 -2.888 -11.711 6.136 457 HD11 LEU 58 HD11 LEU 58 -4.943 -12.800 6.703 458 HD12 LEU 58 HD12 LEU 58 -4.017 -12.544 8.182 459 HD13 LEU 58 HD13 LEU 58 -4.078 -14.146 7.446 460 HD21 LEU 58 HD21 LEU 58 -1.586 -12.313 8.106 461 HD22 LEU 58 HD22 LEU 58 -0.698 -12.689 6.629 462 HD23 LEU 58 HD23 LEU 58 -1.481 -13.980 7.540 463 H ALA 59 H ALA 59 -1.332 -13.120 2.614 464 HA ALA 59 HA ALA 59 -0.352 -10.509 3.005 465 HB1 ALA 59 HB1 ALA 59 0.363 -12.577 0.940 466 HB2 ALA 59 HB2 ALA 59 1.138 -12.325 2.504 467 HB3 ALA 59 HB3 ALA 59 1.279 -11.100 1.240 468 H VAL 60 H VAL 60 -2.653 -11.731 0.752 469 HA VAL 60 HA VAL 60 -2.292 -9.576 -1.137 470 HB VAL 60 HB VAL 60 -4.362 -10.382 -2.221 471 HG11 VAL 60 HG11 VAL 60 -2.226 -11.315 -2.897 472 HG12 VAL 60 HG12 VAL 60 -3.497 -12.530 -2.995 473 HG13 VAL 60 HG13 VAL 60 -2.356 -12.560 -1.653 474 HG21 VAL 60 HG21 VAL 60 -5.658 -12.135 -1.457 475 HG22 VAL 60 HG22 VAL 60 -5.290 -11.260 0.030 476 HG23 VAL 60 HG23 VAL 60 -4.405 -12.731 -0.374 477 H LEU 61 H LEU 61 -4.120 -10.176 1.720 478 HA LEU 61 HA LEU 61 -6.130 -8.190 1.271 479 HB2 LEU 61 HB2 LEU 61 -6.092 -10.282 2.869 480 HB3 LEU 61 HB3 LEU 61 -5.384 -9.146 3.999 481 HG LEU 61 HG LEU 61 -7.407 -7.668 3.590 482 HD11 LEU 61 HD11 LEU 61 -8.321 -8.498 1.592 483 HD12 LEU 61 HD12 LEU 61 -9.438 -9.002 2.858 484 HD13 LEU 61 HD13 LEU 61 -8.300 -10.162 2.175 485 HD21 LEU 61 HD21 LEU 61 -7.069 -9.057 5.603 486 HD22 LEU 61 HD22 LEU 61 -7.929 -10.374 4.805 487 HD23 LEU 61 HD23 LEU 61 -8.768 -8.867 5.170 488 H THR 62 H THR 62 -3.029 -8.326 2.917 489 HA THR 62 HA THR 62 -3.204 -5.818 4.207 490 HB THR 62 HB THR 62 -0.610 -6.021 4.103 491 HG1 THR 62 HG1 THR 62 0.145 -7.750 3.131 492 HG21 THR 62 HG21 THR 62 -1.784 -6.496 6.125 493 HG22 THR 62 HG22 THR 62 -0.651 -7.816 5.840 494 HG23 THR 62 HG23 THR 62 -2.368 -8.034 5.490 495 H ALA 63 H ALA 63 -1.845 -6.849 1.119 496 HA ALA 63 HA ALA 63 -0.707 -4.432 0.310 497 HB1 ALA 63 HB1 ALA 63 -0.672 -5.367 -1.907 498 HB2 ALA 63 HB2 ALA 63 -1.909 -6.547 -1.471 499 HB3 ALA 63 HB3 ALA 63 -0.308 -6.640 -0.742 500 H VAL 64 H VAL 64 -3.944 -5.741 -0.373 501 HA VAL 64 HA VAL 64 -4.737 -3.505 -1.927 502 HB VAL 64 HB VAL 64 -5.708 -5.840 -2.034 503 HG11 VAL 64 HG11 VAL 64 -7.355 -4.871 0.291 504 HG12 VAL 64 HG12 VAL 64 -6.117 -6.123 0.366 505 HG13 VAL 64 HG13 VAL 64 -7.572 -6.380 -0.596 506 HG21 VAL 64 HG21 VAL 64 -6.654 -3.993 -3.270 507 HG22 VAL 64 HG22 VAL 64 -7.590 -3.497 -1.861 508 HG23 VAL 64 HG23 VAL 64 -7.939 -5.034 -2.657 509 H GLN 65 H GLN 65 -4.879 -4.198 1.506 510 HA GLN 65 HA GLN 65 -6.799 -2.162 2.103 511 HB2 GLN 65 HB2 GLN 65 -6.081 -4.227 3.534 512 HB3 GLN 65 HB3 GLN 65 -4.815 -3.153 4.121 513 HG2 GLN 65 HG2 GLN 65 -6.936 -1.536 4.431 514 HG3 GLN 65 HG3 GLN 65 -7.731 -3.098 4.627 515 HE21 GLN 65 HE21 GLN 65 -8.155 -2.818 6.787 516 HE22 GLN 65 HE22 GLN 65 -6.920 -2.827 7.998 517 H ILE 66 H ILE 66 -3.272 -2.344 2.103 518 HA ILE 66 HA ILE 66 -2.787 0.187 3.251 519 HB ILE 66 HB ILE 66 -1.117 -1.498 1.381 520 HG12 ILE 66 HG12 ILE 66 -0.735 -0.923 4.320 521 HG13 ILE 66 HG13 ILE 66 -1.641 -2.309 3.726 522 HG21 ILE 66 HG21 ILE 66 -0.597 0.964 1.246 523 HG22 ILE 66 HG22 ILE 66 0.740 -0.071 1.742 524 HG23 ILE 66 HG23 ILE 66 -0.134 0.875 2.946 525 HD11 ILE 66 HD11 ILE 66 0.397 -3.053 2.528 526 HD12 ILE 66 HD12 ILE 66 0.574 -3.005 4.281 527 HD13 ILE 66 HD13 ILE 66 1.278 -1.729 3.289 528 H ALA 67 H ALA 67 -3.210 -0.881 -0.082 529 HA ALA 67 HA ALA 67 -2.616 1.543 -1.360 530 HB1 ALA 67 HB1 ALA 67 -3.687 0.599 -3.305 531 HB2 ALA 67 HB2 ALA 67 -4.491 -0.614 -2.311 532 HB3 ALA 67 HB3 ALA 67 -2.739 -0.646 -2.491 533 H SER 68 H SER 68 -5.712 0.235 -0.202 534 HA SER 68 HA SER 68 -7.259 2.387 -1.240 535 HB2 SER 68 HB2 SER 68 -8.931 1.403 0.560 536 HB3 SER 68 HB3 SER 68 -8.571 0.524 -0.926 537 HG SER 68 HG SER 68 -7.327 -0.875 0.178 538 H GLU 69 H GLU 69 -5.967 1.653 1.977 539 HA GLU 69 HA GLU 69 -7.170 3.784 3.336 540 HB2 GLU 69 HB2 GLU 69 -4.976 1.906 3.885 541 HB3 GLU 69 HB3 GLU 69 -4.850 3.443 4.725 542 HG2 GLU 69 HG2 GLU 69 -7.237 1.612 4.787 543 HG3 GLU 69 HG3 GLU 69 -6.022 1.768 6.055 544 H TYR 70 H TYR 70 -4.077 3.649 1.612 545 HA TYR 70 HA TYR 70 -3.448 6.374 2.345 546 HB2 TYR 70 HB2 TYR 70 -2.075 4.205 0.853 547 HB3 TYR 70 HB3 TYR 70 -1.629 5.859 0.453 548 HD1 TYR 70 HD2 TYR 70 -1.358 7.355 2.751 549 HD2 TYR 70 HD1 TYR 70 -0.688 3.172 2.354 550 HE1 TYR 70 HE2 TYR 70 0.141 7.419 4.702 551 HE2 TYR 70 HE1 TYR 70 0.810 3.220 4.302 552 HH TYR 70 HH TYR 70 2.155 4.771 5.555 553 H LEU 71 H LEU 71 -5.253 4.861 -0.105 554 HA LEU 71 HA LEU 71 -4.789 6.670 -2.222 555 HB2 LEU 71 HB2 LEU 71 -5.928 4.368 -2.284 556 HB3 LEU 71 HB3 LEU 71 -7.372 5.216 -1.765 557 HG LEU 71 HG LEU 71 -7.131 6.683 -3.819 558 HD11 LEU 71 HD11 LEU 71 -4.841 6.337 -4.404 559 HD12 LEU 71 HD12 LEU 71 -5.838 5.677 -5.696 560 HD13 LEU 71 HD13 LEU 71 -5.079 4.594 -4.532 561 HD21 LEU 71 HD21 LEU 71 -8.088 5.035 -5.342 562 HD22 LEU 71 HD22 LEU 71 -8.785 4.891 -3.733 563 HD23 LEU 71 HD23 LEU 71 -7.569 3.731 -4.279 564 H LYS 72 H LYS 72 -7.102 6.645 0.442 565 HA LYS 72 HA LYS 72 -8.517 8.941 -0.505 566 HB2 LYS 72 HB2 LYS 72 -9.739 8.880 1.536 567 HB3 LYS 72 HB3 LYS 72 -9.485 7.216 1.037 568 HG2 LYS 72 HG2 LYS 72 -7.690 6.982 2.664 569 HG3 LYS 72 HG3 LYS 72 -7.894 8.666 3.147 570 HD2 LYS 72 HD2 LYS 72 -10.299 8.063 3.712 571 HD3 LYS 72 HD3 LYS 72 -9.818 6.376 3.522 572 HE2 LYS 72 HE2 LYS 72 -8.524 8.335 5.418 573 HE3 LYS 72 HE3 LYS 72 -9.768 7.172 5.873 574 HZ1 LYS 72 HZ1 LYS 72 -8.311 5.372 5.307 575 HZ2 LYS 72 HZ2 LYS 72 -7.496 6.414 6.365 576 HZ3 LYS 72 HZ3 LYS 72 -7.137 6.440 4.713 577 H LEU 73 H LEU 73 -5.534 8.504 1.016 578 HA LEU 73 HA LEU 73 -5.485 11.041 2.377 579 HB2 LEU 73 HB2 LEU 73 -4.168 8.922 3.007 580 HB3 LEU 73 HB3 LEU 73 -3.095 9.332 1.689 581 HG LEU 73 HG LEU 73 -2.322 9.986 3.997 582 HD11 LEU 73 HD11 LEU 73 -1.327 10.949 2.014 583 HD12 LEU 73 HD12 LEU 73 -1.434 12.147 3.304 584 HD13 LEU 73 HD13 LEU 73 -2.581 12.187 1.964 585 HD21 LEU 73 HD21 LEU 73 -4.656 10.824 4.648 586 HD22 LEU 73 HD22 LEU 73 -4.209 12.305 3.794 587 HD23 LEU 73 HD23 LEU 73 -3.254 11.758 5.169 588 H LYS 74 H LYS 74 -4.026 9.652 -0.568 589 HA LYS 74 HA LYS 74 -2.793 12.084 -1.362 590 HB2 LYS 74 HB2 LYS 74 -2.394 11.023 -3.503 591 HB3 LYS 74 HB3 LYS 74 -2.057 9.884 -2.210 592 HG2 LYS 74 HG2 LYS 74 -3.478 8.419 -3.070 593 HG3 LYS 74 HG3 LYS 74 -4.781 9.603 -3.036 594 HD2 LYS 74 HD2 LYS 74 -4.553 8.899 -5.290 595 HD3 LYS 74 HD3 LYS 74 -3.863 10.522 -5.193 596 HE2 LYS 74 HE2 LYS 74 -1.617 9.544 -5.062 597 HE3 LYS 74 HE3 LYS 74 -2.313 7.929 -5.151 598 HZ1 LYS 74 HZ1 LYS 74 -3.093 8.388 -7.353 599 HZ2 LYS 74 HZ2 LYS 74 -1.442 8.745 -7.285 600 HZ3 LYS 74 HZ3 LYS 74 -2.577 9.996 -7.268 601 H GLU 75 H GLU 75 -5.980 10.809 -1.645 602 HA GLU 75 HA GLU 75 -6.867 12.489 -3.758 603 HB2 GLU 75 HB2 GLU 75 -8.010 10.385 -3.030 604 HB3 GLU 75 HB3 GLU 75 -8.514 11.218 -1.568 605 HG2 GLU 75 HG2 GLU 75 -10.309 11.163 -3.186 606 HG3 GLU 75 HG3 GLU 75 -9.774 12.820 -2.904 607 H GLU 76 H GLU 76 -6.965 12.680 -0.220 608 HA GLU 76 HA GLU 76 -8.392 15.098 -0.046 609 HB2 GLU 76 HB2 GLU 76 -7.897 13.443 1.827 610 HB3 GLU 76 HB3 GLU 76 -6.305 14.182 1.930 611 HG2 GLU 76 HG2 GLU 76 -7.074 15.939 3.059 612 HG3 GLU 76 HG3 GLU 76 -8.455 16.138 1.983 613 H TYR 77 H TYR 77 -5.010 14.369 -0.553 614 HA TYR 77 HA TYR 77 -3.869 16.868 -0.041 615 HB2 TYR 77 HB2 TYR 77 -2.379 15.059 -0.326 616 HB3 TYR 77 HB3 TYR 77 -3.108 14.584 -1.854 617 HD1 TYR 77 HD1 TYR 77 -1.914 17.950 -0.785 618 HD2 TYR 77 HD2 TYR 77 -1.331 14.621 -3.362 619 HE1 TYR 77 HE1 TYR 77 -0.166 19.195 -1.976 620 HE2 TYR 77 HE2 TYR 77 0.426 15.854 -4.568 621 HH TYR 77 HH TYR 77 2.028 18.284 -3.502 622 H GLN 78 H GLN 78 -4.920 15.518 -3.174 623 HA GLN 78 HA GLN 78 -4.553 18.023 -4.493 624 HB2 GLN 78 HB2 GLN 78 -5.636 16.961 -6.440 625 HB3 GLN 78 HB3 GLN 78 -4.295 16.028 -5.799 626 HG2 GLN 78 HG2 GLN 78 -5.810 14.461 -4.779 627 HG3 GLN 78 HG3 GLN 78 -7.196 15.447 -5.250 628 HE21 GLN 78 HE21 GLN 78 -8.017 13.595 -6.352 629 HE22 GLN 78 HE22 GLN 78 -7.398 13.173 -7.915 630 H ARG 79 H ARG 79 -7.174 16.561 -2.781 631 HA ARG 79 HA ARG 79 -9.302 18.072 -3.901 632 HB2 ARG 79 HB2 ARG 79 -8.911 16.427 -1.459 633 HB3 ARG 79 HB3 ARG 79 -10.199 17.617 -1.399 634 HG2 ARG 79 HG2 ARG 79 -11.325 16.620 -3.234 635 HG3 ARG 79 HG3 ARG 79 -9.948 15.576 -3.592 636 HD2 ARG 79 HD2 ARG 79 -11.842 14.446 -2.404 637 HD3 ARG 79 HD3 ARG 79 -10.280 14.325 -1.595 638 HE ARG 79 HE ARG 79 -12.261 16.351 -0.790 639 HH11 ARG 79 HH11 ARG 79 -10.259 13.583 -0.012 640 HH12 ARG 79 HH12 ARG 79 -10.431 13.780 1.708 641 HH21 ARG 79 HH21 ARG 79 -12.526 16.568 1.486 642 HH22 ARG 79 HH22 ARG 79 -11.740 15.441 2.545 643 H LEU 80 H LEU 80 -6.958 18.622 -1.417 644 HA LEU 80 HA LEU 80 -8.143 20.986 -0.343 645 HB2 LEU 80 HB2 LEU 80 -6.746 19.785 1.107 646 HB3 LEU 80 HB3 LEU 80 -5.475 19.641 -0.090 647 HG LEU 80 HG LEU 80 -5.622 22.357 0.238 648 HD11 LEU 80 HD11 LEU 80 -7.210 22.092 2.093 649 HD12 LEU 80 HD12 LEU 80 -5.687 22.819 2.607 650 HD13 LEU 80 HD13 LEU 80 -6.016 21.123 2.957 651 HD21 LEU 80 HD21 LEU 80 -3.578 21.067 0.126 652 HD22 LEU 80 HD22 LEU 80 -3.893 20.377 1.721 653 HD23 LEU 80 HD23 LEU 80 -3.561 22.101 1.555 654 H ARG 81 H ARG 81 -5.522 20.310 -2.629 655 HA ARG 81 HA ARG 81 -4.800 23.033 -2.977 656 HB2 ARG 81 HB2 ARG 81 -4.281 20.664 -4.778 657 HB3 ARG 81 HB3 ARG 81 -3.511 22.238 -4.923 658 HG2 ARG 81 HG2 ARG 81 -3.095 21.458 -2.276 659 HG3 ARG 81 HG3 ARG 81 -2.829 20.006 -3.240 660 HD2 ARG 81 HD2 ARG 81 -0.730 21.027 -3.162 661 HD3 ARG 81 HD3 ARG 81 -1.371 21.493 -4.735 662 HE ARG 81 HE ARG 81 -2.049 23.481 -2.883 663 HH11 ARG 81 HH11 ARG 81 0.780 22.163 -4.460 664 HH12 ARG 81 HH12 ARG 81 1.685 23.640 -4.354 665 HH21 ARG 81 HH21 ARG 81 -0.840 25.440 -2.736 666 HH22 ARG 81 HH22 ARG 81 0.773 25.491 -3.370 667 H GLU 82 H GLU 82 -6.955 20.842 -4.753 668 HA GLU 82 HA GLU 82 -7.488 22.638 -6.883 669 HB2 GLU 82 HB2 GLU 82 -9.122 21.129 -7.591 670 HB3 GLU 82 HB3 GLU 82 -7.959 20.107 -6.761 671 HG2 GLU 82 HG2 GLU 82 -9.370 20.051 -4.798 672 HG3 GLU 82 HG3 GLU 82 -10.517 21.142 -5.564 673 H GLN 83 H GLN 83 -8.583 22.470 -3.636 674 HA GLN 83 HA GLN 83 -11.026 23.914 -3.991 675 HB2 GLN 83 HB2 GLN 83 -10.289 22.389 -2.024 676 HB3 GLN 83 HB3 GLN 83 -9.466 23.822 -1.424 677 HG2 GLN 83 HG2 GLN 83 -11.538 25.026 -1.298 678 HG3 GLN 83 HG3 GLN 83 -12.404 23.691 -2.059 679 HE21 GLN 83 HE21 GLN 83 -12.808 21.828 -0.881 680 HE22 GLN 83 HE22 GLN 83 -12.691 21.790 0.845 681 H LEU 84 H LEU 84 -7.692 24.731 -3.590 682 HA LEU 84 HA LEU 84 -8.272 27.538 -3.055 683 HB2 LEU 84 HB2 LEU 84 -6.238 25.874 -2.278 684 HB3 LEU 84 HB3 LEU 84 -5.495 26.736 -3.611 685 HG LEU 84 HG LEU 84 -6.820 28.143 -1.287 686 HD11 LEU 84 HD11 LEU 84 -4.993 26.838 -0.380 687 HD12 LEU 84 HD12 LEU 84 -4.554 28.544 -0.417 688 HD13 LEU 84 HD13 LEU 84 -3.905 27.444 -1.630 689 HD21 LEU 84 HD21 LEU 84 -6.484 29.356 -3.469 690 HD22 LEU 84 HD22 LEU 84 -4.748 29.184 -3.204 691 HD23 LEU 84 HD23 LEU 84 -5.731 30.092 -2.055 692 H LYS 85 H LYS 85 -7.275 25.413 -5.618 693 HA LYS 85 HA LYS 85 -6.575 27.594 -7.390 694 HB2 LYS 85 HB2 LYS 85 -6.689 24.605 -7.799 695 HB3 LYS 85 HB3 LYS 85 -6.214 25.747 -9.048 696 HG2 LYS 85 HG2 LYS 85 -4.200 26.198 -8.069 697 HG3 LYS 85 HG3 LYS 85 -4.782 25.834 -6.444 698 HD2 LYS 85 HD2 LYS 85 -3.250 24.104 -7.102 699 HD3 LYS 85 HD3 LYS 85 -4.877 23.428 -7.081 700 HE2 LYS 85 HE2 LYS 85 -4.991 23.797 -9.542 701 HE3 LYS 85 HE3 LYS 85 -3.304 24.301 -9.499 702 HZ1 LYS 85 HZ1 LYS 85 -3.545 21.981 -10.129 703 HZ2 LYS 85 HZ2 LYS 85 -4.322 21.642 -8.668 704 HZ3 LYS 85 HZ3 LYS 85 -2.701 22.124 -8.671 705 H LYS 86 H LYS 86 -8.247 28.740 -8.148 706 HA LYS 86 HA LYS 86 -10.720 27.382 -8.871 707 HB2 LYS 86 HB2 LYS 86 -10.711 29.536 -7.547 708 HB3 LYS 86 HB3 LYS 86 -10.111 30.339 -8.990 709 HG2 LYS 86 HG2 LYS 86 -12.117 29.825 -10.189 710 HG3 LYS 86 HG3 LYS 86 -12.700 28.811 -8.870 711 HD2 LYS 86 HD2 LYS 86 -13.854 30.883 -8.712 712 HD3 LYS 86 HD3 LYS 86 -12.664 30.857 -7.411 713 HE2 LYS 86 HE2 LYS 86 -12.586 33.023 -8.379 714 HE3 LYS 86 HE3 LYS 86 -11.141 32.171 -8.918 715 HZ1 LYS 86 HZ1 LYS 86 -12.199 31.738 -11.029 716 HZ2 LYS 86 HZ2 LYS 86 -12.219 33.398 -10.711 717 HZ3 LYS 86 HZ3 LYS 86 -13.624 32.486 -10.511 718 H1 GLY 1 H1 GLY 1 -18.209 19.522 15.604 719 H2 GLY 1 H2 GLY 1 -18.631 18.012 16.229 720 H3 GLY 1 H3 GLY 1 -18.624 19.367 17.236 721 HA2 GLY 1 HA3 GLY 1 -20.417 20.349 15.897 722 HA3 GLY 1 HA2 GLY 1 -20.471 18.852 14.979 723 H SER 2 H SER 2 -21.534 17.108 15.801 724 HA SER 2 HA SER 2 -23.320 17.585 18.002 725 HB2 SER 2 HB2 SER 2 -22.892 14.996 16.492 726 HB3 SER 2 HB3 SER 2 -24.324 15.488 17.395 727 HG SER 2 HG SER 2 -24.922 16.050 15.434 728 H HIS 3 H HIS 3 -23.570 15.958 19.777 729 HA HIS 3 HA HIS 3 -21.140 15.643 21.193 730 HB2 HIS 3 HB2 HIS 3 -23.970 14.839 21.639 731 HB3 HIS 3 HB3 HIS 3 -22.740 13.977 22.556 732 HD1 HIS 3 HD1 HIS 3 -24.356 17.334 22.201 733 HD2 HIS 3 HD2 HIS 3 -21.455 15.484 24.534 734 HE1 HIS 3 HE1 HIS 3 -23.900 18.920 24.098 735 HE2 HIS 3 HE2 HIS 3 -22.271 17.705 25.582 736 H MET 4 H MET 4 -23.123 13.470 19.293 737 HA MET 4 HA MET 4 -20.944 11.497 19.384 738 HB2 MET 4 HB2 MET 4 -23.136 10.795 20.482 739 HB3 MET 4 HB3 MET 4 -23.845 10.838 18.873 740 HG2 MET 4 HG2 MET 4 -21.671 9.304 18.419 741 HG3 MET 4 HG3 MET 4 -22.028 8.881 20.090 742 HE1 MET 4 HE1 MET 4 -22.936 8.539 16.403 743 HE2 MET 4 HE2 MET 4 -24.207 9.683 16.832 744 HE3 MET 4 HE3 MET 4 -24.622 8.024 16.396 745 H THR 5 H THR 5 -20.030 11.075 17.461 746 HA THR 5 HA THR 5 -21.543 11.280 15.015 747 HB THR 5 HB THR 5 -20.864 13.627 15.409 748 HG1 THR 5 HG1 THR 5 -20.987 13.230 13.267 749 HG21 THR 5 HG21 THR 5 -18.821 13.251 16.675 750 HG22 THR 5 HG22 THR 5 -18.489 14.242 15.255 751 HG23 THR 5 HG23 THR 5 -18.053 12.535 15.256 752 H GLU 6 H GLU 6 -20.293 10.545 13.154 753 HA GLU 6 HA GLU 6 -17.711 9.397 13.475 754 HB2 GLU 6 HB2 GLU 6 -19.209 7.752 14.703 755 HB3 GLU 6 HB3 GLU 6 -19.970 7.415 13.155 756 HG2 GLU 6 HG2 GLU 6 -17.894 6.604 12.254 757 HG3 GLU 6 HG3 GLU 6 -17.036 7.066 13.723 758 H GLN 7 H GLN 7 -16.841 8.794 11.501 759 HA GLN 7 HA GLN 7 -18.140 9.896 9.202 760 HB2 GLN 7 HB2 GLN 7 -15.500 8.564 9.716 761 HB3 GLN 7 HB3 GLN 7 -16.053 8.777 8.061 762 HG2 GLN 7 HG2 GLN 7 -14.660 10.613 8.559 763 HG3 GLN 7 HG3 GLN 7 -16.316 11.219 8.564 764 HE21 GLN 7 HE21 GLN 7 -13.546 10.420 10.505 765 HE22 GLN 7 HE22 GLN 7 -14.059 11.245 11.935 766 HA PRO 8 HA PRO 8 -20.275 6.326 7.756 767 HB2 PRO 8 HB2 PRO 8 -20.106 6.742 5.052 768 HB3 PRO 8 HB3 PRO 8 -21.241 7.586 6.111 769 HG2 PRO 8 HG2 PRO 8 -18.603 8.503 5.041 770 HG3 PRO 8 HG3 PRO 8 -20.118 9.410 5.214 771 HD2 PRO 8 HD2 PRO 8 -18.084 9.684 6.962 772 HD3 PRO 8 HD3 PRO 8 -19.780 9.784 7.474 773 H LYS 9 H LYS 9 -19.372 4.372 7.914 774 HA LYS 9 HA LYS 9 -17.088 3.711 6.178 775 HB2 LYS 9 HB2 LYS 9 -17.754 2.617 8.919 776 HB3 LYS 9 HB3 LYS 9 -16.442 2.047 7.899 777 HG2 LYS 9 HG2 LYS 9 -15.286 4.127 8.096 778 HG3 LYS 9 HG3 LYS 9 -16.666 4.882 8.896 779 HD2 LYS 9 HD2 LYS 9 -15.187 4.391 10.639 780 HD3 LYS 9 HD3 LYS 9 -16.364 3.082 10.692 781 HE2 LYS 9 HE2 LYS 9 -14.771 1.701 9.341 782 HE3 LYS 9 HE3 LYS 9 -13.588 2.993 9.522 783 HZ1 LYS 9 HZ1 LYS 9 -13.146 1.411 11.193 784 HZ2 LYS 9 HZ2 LYS 9 -14.768 1.315 11.653 785 HZ3 LYS 9 HZ3 LYS 9 -13.884 2.717 11.974 786 H THR 10 H THR 10 -17.041 1.538 5.362 787 HA THR 10 HA THR 10 -19.233 -0.238 5.727 788 HB THR 10 HB THR 10 -20.185 1.590 4.209 789 HG1 THR 10 HG1 THR 10 -21.433 0.095 3.281 790 HG21 THR 10 HG21 THR 10 -18.252 1.947 2.784 791 HG22 THR 10 HG22 THR 10 -19.625 1.405 1.818 792 HG23 THR 10 HG23 THR 10 -18.329 0.277 2.223 793 H ARG 11 H ARG 11 -18.988 -2.197 4.415 794 HA ARG 11 HA ARG 11 -16.194 -2.568 3.573 795 HB2 ARG 11 HB2 ARG 11 -16.282 -4.820 4.318 796 HB3 ARG 11 HB3 ARG 11 -16.967 -3.850 5.612 797 HG2 ARG 11 HG2 ARG 11 -19.239 -4.434 4.557 798 HG3 ARG 11 HG3 ARG 11 -18.352 -5.703 3.711 799 HD2 ARG 11 HD2 ARG 11 -19.044 -6.826 5.597 800 HD3 ARG 11 HD3 ARG 11 -17.456 -6.255 6.106 801 HE ARG 11 HE ARG 11 -18.480 -4.685 7.507 802 HH11 ARG 11 HH11 ARG 11 -20.835 -6.591 5.745 803 HH12 ARG 11 HH12 ARG 11 -22.160 -6.113 6.755 804 HH21 ARG 11 HH21 ARG 11 -20.223 -4.057 8.835 805 HH22 ARG 11 HH22 ARG 11 -21.814 -4.665 8.512 806 H VAL 12 H VAL 12 -15.755 -3.687 1.693 807 HA VAL 12 HA VAL 12 -18.046 -4.369 -0.021 808 HB VAL 12 HB VAL 12 -17.180 -2.069 -0.563 809 HG11 VAL 12 HG11 VAL 12 -14.687 -3.624 -1.171 810 HG12 VAL 12 HG12 VAL 12 -14.875 -2.178 -0.178 811 HG13 VAL 12 HG13 VAL 12 -15.024 -2.069 -1.932 812 HG21 VAL 12 HG21 VAL 12 -16.840 -4.113 -2.754 813 HG22 VAL 12 HG22 VAL 12 -17.144 -2.390 -2.973 814 HG23 VAL 12 HG23 VAL 12 -18.372 -3.415 -2.227 815 H SER 13 H SER 13 -17.614 -5.973 -1.586 816 HA SER 13 HA SER 13 -15.202 -7.545 -1.047 817 HB2 SER 13 HB2 SER 13 -17.734 -8.431 -2.450 818 HB3 SER 13 HB3 SER 13 -16.405 -9.462 -1.918 819 HG SER 13 HG SER 13 -16.928 -8.923 0.235 820 H VAL 14 H VAL 14 -13.728 -7.903 -2.613 821 HA VAL 14 HA VAL 14 -14.383 -7.142 -5.369 822 HB VAL 14 HB VAL 14 -11.984 -6.186 -5.476 823 HG11 VAL 14 HG11 VAL 14 -12.793 -3.947 -4.856 824 HG12 VAL 14 HG12 VAL 14 -14.194 -4.684 -4.082 825 HG13 VAL 14 HG13 VAL 14 -13.968 -4.837 -5.824 826 HG21 VAL 14 HG21 VAL 14 -11.185 -5.149 -3.421 827 HG22 VAL 14 HG22 VAL 14 -11.296 -6.899 -3.234 828 HG23 VAL 14 HG23 VAL 14 -12.531 -5.856 -2.528 829 H ARG 15 H ARG 15 -12.612 -7.860 -6.894 830 HA ARG 15 HA ARG 15 -11.771 -10.551 -6.092 831 HB2 ARG 15 HB2 ARG 15 -13.267 -10.265 -8.085 832 HB3 ARG 15 HB3 ARG 15 -11.951 -9.411 -8.878 833 HG2 ARG 15 HG2 ARG 15 -10.749 -11.739 -8.058 834 HG3 ARG 15 HG3 ARG 15 -12.374 -12.269 -8.493 835 HD2 ARG 15 HD2 ARG 15 -11.350 -12.454 -10.519 836 HD3 ARG 15 HD3 ARG 15 -11.899 -10.785 -10.634 837 HE ARG 15 HE ARG 15 -9.535 -10.265 -9.775 838 HH11 ARG 15 HH11 ARG 15 -10.351 -12.966 -11.851 839 HH12 ARG 15 HH12 ARG 15 -8.763 -13.082 -12.542 840 HH21 ARG 15 HH21 ARG 15 -7.420 -10.421 -10.680 841 HH22 ARG 15 HH22 ARG 15 -7.115 -11.636 -11.891 842 H ILE 16 H ILE 16 -9.681 -10.992 -5.799 843 HA ILE 16 HA ILE 16 -7.669 -9.364 -7.189 844 HB ILE 16 HB ILE 16 -7.709 -10.000 -4.236 845 HG12 ILE 16 HG12 ILE 16 -6.911 -7.345 -4.795 846 HG13 ILE 16 HG13 ILE 16 -8.307 -7.680 -5.814 847 HG21 ILE 16 HG21 ILE 16 -5.444 -9.063 -4.116 848 HG22 ILE 16 HG22 ILE 16 -5.394 -8.978 -5.877 849 HG23 ILE 16 HG23 ILE 16 -5.497 -10.545 -5.070 850 HD11 ILE 16 HD11 ILE 16 -8.188 -8.025 -2.828 851 HD12 ILE 16 HD12 ILE 16 -9.586 -8.345 -3.853 852 HD13 ILE 16 HD13 ILE 16 -8.970 -6.702 -3.692 853 H TYR 17 H TYR 17 -6.504 -10.664 -8.389 854 HA TYR 17 HA TYR 17 -5.411 -12.461 -9.203 855 HB2 TYR 17 HB2 TYR 17 -4.594 -12.205 -6.513 856 HB3 TYR 17 HB3 TYR 17 -4.798 -13.928 -6.816 857 HD1 TYR 17 HD1 TYR 17 -3.478 -11.021 -8.775 858 HD2 TYR 17 HD2 TYR 17 -2.830 -14.988 -7.372 859 HE1 TYR 17 HE1 TYR 17 -1.317 -11.080 -9.945 860 HE2 TYR 17 HE2 TYR 17 -0.663 -15.050 -8.537 861 HH TYR 17 HH TYR 17 0.844 -12.290 -9.768 862 H GLY 18 H GLY 18 -8.170 -12.704 -9.113 863 HA2 GLY 18 HA2 GLY 18 -9.482 -14.472 -9.929 864 HA3 GLY 18 HA3 GLY 18 -8.373 -15.610 -9.190 865 H GLN 19 H GLN 19 -8.446 -14.394 -6.555 866 HA GLN 19 HA GLN 19 -10.940 -15.610 -5.687 867 HB2 GLN 19 HB2 GLN 19 -8.497 -14.643 -4.218 868 HB3 GLN 19 HB3 GLN 19 -9.951 -15.169 -3.379 869 HG2 GLN 19 HG2 GLN 19 -8.289 -16.836 -5.251 870 HG3 GLN 19 HG3 GLN 19 -8.298 -16.940 -3.491 871 HE21 GLN 19 HE21 GLN 19 -10.192 -17.714 -2.446 872 HE22 GLN 19 HE22 GLN 19 -11.309 -18.725 -3.293 873 H ASP 20 H ASP 20 -12.220 -14.595 -3.965 874 HA ASP 20 HA ASP 20 -12.471 -11.698 -4.419 875 HB2 ASP 20 HB2 ASP 20 -14.589 -13.701 -3.597 876 HB3 ASP 20 HB3 ASP 20 -14.845 -11.968 -3.737 877 H TYR 21 H TYR 21 -12.342 -10.358 -2.691 878 HA TYR 21 HA TYR 21 -12.384 -11.562 -0.003 879 HB2 TYR 21 HB2 TYR 21 -10.411 -9.443 -0.875 880 HB3 TYR 21 HB3 TYR 21 -10.476 -10.250 0.686 881 HD1 TYR 21 HD1 TYR 21 -9.913 -12.710 0.805 882 HD2 TYR 21 HD2 TYR 21 -9.212 -10.361 -2.673 883 HE1 TYR 21 HE1 TYR 21 -8.333 -14.407 -0.016 884 HE2 TYR 21 HE2 TYR 21 -7.629 -12.053 -3.503 885 HH TYR 21 HH TYR 21 -6.288 -13.847 -2.753 886 H THR 22 H THR 22 -13.037 -10.175 1.677 887 HA THR 22 HA THR 22 -14.486 -7.796 0.750 888 HB THR 22 HB THR 22 -14.955 -9.342 3.305 889 HG1 THR 22 HG1 THR 22 -16.291 -10.589 2.201 890 HG21 THR 22 HG21 THR 22 -15.708 -6.982 3.313 891 HG22 THR 22 HG22 THR 22 -17.052 -8.120 3.408 892 HG23 THR 22 HG23 THR 22 -16.684 -7.313 1.883 893 H ILE 23 H ILE 23 -13.751 -5.891 1.342 894 HA ILE 23 HA ILE 23 -12.008 -5.701 3.711 895 HB ILE 23 HB ILE 23 -10.753 -3.893 2.414 896 HG12 ILE 23 HG12 ILE 23 -12.020 -5.346 0.077 897 HG13 ILE 23 HG13 ILE 23 -12.390 -3.698 0.569 898 HG21 ILE 23 HG21 ILE 23 -9.198 -5.479 1.495 899 HG22 ILE 23 HG22 ILE 23 -10.446 -6.722 1.428 900 HG23 ILE 23 HG23 ILE 23 -9.869 -6.138 2.987 901 HD11 ILE 23 HD11 ILE 23 -10.949 -3.426 -1.209 902 HD12 ILE 23 HD12 ILE 23 -9.933 -4.780 -0.723 903 HD13 ILE 23 HD13 ILE 23 -9.878 -3.268 0.186 904 H VAL 24 H VAL 24 -11.701 -3.334 4.349 905 HA VAL 24 HA VAL 24 -14.347 -2.079 4.344 906 HB VAL 24 HB VAL 24 -11.983 -1.411 6.101 907 HG11 VAL 24 HG11 VAL 24 -13.610 -0.266 7.491 908 HG12 VAL 24 HG12 VAL 24 -14.907 -0.733 6.392 909 HG13 VAL 24 HG13 VAL 24 -13.649 0.379 5.851 910 HG21 VAL 24 HG21 VAL 24 -14.351 -3.178 6.712 911 HG22 VAL 24 HG22 VAL 24 -13.099 -2.696 7.858 912 HG23 VAL 24 HG23 VAL 24 -12.687 -3.719 6.482 913 H GLY 25 H GLY 25 -14.686 -0.417 3.015 914 HA2 GLY 25 HA2 GLY 25 -12.387 1.315 2.362 915 HA3 GLY 25 HA3 GLY 25 -13.497 0.762 1.118 916 H ALA 26 H ALA 26 -13.104 2.832 3.902 917 HA ALA 26 HA ALA 26 -15.755 3.976 3.625 918 HB1 ALA 26 HB1 ALA 26 -14.726 3.642 5.849 919 HB2 ALA 26 HB2 ALA 26 -15.176 5.321 5.549 920 HB3 ALA 26 HB3 ALA 26 -13.488 4.824 5.426 921 H GLU 27 H GLU 27 -14.929 4.442 1.280 922 HA GLU 27 HA GLU 27 -14.096 7.245 1.268 923 HB2 GLU 27 HB2 GLU 27 -12.066 6.100 0.790 924 HB3 GLU 27 HB3 GLU 27 -12.850 5.028 -0.356 925 HG2 GLU 27 HG2 GLU 27 -11.421 6.800 -1.363 926 HG3 GLU 27 HG3 GLU 27 -13.081 6.767 -1.950 927 H SER 28 H SER 28 -14.665 5.036 -1.478 928 HA SER 28 HA SER 28 -17.324 5.909 -1.933 929 HB2 SER 28 HB2 SER 28 -17.026 7.320 -3.847 930 HB3 SER 28 HB3 SER 28 -15.979 7.961 -2.585 931 HG SER 28 HG SER 28 -15.105 7.666 -4.827 932 HA PRO 29 HA PRO 29 -17.524 2.165 -4.205 933 HB2 PRO 29 HB2 PRO 29 -19.055 3.014 -6.382 934 HB3 PRO 29 HB3 PRO 29 -19.682 2.439 -4.835 935 HG2 PRO 29 HG2 PRO 29 -19.275 5.238 -5.795 936 HG3 PRO 29 HG3 PRO 29 -20.586 4.567 -4.806 937 HD2 PRO 29 HD2 PRO 29 -18.642 6.023 -3.696 938 HD3 PRO 29 HD3 PRO 29 -19.306 4.602 -2.862 939 H ALA 30 H ALA 30 -16.824 5.043 -6.181 940 HA ALA 30 HA ALA 30 -15.648 3.509 -8.291 941 HB1 ALA 30 HB1 ALA 30 -15.390 6.458 -7.753 942 HB2 ALA 30 HB2 ALA 30 -16.684 5.699 -8.679 943 HB3 ALA 30 HB3 ALA 30 -15.021 5.623 -9.261 944 H HIS 31 H HIS 31 -14.352 5.393 -5.577 945 HA HIS 31 HA HIS 31 -11.634 5.177 -6.297 946 HB2 HIS 31 HB2 HIS 31 -13.117 5.835 -3.804 947 HB3 HIS 31 HB3 HIS 31 -11.428 5.389 -3.636 948 HD1 HIS 31 HD1 HIS 31 -13.120 8.285 -3.454 949 HD2 HIS 31 HD2 HIS 31 -10.122 7.095 -6.084 950 HE1 HIS 31 HE1 HIS 31 -12.081 10.404 -4.298 951 HE2 HIS 31 HE2 HIS 31 -10.118 9.665 -5.690 952 H ILE 32 H ILE 32 -13.686 3.163 -4.216 953 HA ILE 32 HA ILE 32 -11.571 1.367 -3.526 954 HB ILE 32 HB ILE 32 -13.242 -0.005 -2.471 955 HG12 ILE 32 HG12 ILE 32 -15.271 1.726 -3.916 956 HG13 ILE 32 HG13 ILE 32 -14.981 0.013 -4.173 957 HG21 ILE 32 HG21 ILE 32 -14.058 1.542 -0.854 958 HG22 ILE 32 HG22 ILE 32 -14.025 2.867 -2.016 959 HG23 ILE 32 HG23 ILE 32 -12.515 2.165 -1.437 960 HD11 ILE 32 HD11 ILE 32 -15.659 -0.223 -1.692 961 HD12 ILE 32 HD12 ILE 32 -16.907 0.041 -2.908 962 HD13 ILE 32 HD13 ILE 32 -16.354 1.383 -1.907 963 H ARG 33 H ARG 33 -13.406 1.733 -6.323 964 HA ARG 33 HA ARG 33 -13.564 -1.031 -7.078 965 HB2 ARG 33 HB2 ARG 33 -14.922 1.123 -7.898 966 HB3 ARG 33 HB3 ARG 33 -13.676 1.117 -9.139 967 HG2 ARG 33 HG2 ARG 33 -15.227 -0.180 -10.165 968 HG3 ARG 33 HG3 ARG 33 -14.352 -1.436 -9.286 969 HD2 ARG 33 HD2 ARG 33 -16.635 -1.853 -8.886 970 HD3 ARG 33 HD3 ARG 33 -16.021 -1.098 -7.416 971 HE ARG 33 HE ARG 33 -17.098 0.842 -9.192 972 HH11 ARG 33 HH11 ARG 33 -18.041 -1.640 -6.912 973 HH12 ARG 33 HH12 ARG 33 -19.551 -0.885 -6.516 974 HH21 ARG 33 HH21 ARG 33 -19.088 1.839 -8.676 975 HH22 ARG 33 HH22 ARG 33 -20.146 1.092 -7.519 976 H LEU 34 H LEU 34 -11.484 1.705 -7.933 977 HA LEU 34 HA LEU 34 -9.934 0.188 -9.792 978 HB2 LEU 34 HB2 LEU 34 -8.646 2.132 -10.109 979 HB3 LEU 34 HB3 LEU 34 -10.296 2.670 -9.867 980 HG LEU 34 HG LEU 34 -9.180 2.749 -7.318 981 HD11 LEU 34 HD11 LEU 34 -7.165 4.172 -7.691 982 HD12 LEU 34 HD12 LEU 34 -7.215 3.715 -9.393 983 HD13 LEU 34 HD13 LEU 34 -6.948 2.486 -8.156 984 HD21 LEU 34 HD21 LEU 34 -9.481 5.118 -7.530 985 HD22 LEU 34 HD22 LEU 34 -10.776 4.321 -8.420 986 HD23 LEU 34 HD23 LEU 34 -9.409 5.021 -9.287 987 H VAL 35 H VAL 35 -9.814 0.605 -6.378 988 HA VAL 35 HA VAL 35 -7.096 0.284 -5.845 989 HB VAL 35 HB VAL 35 -9.463 -0.695 -4.238 990 HG11 VAL 35 HG11 VAL 35 -7.990 -0.903 -2.356 991 HG12 VAL 35 HG12 VAL 35 -6.629 -0.289 -3.292 992 HG13 VAL 35 HG13 VAL 35 -7.328 -1.861 -3.681 993 HG21 VAL 35 HG21 VAL 35 -7.755 1.766 -3.900 994 HG22 VAL 35 HG22 VAL 35 -9.167 1.318 -2.941 995 HG23 VAL 35 HG23 VAL 35 -9.353 1.741 -4.643 996 H ALA 36 H ALA 36 -9.607 -2.190 -6.253 997 HA ALA 36 HA ALA 36 -7.973 -4.416 -5.733 998 HB1 ALA 36 HB1 ALA 36 -10.439 -4.452 -5.723 999 HB2 ALA 36 HB2 ALA 36 -9.737 -5.740 -6.705 1000 HB3 ALA 36 HB3 ALA 36 -10.425 -4.312 -7.480 1001 H ALA 37 H ALA 37 -8.869 -2.855 -8.793 1002 HA ALA 37 HA ALA 37 -7.526 -4.659 -10.489 1003 HB1 ALA 37 HB1 ALA 37 -9.264 -3.088 -11.247 1004 HB2 ALA 37 HB2 ALA 37 -7.792 -2.974 -12.212 1005 HB3 ALA 37 HB3 ALA 37 -8.144 -1.751 -10.991 1006 H PHE 38 H PHE 38 -6.505 -1.715 -8.872 1007 HA PHE 38 HA PHE 38 -4.027 -1.387 -10.153 1008 HB2 PHE 38 HB2 PHE 38 -4.860 0.466 -8.965 1009 HB3 PHE 38 HB3 PHE 38 -5.153 -0.483 -7.515 1010 HD1 PHE 38 HD2 PHE 38 -2.161 0.155 -9.674 1011 HD2 PHE 38 HD1 PHE 38 -3.862 0.200 -5.773 1012 HE1 PHE 38 HE2 PHE 38 -0.007 0.905 -8.750 1013 HE2 PHE 38 HE1 PHE 38 -1.711 0.947 -4.840 1014 HZ PHE 38 HZ PHE 38 0.219 1.300 -6.326 1015 H VAL 39 H VAL 39 -4.885 -3.068 -7.129 1016 HA VAL 39 HA VAL 39 -2.177 -3.859 -6.648 1017 HB VAL 39 HB VAL 39 -3.995 -3.566 -4.884 1018 HG11 VAL 39 HG11 VAL 39 -4.718 -6.340 -5.815 1019 HG12 VAL 39 HG12 VAL 39 -5.747 -4.908 -5.843 1020 HG13 VAL 39 HG13 VAL 39 -5.254 -5.611 -4.300 1021 HG21 VAL 39 HG21 VAL 39 -3.028 -5.377 -3.476 1022 HG22 VAL 39 HG22 VAL 39 -1.830 -4.390 -4.308 1023 HG23 VAL 39 HG23 VAL 39 -2.219 -5.998 -4.915 1024 H ASP 40 H ASP 40 -4.911 -5.298 -8.294 1025 HA ASP 40 HA ASP 40 -3.945 -7.953 -8.410 1026 HB2 ASP 40 HB2 ASP 40 -6.308 -7.160 -8.904 1027 HB3 ASP 40 HB3 ASP 40 -5.714 -6.624 -10.472 1028 H ASP 41 H ASP 41 -3.565 -5.162 -10.549 1029 HA ASP 41 HA ASP 41 -2.120 -6.585 -12.550 1030 HB2 ASP 41 HB2 ASP 41 -3.323 -4.444 -12.985 1031 HB3 ASP 41 HB3 ASP 41 -2.104 -3.608 -12.027 1032 H LYS 42 H LYS 42 -1.215 -4.734 -9.706 1033 HA LYS 42 HA LYS 42 1.542 -4.571 -10.222 1034 HB2 LYS 42 HB2 LYS 42 0.369 -3.225 -8.508 1035 HB3 LYS 42 HB3 LYS 42 0.163 -4.676 -7.534 1036 HG2 LYS 42 HG2 LYS 42 2.309 -4.671 -6.830 1037 HG3 LYS 42 HG3 LYS 42 2.924 -4.058 -8.366 1038 HD2 LYS 42 HD2 LYS 42 1.321 -2.299 -6.540 1039 HD3 LYS 42 HD3 LYS 42 3.051 -2.543 -6.280 1040 HE2 LYS 42 HE2 LYS 42 1.762 -1.501 -8.800 1041 HE3 LYS 42 HE3 LYS 42 2.630 -0.537 -7.610 1042 HZ1 LYS 42 HZ1 LYS 42 4.232 -0.907 -9.193 1043 HZ2 LYS 42 HZ2 LYS 42 3.690 -2.466 -9.563 1044 HZ3 LYS 42 HZ3 LYS 42 4.548 -2.183 -8.125 1045 H MET 43 H MET 43 -0.405 -7.033 -8.597 1046 HA MET 43 HA MET 43 1.873 -8.633 -7.886 1047 HB2 MET 43 HB2 MET 43 -1.056 -8.861 -7.591 1048 HB3 MET 43 HB3 MET 43 -0.191 -10.384 -7.742 1049 HG2 MET 43 HG2 MET 43 1.254 -9.734 -5.871 1050 HG3 MET 43 HG3 MET 43 0.338 -8.239 -5.699 1051 HE1 MET 43 HE1 MET 43 -1.992 -8.036 -4.638 1052 HE2 MET 43 HE2 MET 43 -3.097 -9.391 -4.411 1053 HE3 MET 43 HE3 MET 43 -2.614 -8.909 -6.038 1054 H HIS 44 H HIS 44 0.328 -8.033 -10.759 1055 HA HIS 44 HA HIS 44 0.821 -10.690 -11.880 1056 HB2 HIS 44 HB2 HIS 44 -0.872 -8.398 -12.570 1057 HB3 HIS 44 HB3 HIS 44 -0.054 -9.107 -13.955 1058 HD1 HIS 44 HD1 HIS 44 -2.986 -9.507 -11.855 1059 HD2 HIS 44 HD2 HIS 44 -0.600 -11.992 -14.193 1060 HE1 HIS 44 HE1 HIS 44 -4.351 -11.580 -12.258 1061 HE2 HIS 44 HE2 HIS 44 -2.930 -13.025 -13.759 1062 H GLU 45 H GLU 45 2.274 -7.614 -11.631 1063 HA GLU 45 HA GLU 45 3.990 -8.077 -13.954 1064 HB2 GLU 45 HB2 GLU 45 4.683 -5.800 -13.753 1065 HB3 GLU 45 HB3 GLU 45 2.935 -5.834 -13.571 1066 HG2 GLU 45 HG2 GLU 45 3.199 -5.689 -11.125 1067 HG3 GLU 45 HG3 GLU 45 4.948 -5.608 -11.334 1068 H PHE 46 H PHE 46 4.025 -8.283 -10.516 1069 HA PHE 46 HA PHE 46 6.935 -8.308 -10.416 1070 HB2 PHE 46 HB2 PHE 46 4.927 -7.529 -8.607 1071 HB3 PHE 46 HB3 PHE 46 5.687 -8.948 -7.900 1072 HD1 PHE 46 HD1 PHE 46 8.434 -8.807 -8.446 1073 HD2 PHE 46 HD2 PHE 46 5.742 -5.597 -7.701 1074 HE1 PHE 46 HE1 PHE 46 10.311 -7.423 -7.655 1075 HE2 PHE 46 HE2 PHE 46 7.610 -4.208 -6.913 1076 HZ PHE 46 HZ PHE 46 9.897 -5.119 -6.885 1077 H SER 47 H SER 47 4.357 -10.505 -10.725 1078 HA SER 47 HA SER 47 5.465 -12.737 -9.376 1079 HB2 SER 47 HB2 SER 47 3.882 -13.976 -11.071 1080 HB3 SER 47 HB3 SER 47 3.189 -12.965 -9.802 1081 HG SER 47 HG SER 47 2.905 -12.720 -12.427 1082 H GLU 48 H GLU 48 5.694 -11.517 -12.669 1083 HA GLU 48 HA GLU 48 7.242 -13.735 -13.626 1084 HB2 GLU 48 HB2 GLU 48 7.517 -12.360 -15.663 1085 HB3 GLU 48 HB3 GLU 48 5.837 -12.521 -15.174 1086 HG2 GLU 48 HG2 GLU 48 5.592 -10.324 -14.903 1087 HG3 GLU 48 HG3 GLU 48 7.119 -10.174 -14.035 1088 H LYS 49 H LYS 49 8.036 -11.345 -11.529 1089 HA LYS 49 HA LYS 49 10.624 -10.674 -12.606 1090 HB2 LYS 49 HB2 LYS 49 8.960 -9.581 -10.613 1091 HB3 LYS 49 HB3 LYS 49 10.392 -10.136 -9.772 1092 HG2 LYS 49 HG2 LYS 49 10.287 -8.183 -12.065 1093 HG3 LYS 49 HG3 LYS 49 10.632 -7.815 -10.378 1094 HD2 LYS 49 HD2 LYS 49 12.350 -9.624 -12.073 1095 HD3 LYS 49 HD3 LYS 49 12.635 -7.900 -11.897 1096 HE2 LYS 49 HE2 LYS 49 13.072 -8.134 -9.569 1097 HE3 LYS 49 HE3 LYS 49 12.513 -9.804 -9.564 1098 HZ1 LYS 49 HZ1 LYS 49 14.878 -9.814 -9.560 1099 HZ2 LYS 49 HZ2 LYS 49 14.958 -8.748 -10.873 1100 HZ3 LYS 49 HZ3 LYS 49 14.378 -10.318 -11.094 1101 H GLN 50 H GLN 50 9.256 -13.191 -10.818 1102 HA GLN 50 HA GLN 50 10.053 -15.031 -9.758 1103 HB2 GLN 50 HB2 GLN 50 11.291 -15.129 -11.989 1104 HB3 GLN 50 HB3 GLN 50 12.687 -14.496 -11.129 1105 HG2 GLN 50 HG2 GLN 50 12.500 -16.456 -9.580 1106 HG3 GLN 50 HG3 GLN 50 11.276 -17.108 -10.669 1107 HE21 GLN 50 HE21 GLN 50 11.888 -17.854 -12.692 1108 HE22 GLN 50 HE22 GLN 50 13.537 -18.175 -13.100 1109 HA PRO 51 HA PRO 51 12.416 -12.612 -6.628 1110 HB2 PRO 51 HB2 PRO 51 10.393 -12.581 -4.730 1111 HB3 PRO 51 HB3 PRO 51 10.744 -11.280 -5.869 1112 HG2 PRO 51 HG2 PRO 51 8.461 -13.029 -5.788 1113 HG3 PRO 51 HG3 PRO 51 8.765 -11.665 -6.869 1114 HD2 PRO 51 HD2 PRO 51 9.036 -14.527 -7.378 1115 HD3 PRO 51 HD3 PRO 51 9.005 -13.181 -8.534 1116 H MET 52 H MET 52 9.990 -14.551 -4.948 1117 HA MET 52 HA MET 52 12.149 -16.336 -4.042 1118 HB2 MET 52 HB2 MET 52 9.569 -15.757 -2.578 1119 HB3 MET 52 HB3 MET 52 10.973 -16.618 -1.963 1120 HG2 MET 52 HG2 MET 52 10.823 -13.686 -2.631 1121 HG3 MET 52 HG3 MET 52 10.858 -14.399 -1.020 1122 HE1 MET 52 HE1 MET 52 14.343 -12.528 -1.620 1123 HE2 MET 52 HE2 MET 52 12.883 -12.540 -0.633 1124 HE3 MET 52 HE3 MET 52 12.791 -12.089 -2.336 1125 H LEU 53 H LEU 53 9.859 -16.286 -6.231 1126 HA LEU 53 HA LEU 53 8.404 -17.722 -7.225 1127 HB2 LEU 53 HB2 LEU 53 10.696 -19.408 -6.334 1128 HB3 LEU 53 HB3 LEU 53 9.309 -20.184 -7.068 1129 HG LEU 53 HG LEU 53 10.877 -17.976 -8.398 1130 HD11 LEU 53 HD11 LEU 53 12.400 -19.775 -8.161 1131 HD12 LEU 53 HD12 LEU 53 11.777 -19.858 -9.808 1132 HD13 LEU 53 HD13 LEU 53 11.168 -20.964 -8.577 1133 HD21 LEU 53 HD21 LEU 53 8.789 -18.049 -9.423 1134 HD22 LEU 53 HD22 LEU 53 8.655 -19.798 -9.247 1135 HD23 LEU 53 HD23 LEU 53 9.769 -19.116 -10.430 1136 H ASP 54 H ASP 54 7.219 -16.997 -5.054 1137 HA ASP 54 HA ASP 54 5.699 -19.295 -4.242 1138 HB2 ASP 54 HB2 ASP 54 7.776 -18.992 -2.650 1139 HB3 ASP 54 HB3 ASP 54 6.816 -17.681 -1.977 1140 H VAL 55 H VAL 55 3.631 -18.682 -4.032 1141 HA VAL 55 HA VAL 55 2.752 -16.148 -4.719 1142 HB VAL 55 HB VAL 55 1.162 -18.125 -3.090 1143 HG11 VAL 55 HG11 VAL 55 0.316 -15.946 -4.993 1144 HG12 VAL 55 HG12 VAL 55 0.120 -15.938 -3.241 1145 HG13 VAL 55 HG13 VAL 55 -0.766 -17.107 -4.223 1146 HG21 VAL 55 HG21 VAL 55 1.542 -17.948 -6.076 1147 HG22 VAL 55 HG22 VAL 55 0.379 -18.989 -5.257 1148 HG23 VAL 55 HG23 VAL 55 2.106 -19.242 -5.020 1149 HA PRO 56 HA PRO 56 1.740 -15.261 0.007 1150 HB2 PRO 56 HB2 PRO 56 3.632 -16.424 1.677 1151 HB3 PRO 56 HB3 PRO 56 1.971 -16.983 1.458 1152 HG2 PRO 56 HG2 PRO 56 4.491 -17.977 0.192 1153 HG3 PRO 56 HG3 PRO 56 3.090 -18.892 0.777 1154 HD2 PRO 56 HD2 PRO 56 3.455 -18.448 -1.832 1155 HD3 PRO 56 HD3 PRO 56 1.829 -18.415 -1.117 1156 H LYS 57 H LYS 57 5.099 -15.907 -0.956 1157 HA LYS 57 HA LYS 57 6.106 -13.592 0.408 1158 HB2 LYS 57 HB2 LYS 57 7.320 -15.570 -1.500 1159 HB3 LYS 57 HB3 LYS 57 8.201 -14.142 -0.979 1160 HG2 LYS 57 HG2 LYS 57 8.915 -15.364 0.734 1161 HG3 LYS 57 HG3 LYS 57 7.278 -15.238 1.383 1162 HD2 LYS 57 HD2 LYS 57 6.666 -17.293 0.169 1163 HD3 LYS 57 HD3 LYS 57 8.330 -17.433 -0.403 1164 HE2 LYS 57 HE2 LYS 57 9.022 -17.449 2.031 1165 HE3 LYS 57 HE3 LYS 57 7.312 -17.632 2.421 1166 HZ1 LYS 57 HZ1 LYS 57 9.060 -19.510 0.948 1167 HZ2 LYS 57 HZ2 LYS 57 7.371 -19.622 0.874 1168 HZ3 LYS 57 HZ3 LYS 57 8.171 -19.794 2.362 1169 H LEU 58 H LEU 58 4.880 -14.307 -2.748 1170 HA LEU 58 HA LEU 58 5.998 -12.047 -4.077 1171 HB2 LEU 58 HB2 LEU 58 5.240 -14.118 -5.220 1172 HB3 LEU 58 HB3 LEU 58 3.590 -13.740 -4.783 1173 HG LEU 58 HG LEU 58 4.359 -13.280 -7.188 1174 HD11 LEU 58 HD11 LEU 58 2.947 -11.297 -7.376 1175 HD12 LEU 58 HD12 LEU 58 2.988 -11.108 -5.624 1176 HD13 LEU 58 HD13 LEU 58 2.225 -12.528 -6.340 1177 HD21 LEU 58 HD21 LEU 58 5.458 -11.237 -7.662 1178 HD22 LEU 58 HD22 LEU 58 6.456 -12.102 -6.498 1179 HD23 LEU 58 HD23 LEU 58 5.444 -10.752 -5.969 1180 H ALA 59 H ALA 59 2.860 -12.790 -2.645 1181 HA ALA 59 HA ALA 59 1.551 -10.404 -3.293 1182 HB1 ALA 59 HB1 ALA 59 1.101 -12.302 -1.002 1183 HB2 ALA 59 HB2 ALA 59 0.330 -12.343 -2.588 1184 HB3 ALA 59 HB3 ALA 59 -0.008 -11.016 -1.476 1185 H VAL 60 H VAL 60 3.378 -11.275 -0.356 1186 HA VAL 60 HA VAL 60 2.858 -8.800 0.944 1187 HB VAL 60 HB VAL 60 3.547 -10.939 2.105 1188 HG11 VAL 60 HG11 VAL 60 5.845 -11.525 2.294 1189 HG12 VAL 60 HG12 VAL 60 6.345 -10.100 1.386 1190 HG13 VAL 60 HG13 VAL 60 5.476 -11.400 0.572 1191 HG21 VAL 60 HG21 VAL 60 4.808 -9.774 3.857 1192 HG22 VAL 60 HG22 VAL 60 3.450 -8.811 3.274 1193 HG23 VAL 60 HG23 VAL 60 5.092 -8.432 2.750 1194 H LEU 61 H LEU 61 5.149 -9.826 -1.425 1195 HA LEU 61 HA LEU 61 7.135 -7.857 -1.020 1196 HB2 LEU 61 HB2 LEU 61 7.474 -9.899 -2.370 1197 HB3 LEU 61 HB3 LEU 61 6.349 -9.288 -3.566 1198 HG LEU 61 HG LEU 61 7.910 -7.366 -3.949 1199 HD11 LEU 61 HD11 LEU 61 9.658 -8.994 -2.117 1200 HD12 LEU 61 HD12 LEU 61 9.151 -7.316 -1.917 1201 HD13 LEU 61 HD13 LEU 61 10.270 -7.752 -3.208 1202 HD21 LEU 61 HD21 LEU 61 8.991 -10.139 -4.411 1203 HD22 LEU 61 HD22 LEU 61 9.496 -8.681 -5.267 1204 HD23 LEU 61 HD23 LEU 61 7.847 -9.280 -5.442 1205 H THR 62 H THR 62 4.244 -7.989 -3.062 1206 HA THR 62 HA THR 62 4.647 -5.391 -4.165 1207 HB THR 62 HB THR 62 2.101 -5.688 -4.699 1208 HG1 THR 62 HG1 THR 62 2.094 -7.562 -3.110 1209 HG21 THR 62 HG21 THR 62 4.035 -5.937 -6.276 1210 HG22 THR 62 HG22 THR 62 2.647 -6.954 -6.651 1211 HG23 THR 62 HG23 THR 62 4.065 -7.654 -5.871 1212 H ALA 63 H ALA 63 3.082 -6.654 -1.329 1213 HA ALA 63 HA ALA 63 1.429 -4.482 -0.679 1214 HB1 ALA 63 HB1 ALA 63 1.367 -6.759 0.368 1215 HB2 ALA 63 HB2 ALA 63 1.302 -5.421 1.515 1216 HB3 ALA 63 HB3 ALA 63 2.807 -6.310 1.282 1217 H VAL 64 H VAL 64 4.770 -5.235 0.253 1218 HA VAL 64 HA VAL 64 5.067 -2.884 1.830 1219 HB VAL 64 HB VAL 64 6.392 -5.020 2.084 1220 HG11 VAL 64 HG11 VAL 64 7.009 -5.421 -0.203 1221 HG12 VAL 64 HG12 VAL 64 8.465 -5.214 0.768 1222 HG13 VAL 64 HG13 VAL 64 7.901 -3.902 -0.268 1223 HG21 VAL 64 HG21 VAL 64 6.986 -3.021 3.299 1224 HG22 VAL 64 HG22 VAL 64 7.896 -2.413 1.915 1225 HG23 VAL 64 HG23 VAL 64 8.449 -3.853 2.771 1226 H GLN 65 H GLN 65 5.442 -3.570 -1.564 1227 HA GLN 65 HA GLN 65 7.135 -1.350 -2.159 1228 HB2 GLN 65 HB2 GLN 65 6.718 -3.440 -3.608 1229 HB3 GLN 65 HB3 GLN 65 5.247 -2.620 -4.130 1230 HG2 GLN 65 HG2 GLN 65 6.871 -0.630 -4.628 1231 HG3 GLN 65 HG3 GLN 65 8.103 -1.891 -4.644 1232 HE21 GLN 65 HE21 GLN 65 8.533 -1.628 -6.812 1233 HE22 GLN 65 HE22 GLN 65 7.438 -2.113 -8.058 1234 H ILE 66 H ILE 66 3.648 -1.889 -2.199 1235 HA ILE 66 HA ILE 66 2.938 0.622 -3.298 1236 HB ILE 66 HB ILE 66 1.367 -1.237 -1.495 1237 HG12 ILE 66 HG12 ILE 66 1.023 -0.805 -4.460 1238 HG13 ILE 66 HG13 ILE 66 2.144 -2.005 -3.821 1239 HG21 ILE 66 HG21 ILE 66 0.251 0.971 -3.214 1240 HG22 ILE 66 HG22 ILE 66 0.596 1.163 -1.496 1241 HG23 ILE 66 HG23 ILE 66 -0.599 -0.018 -2.026 1242 HD11 ILE 66 HD11 ILE 66 -0.827 -1.920 -3.353 1243 HD12 ILE 66 HD12 ILE 66 0.287 -3.109 -2.675 1244 HD13 ILE 66 HD13 ILE 66 0.040 -3.026 -4.419 1245 H ALA 67 H ALA 67 3.421 -0.562 -0.029 1246 HA ALA 67 HA ALA 67 2.525 1.686 1.387 1247 HB1 ALA 67 HB1 ALA 67 2.893 -0.521 2.401 1248 HB2 ALA 67 HB2 ALA 67 3.728 0.758 3.280 1249 HB3 ALA 67 HB3 ALA 67 4.632 -0.310 2.208 1250 H SER 68 H SER 68 5.727 0.884 0.086 1251 HA SER 68 HA SER 68 7.033 3.091 1.322 1252 HB2 SER 68 HB2 SER 68 8.711 2.496 -0.687 1253 HB3 SER 68 HB3 SER 68 8.612 1.535 0.789 1254 HG SER 68 HG SER 68 7.522 -0.010 -0.260 1255 H GLU 69 H GLU 69 5.965 2.524 -2.032 1256 HA GLU 69 HA GLU 69 6.774 5.047 -2.999 1257 HB2 GLU 69 HB2 GLU 69 5.426 2.768 -4.087 1258 HB3 GLU 69 HB3 GLU 69 4.535 4.215 -4.525 1259 HG2 GLU 69 HG2 GLU 69 7.498 4.077 -4.896 1260 HG3 GLU 69 HG3 GLU 69 6.401 3.376 -6.085 1261 H TYR 70 H TYR 70 3.860 4.066 -1.322 1262 HA TYR 70 HA TYR 70 2.550 6.571 -1.954 1263 HB2 TYR 70 HB2 TYR 70 1.751 4.060 -0.605 1264 HB3 TYR 70 HB3 TYR 70 0.967 5.531 -0.029 1265 HD1 TYR 70 HD1 TYR 70 1.478 3.357 -2.967 1266 HD2 TYR 70 HD2 TYR 70 -0.622 6.694 -1.375 1267 HE1 TYR 70 HE1 TYR 70 -0.056 3.299 -4.886 1268 HE2 TYR 70 HE2 TYR 70 -2.163 6.644 -3.287 1269 HH TYR 70 HH TYR 70 -2.289 4.026 -5.481 1270 H LEU 71 H LEU 71 4.457 5.226 0.643 1271 HA LEU 71 HA LEU 71 3.733 7.165 2.592 1272 HB2 LEU 71 HB2 LEU 71 4.814 4.975 3.114 1273 HB3 LEU 71 HB3 LEU 71 6.298 5.590 2.413 1274 HG LEU 71 HG LEU 71 6.291 7.413 4.150 1275 HD11 LEU 71 HD11 LEU 71 4.930 6.970 6.197 1276 HD12 LEU 71 HD12 LEU 71 4.000 5.802 5.260 1277 HD13 LEU 71 HD13 LEU 71 4.004 7.504 4.796 1278 HD21 LEU 71 HD21 LEU 71 7.711 5.466 4.442 1279 HD22 LEU 71 HD22 LEU 71 6.374 4.582 5.187 1280 HD23 LEU 71 HD23 LEU 71 7.055 5.993 5.990 1281 H LYS 72 H LYS 72 6.360 6.921 0.236 1282 HA LYS 72 HA LYS 72 7.641 9.329 1.024 1283 HB2 LYS 72 HB2 LYS 72 8.925 9.122 -1.026 1284 HB3 LYS 72 HB3 LYS 72 8.793 7.558 -0.237 1285 HG2 LYS 72 HG2 LYS 72 6.889 7.057 -1.834 1286 HG3 LYS 72 HG3 LYS 72 7.369 8.511 -2.707 1287 HD2 LYS 72 HD2 LYS 72 9.407 6.419 -2.071 1288 HD3 LYS 72 HD3 LYS 72 8.306 6.185 -3.424 1289 HE2 LYS 72 HE2 LYS 72 10.003 8.642 -3.068 1290 HE3 LYS 72 HE3 LYS 72 10.511 7.234 -4.001 1291 HZ1 LYS 72 HZ1 LYS 72 8.269 9.085 -4.552 1292 HZ2 LYS 72 HZ2 LYS 72 8.360 7.555 -5.275 1293 HZ3 LYS 72 HZ3 LYS 72 9.580 8.697 -5.548 1294 H LEU 73 H LEU 73 4.791 8.707 -0.647 1295 HA LEU 73 HA LEU 73 4.769 11.166 -2.179 1296 HB2 LEU 73 HB2 LEU 73 3.728 9.187 -3.129 1297 HB3 LEU 73 HB3 LEU 73 2.669 9.040 -1.741 1298 HG LEU 73 HG LEU 73 1.710 11.301 -2.394 1299 HD11 LEU 73 HD11 LEU 73 1.986 11.945 -4.747 1300 HD12 LEU 73 HD12 LEU 73 3.209 10.690 -4.942 1301 HD13 LEU 73 HD13 LEU 73 3.503 12.047 -3.855 1302 HD21 LEU 73 HD21 LEU 73 0.357 10.290 -4.245 1303 HD22 LEU 73 HD22 LEU 73 0.431 9.343 -2.760 1304 HD23 LEU 73 HD23 LEU 73 1.412 8.881 -4.151 1305 H LYS 74 H LYS 74 3.078 9.798 0.647 1306 HA LYS 74 HA LYS 74 1.492 12.101 1.089 1307 HB2 LYS 74 HB2 LYS 74 0.928 11.146 3.236 1308 HB3 LYS 74 HB3 LYS 74 0.888 9.902 2.005 1309 HG2 LYS 74 HG2 LYS 74 1.919 8.799 3.725 1310 HG3 LYS 74 HG3 LYS 74 3.312 9.400 2.827 1311 HD2 LYS 74 HD2 LYS 74 3.826 9.893 5.051 1312 HD3 LYS 74 HD3 LYS 74 3.216 11.417 4.415 1313 HE2 LYS 74 HE2 LYS 74 1.017 10.934 5.411 1314 HE3 LYS 74 HE3 LYS 74 1.656 9.430 6.065 1315 HZ1 LYS 74 HZ1 LYS 74 2.949 12.009 6.687 1316 HZ2 LYS 74 HZ2 LYS 74 3.002 10.554 7.553 1317 HZ3 LYS 74 HZ3 LYS 74 1.593 11.491 7.557 1318 H GLU 75 H GLU 75 4.722 11.212 2.027 1319 HA GLU 75 HA GLU 75 5.056 13.197 4.032 1320 HB2 GLU 75 HB2 GLU 75 6.528 11.062 3.314 1321 HB3 GLU 75 HB3 GLU 75 7.418 12.319 2.461 1322 HG2 GLU 75 HG2 GLU 75 8.513 12.264 4.472 1323 HG3 GLU 75 HG3 GLU 75 7.339 13.549 4.748 1324 H GLU 76 H GLU 76 5.381 13.095 0.581 1325 HA GLU 76 HA GLU 76 6.768 15.509 0.170 1326 HB2 GLU 76 HB2 GLU 76 6.506 13.846 -1.603 1327 HB3 GLU 76 HB3 GLU 76 4.764 14.073 -1.589 1328 HG2 GLU 76 HG2 GLU 76 4.913 15.735 -3.038 1329 HG3 GLU 76 HG3 GLU 76 6.068 16.587 -2.011 1330 H TYR 77 H TYR 77 3.371 14.704 0.475 1331 HA TYR 77 HA TYR 77 2.186 17.131 -0.154 1332 HB2 TYR 77 HB2 TYR 77 0.781 15.243 0.107 1333 HB3 TYR 77 HB3 TYR 77 1.410 14.891 1.708 1334 HD1 TYR 77 HD1 TYR 77 0.260 18.236 0.570 1335 HD2 TYR 77 HD2 TYR 77 -0.641 14.778 2.872 1336 HE1 TYR 77 HE1 TYR 77 -1.662 19.406 1.560 1337 HE2 TYR 77 HE2 TYR 77 -2.562 15.939 3.875 1338 HH TYR 77 HH TYR 77 -3.573 17.959 4.149 1339 H GLN 78 H GLN 78 2.909 15.934 3.123 1340 HA GLN 78 HA GLN 78 2.380 18.400 4.361 1341 HB2 GLN 78 HB2 GLN 78 3.416 17.444 6.363 1342 HB3 GLN 78 HB3 GLN 78 2.287 16.329 5.615 1343 HG2 GLN 78 HG2 GLN 78 4.304 15.228 4.541 1344 HG3 GLN 78 HG3 GLN 78 5.287 16.214 5.623 1345 HE21 GLN 78 HE21 GLN 78 5.359 15.726 7.783 1346 HE22 GLN 78 HE22 GLN 78 4.681 14.284 8.451 1347 H ARG 79 H ARG 79 5.300 17.146 2.910 1348 HA ARG 79 HA ARG 79 7.136 18.902 4.119 1349 HB2 ARG 79 HB2 ARG 79 7.726 16.854 2.820 1350 HB3 ARG 79 HB3 ARG 79 7.330 17.728 1.346 1351 HG2 ARG 79 HG2 ARG 79 9.060 19.411 1.956 1352 HG3 ARG 79 HG3 ARG 79 9.521 18.372 3.306 1353 HD2 ARG 79 HD2 ARG 79 11.018 17.762 1.638 1354 HD3 ARG 79 HD3 ARG 79 9.765 16.530 1.525 1355 HE ARG 79 HE ARG 79 9.990 18.842 -0.297 1356 HH11 ARG 79 HH11 ARG 79 9.145 15.488 0.317 1357 HH12 ARG 79 HH12 ARG 79 8.688 15.180 -1.333 1358 HH21 ARG 79 HH21 ARG 79 9.401 18.409 -2.466 1359 HH22 ARG 79 HH22 ARG 79 8.833 16.820 -2.895 1360 H LEU 80 H LEU 80 5.298 19.199 1.077 1361 HA LEU 80 HA LEU 80 6.477 21.754 0.482 1362 HB2 LEU 80 HB2 LEU 80 5.183 21.774 -1.469 1363 HB3 LEU 80 HB3 LEU 80 5.606 20.093 -1.216 1364 HG LEU 80 HG LEU 80 3.166 20.307 0.065 1365 HD11 LEU 80 HD11 LEU 80 3.009 21.891 -2.496 1366 HD12 LEU 80 HD12 LEU 80 2.834 22.549 -0.868 1367 HD13 LEU 80 HD13 LEU 80 1.655 21.390 -1.483 1368 HD21 LEU 80 HD21 LEU 80 3.852 18.447 -1.307 1369 HD22 LEU 80 HD22 LEU 80 3.760 19.444 -2.760 1370 HD23 LEU 80 HD23 LEU 80 2.294 19.058 -1.860 1371 H ARG 81 H ARG 81 3.851 20.700 2.400 1372 HA ARG 81 HA ARG 81 2.463 23.240 2.268 1373 HB2 ARG 81 HB2 ARG 81 1.951 20.754 3.907 1374 HB3 ARG 81 HB3 ARG 81 0.939 22.194 3.949 1375 HG2 ARG 81 HG2 ARG 81 1.459 21.081 1.275 1376 HG3 ARG 81 HG3 ARG 81 0.484 20.081 2.350 1377 HD2 ARG 81 HD2 ARG 81 -0.851 21.606 0.923 1378 HD3 ARG 81 HD3 ARG 81 -1.108 21.845 2.645 1379 HE ARG 81 HE ARG 81 0.716 23.586 1.116 1380 HH11 ARG 81 HH11 ARG 81 -2.039 23.171 3.250 1381 HH12 ARG 81 HH12 ARG 81 -2.269 24.877 3.479 1382 HH21 ARG 81 HH21 ARG 81 0.417 25.820 1.434 1383 HH22 ARG 81 HH22 ARG 81 -0.881 26.384 2.442 1384 H GLU 82 H GLU 82 4.515 21.450 4.511 1385 HA GLU 82 HA GLU 82 4.265 23.292 6.662 1386 HB2 GLU 82 HB2 GLU 82 6.088 22.117 7.692 1387 HB3 GLU 82 HB3 GLU 82 5.058 20.932 6.902 1388 HG2 GLU 82 HG2 GLU 82 6.609 20.840 5.017 1389 HG3 GLU 82 HG3 GLU 82 7.645 22.020 5.815 1390 H GLN 83 H GLN 83 5.843 23.432 3.703 1391 HA GLN 83 HA GLN 83 8.097 25.002 4.364 1392 HB2 GLN 83 HB2 GLN 83 7.471 23.746 2.156 1393 HB3 GLN 83 HB3 GLN 83 6.673 25.254 1.737 1394 HG2 GLN 83 HG2 GLN 83 8.638 26.408 1.557 1395 HG3 GLN 83 HG3 GLN 83 9.495 25.333 2.664 1396 HE21 GLN 83 HE21 GLN 83 10.192 23.307 1.917 1397 HE22 GLN 83 HE22 GLN 83 10.439 23.009 0.230 1398 H LEU 84 H LEU 84 4.742 25.675 4.002 1399 HA LEU 84 HA LEU 84 5.035 28.526 3.703 1400 HB2 LEU 84 HB2 LEU 84 3.097 27.350 2.775 1401 HB3 LEU 84 HB3 LEU 84 2.645 26.805 4.380 1402 HG LEU 84 HG LEU 84 2.390 29.266 5.002 1403 HD11 LEU 84 HD11 LEU 84 3.674 30.156 3.099 1404 HD12 LEU 84 HD12 LEU 84 2.063 30.855 3.219 1405 HD13 LEU 84 HD13 LEU 84 2.399 29.620 2.006 1406 HD21 LEU 84 HD21 LEU 84 0.567 27.997 2.965 1407 HD22 LEU 84 HD22 LEU 84 0.174 29.463 3.859 1408 HD23 LEU 84 HD23 LEU 84 0.429 27.950 4.724 1409 H LYS 85 H LYS 85 5.073 26.255 6.201 1410 HA LYS 85 HA LYS 85 4.440 28.208 8.280 1411 HB2 LYS 85 HB2 LYS 85 4.994 25.236 8.461 1412 HB3 LYS 85 HB3 LYS 85 4.550 26.268 9.815 1413 HG2 LYS 85 HG2 LYS 85 2.364 26.596 8.970 1414 HG3 LYS 85 HG3 LYS 85 2.790 25.908 7.402 1415 HD2 LYS 85 HD2 LYS 85 3.083 23.717 8.429 1416 HD3 LYS 85 HD3 LYS 85 2.736 24.396 10.017 1417 HE2 LYS 85 HE2 LYS 85 0.763 24.659 7.782 1418 HE3 LYS 85 HE3 LYS 85 0.853 23.169 8.721 1419 HZ1 LYS 85 HZ1 LYS 85 0.472 25.858 9.917 1420 HZ2 LYS 85 HZ2 LYS 85 0.358 24.364 10.702 1421 HZ3 LYS 85 HZ3 LYS 85 -0.796 24.803 9.546 1422 H LYS 86 H LYS 86 5.940 28.457 10.077 1423 HA LYS 86 HA LYS 86 8.722 27.892 9.323 1424 HB2 LYS 86 HB2 LYS 86 7.618 30.402 10.598 1425 HB3 LYS 86 HB3 LYS 86 9.331 30.042 10.455 1426 HG2 LYS 86 HG2 LYS 86 9.276 30.205 8.104 1427 HG3 LYS 86 HG3 LYS 86 7.512 30.180 8.070 1428 HD2 LYS 86 HD2 LYS 86 8.148 32.431 7.696 1429 HD3 LYS 86 HD3 LYS 86 7.585 32.352 9.364 1430 HE2 LYS 86 HE2 LYS 86 9.551 33.642 9.433 1431 HE3 LYS 86 HE3 LYS 86 10.021 32.044 10.010 1432 HZ1 LYS 86 HZ1 LYS 86 10.840 31.555 7.766 1433 HZ2 LYS 86 HZ2 LYS 86 11.650 32.854 8.472 1434 HZ3 LYS 86 HZ3 LYS 86 10.474 33.132 7.287 Start of MODEL 12 1 H1 GLY 1 H1 GLY 1 26.997 -4.309 -0.026 2 H2 GLY 1 H2 GLY 1 28.368 -4.979 -0.753 3 H3 GLY 1 H3 GLY 1 27.542 -3.715 -1.510 4 HA2 GLY 1 HA3 GLY 1 29.028 -3.541 1.046 5 HA3 GLY 1 HA2 GLY 1 29.558 -2.895 -0.499 6 H SER 2 H SER 2 29.633 -0.926 1.010 7 HA SER 2 HA SER 2 27.194 0.594 0.531 8 HB2 SER 2 HB2 SER 2 28.452 0.519 3.285 9 HB3 SER 2 HB3 SER 2 26.980 1.369 2.808 10 HG SER 2 HG SER 2 26.517 -1.075 2.126 11 H HIS 3 H HIS 3 27.523 2.874 0.592 12 HA HIS 3 HA HIS 3 30.288 3.793 0.819 13 HB2 HIS 3 HB2 HIS 3 28.582 3.897 -1.634 14 HB3 HIS 3 HB3 HIS 3 29.639 5.265 -1.295 15 HD1 HIS 3 HD1 HIS 3 32.246 4.730 -1.223 16 HD2 HIS 3 HD2 HIS 3 29.829 1.671 -2.672 17 HE1 HIS 3 HE1 HIS 3 33.799 3.135 -2.384 18 HE2 HIS 3 HE2 HIS 3 32.304 1.361 -3.357 19 H MET 4 H MET 4 30.442 6.110 1.144 20 HA MET 4 HA MET 4 28.110 7.110 2.576 21 HB2 MET 4 HB2 MET 4 30.945 8.144 2.440 22 HB3 MET 4 HB3 MET 4 29.667 8.852 3.419 23 HG2 MET 4 HG2 MET 4 29.475 6.513 4.471 24 HG3 MET 4 HG3 MET 4 31.053 6.217 3.745 25 HE1 MET 4 HE1 MET 4 30.104 9.188 7.125 26 HE2 MET 4 HE2 MET 4 29.057 7.868 6.602 27 HE3 MET 4 HE3 MET 4 29.310 9.265 5.555 28 H THR 5 H THR 5 28.450 7.057 -0.420 29 HA THR 5 HA THR 5 28.543 9.822 -1.203 30 HB THR 5 HB THR 5 27.571 8.617 -3.388 31 HG1 THR 5 HG1 THR 5 27.306 6.589 -2.367 32 HG21 THR 5 HG21 THR 5 29.856 8.280 -4.132 33 HG22 THR 5 HG22 THR 5 30.427 8.286 -2.463 34 HG23 THR 5 HG23 THR 5 29.756 9.755 -3.171 35 H GLU 6 H GLU 6 26.461 10.010 -3.059 36 HA GLU 6 HA GLU 6 24.285 10.703 -1.390 37 HB2 GLU 6 HB2 GLU 6 23.130 11.321 -3.417 38 HB3 GLU 6 HB3 GLU 6 24.809 11.830 -3.535 39 HG2 GLU 6 HG2 GLU 6 25.234 9.732 -4.856 40 HG3 GLU 6 HG3 GLU 6 23.485 9.506 -4.902 41 H GLN 7 H GLN 7 22.017 9.913 -1.835 42 HA GLN 7 HA GLN 7 22.037 6.984 -2.103 43 HB2 GLN 7 HB2 GLN 7 20.368 8.730 -0.294 44 HB3 GLN 7 HB3 GLN 7 20.082 7.012 -0.533 45 HG2 GLN 7 HG2 GLN 7 22.101 6.422 0.504 46 HG3 GLN 7 HG3 GLN 7 22.724 8.069 0.409 47 HE21 GLN 7 HE21 GLN 7 22.402 6.276 2.698 48 HE22 GLN 7 HE22 GLN 7 21.437 7.145 3.838 49 HA PRO 8 HA PRO 8 19.098 8.388 -5.293 50 HB2 PRO 8 HB2 PRO 8 20.089 6.985 -7.334 51 HB3 PRO 8 HB3 PRO 8 20.875 8.468 -6.785 52 HG2 PRO 8 HG2 PRO 8 21.654 5.627 -6.330 53 HG3 PRO 8 HG3 PRO 8 22.682 7.051 -6.575 54 HD2 PRO 8 HD2 PRO 8 22.033 5.873 -4.112 55 HD3 PRO 8 HD3 PRO 8 22.758 7.474 -4.345 56 H LYS 9 H LYS 9 17.762 6.898 -6.852 57 HA LYS 9 HA LYS 9 16.368 5.025 -5.306 58 HB2 LYS 9 HB2 LYS 9 16.444 5.355 -8.310 59 HB3 LYS 9 HB3 LYS 9 15.286 4.348 -7.451 60 HG2 LYS 9 HG2 LYS 9 14.629 6.456 -6.189 61 HG3 LYS 9 HG3 LYS 9 15.552 7.337 -7.408 62 HD2 LYS 9 HD2 LYS 9 13.448 7.389 -8.333 63 HD3 LYS 9 HD3 LYS 9 14.093 5.924 -9.072 64 HE2 LYS 9 HE2 LYS 9 12.984 4.571 -7.365 65 HE3 LYS 9 HE3 LYS 9 12.351 6.032 -6.613 66 HZ1 LYS 9 HZ1 LYS 9 10.679 5.029 -7.993 67 HZ2 LYS 9 HZ2 LYS 9 11.705 5.042 -9.333 68 HZ3 LYS 9 HZ3 LYS 9 11.146 6.500 -8.683 69 H THR 10 H THR 10 17.325 3.254 -4.501 70 HA THR 10 HA THR 10 18.654 1.460 -6.403 71 HB THR 10 HB THR 10 20.359 2.661 -5.050 72 HG1 THR 10 HG1 THR 10 21.540 0.847 -4.745 73 HG21 THR 10 HG21 THR 10 20.590 2.136 -2.660 74 HG22 THR 10 HG22 THR 10 19.072 1.242 -2.714 75 HG23 THR 10 HG23 THR 10 19.082 2.983 -2.996 76 H ARG 11 H ARG 11 19.210 -0.578 -4.603 77 HA ARG 11 HA ARG 11 16.488 -1.464 -3.912 78 HB2 ARG 11 HB2 ARG 11 17.317 -3.780 -4.230 79 HB3 ARG 11 HB3 ARG 11 17.402 -2.815 -5.693 80 HG2 ARG 11 HG2 ARG 11 19.825 -2.458 -5.245 81 HG3 ARG 11 HG3 ARG 11 19.689 -3.574 -3.888 82 HD2 ARG 11 HD2 ARG 11 18.652 -4.519 -6.481 83 HD3 ARG 11 HD3 ARG 11 20.398 -4.320 -6.372 84 HE ARG 11 HE ARG 11 20.165 -5.792 -4.311 85 HH11 ARG 11 HH11 ARG 11 18.028 -6.031 -7.085 86 HH12 ARG 11 HH12 ARG 11 17.707 -7.721 -6.843 87 HH21 ARG 11 HH21 ARG 11 19.719 -8.006 -3.988 88 HH22 ARG 11 HH22 ARG 11 18.639 -8.832 -5.068 89 H VAL 12 H VAL 12 16.058 -2.160 -1.900 90 HA VAL 12 HA VAL 12 18.319 -2.391 -0.022 91 HB VAL 12 HB VAL 12 17.127 -0.256 0.324 92 HG11 VAL 12 HG11 VAL 12 14.923 -0.815 -0.445 93 HG12 VAL 12 HG12 VAL 12 14.823 -0.289 1.236 94 HG13 VAL 12 HG13 VAL 12 14.728 -2.006 0.844 95 HG21 VAL 12 HG21 VAL 12 16.705 -2.247 2.553 96 HG22 VAL 12 HG22 VAL 12 16.723 -0.491 2.731 97 HG23 VAL 12 HG23 VAL 12 18.183 -1.342 2.232 98 H SER 13 H SER 13 18.126 -3.972 1.582 99 HA SER 13 HA SER 13 16.026 -5.961 1.062 100 HB2 SER 13 HB2 SER 13 17.881 -7.237 2.633 101 HB3 SER 13 HB3 SER 13 17.849 -7.285 0.871 102 HG SER 13 HG SER 13 19.287 -5.409 2.453 103 H VAL 14 H VAL 14 14.485 -6.238 2.536 104 HA VAL 14 HA VAL 14 15.032 -5.418 5.315 105 HB VAL 14 HB VAL 14 12.654 -4.731 5.498 106 HG11 VAL 14 HG11 VAL 14 14.348 -3.036 5.182 107 HG12 VAL 14 HG12 VAL 14 12.890 -2.590 4.295 108 HG13 VAL 14 HG13 VAL 14 14.279 -3.253 3.432 109 HG21 VAL 14 HG21 VAL 14 11.298 -4.378 3.538 110 HG22 VAL 14 HG22 VAL 14 11.821 -6.061 3.576 111 HG23 VAL 14 HG23 VAL 14 12.607 -4.917 2.488 112 H ARG 15 H ARG 15 13.308 -6.383 6.829 113 HA ARG 15 HA ARG 15 12.793 -9.158 5.994 114 HB2 ARG 15 HB2 ARG 15 14.532 -8.990 7.728 115 HB3 ARG 15 HB3 ARG 15 13.404 -8.130 8.768 116 HG2 ARG 15 HG2 ARG 15 12.099 -10.495 8.042 117 HG3 ARG 15 HG3 ARG 15 13.761 -10.953 8.408 118 HD2 ARG 15 HD2 ARG 15 12.624 -11.104 10.455 119 HD3 ARG 15 HD3 ARG 15 13.500 -9.576 10.533 120 HE ARG 15 HE ARG 15 10.838 -9.247 9.544 121 HH11 ARG 15 HH11 ARG 15 12.737 -9.577 12.468 122 HH12 ARG 15 HH12 ARG 15 11.545 -8.827 13.478 123 HH21 ARG 15 HH21 ARG 15 9.238 -8.300 10.871 124 HH22 ARG 15 HH22 ARG 15 9.556 -8.105 12.569 125 H ILE 16 H ILE 16 10.694 -9.571 5.759 126 HA ILE 16 HA ILE 16 8.800 -8.234 7.587 127 HB ILE 16 HB ILE 16 8.213 -8.905 4.697 128 HG12 ILE 16 HG12 ILE 16 8.510 -6.133 5.838 129 HG13 ILE 16 HG13 ILE 16 9.885 -6.998 5.157 130 HG21 ILE 16 HG21 ILE 16 6.150 -7.710 5.031 131 HG22 ILE 16 HG22 ILE 16 6.628 -7.260 6.667 132 HG23 ILE 16 HG23 ILE 16 6.295 -8.947 6.279 133 HD11 ILE 16 HD11 ILE 16 8.956 -5.517 3.510 134 HD12 ILE 16 HD12 ILE 16 7.353 -6.223 3.724 135 HD13 ILE 16 HD13 ILE 16 8.656 -7.187 3.026 136 H TYR 17 H TYR 17 7.580 -9.570 8.719 137 HA TYR 17 HA TYR 17 6.525 -11.422 9.482 138 HB2 TYR 17 HB2 TYR 17 5.668 -11.183 6.930 139 HB3 TYR 17 HB3 TYR 17 6.398 -12.783 6.853 140 HD1 TYR 17 HD1 TYR 17 4.115 -10.835 9.095 141 HD2 TYR 17 HD2 TYR 17 5.029 -14.579 7.295 142 HE1 TYR 17 HE1 TYR 17 2.080 -11.803 10.083 143 HE2 TYR 17 HE2 TYR 17 3.000 -15.558 8.278 144 HH TYR 17 HH TYR 17 0.513 -13.731 9.580 145 H GLY 18 H GLY 18 9.526 -11.403 8.940 146 HA2 GLY 18 HA2 GLY 18 11.028 -12.945 9.930 147 HA3 GLY 18 HA3 GLY 18 9.883 -14.231 9.603 148 H GLN 19 H GLN 19 10.158 -12.372 6.827 149 HA GLN 19 HA GLN 19 12.348 -14.078 5.824 150 HB2 GLN 19 HB2 GLN 19 9.758 -13.339 4.462 151 HB3 GLN 19 HB3 GLN 19 11.132 -14.025 3.608 152 HG2 GLN 19 HG2 GLN 19 9.828 -15.377 5.946 153 HG3 GLN 19 HG3 GLN 19 9.314 -15.630 4.278 154 HE21 GLN 19 HE21 GLN 19 11.810 -16.166 6.628 155 HE22 GLN 19 HE22 GLN 19 12.698 -17.335 5.714 156 H ASP 20 H ASP 20 13.637 -13.188 4.127 157 HA ASP 20 HA ASP 20 13.901 -10.296 4.320 158 HB2 ASP 20 HB2 ASP 20 16.008 -11.234 4.482 159 HB3 ASP 20 HB3 ASP 20 15.633 -12.538 3.370 160 H TYR 21 H TYR 21 13.520 -8.875 2.714 161 HA TYR 21 HA TYR 21 12.834 -9.900 0.056 162 HB2 TYR 21 HB2 TYR 21 11.138 -7.931 1.611 163 HB3 TYR 21 HB3 TYR 21 10.860 -8.432 -0.053 164 HD1 TYR 21 HD2 TYR 21 10.502 -10.981 -0.437 165 HD2 TYR 21 HD1 TYR 21 10.091 -9.072 3.342 166 HE1 TYR 21 HE2 TYR 21 9.140 -12.866 0.364 167 HE2 TYR 21 HE1 TYR 21 8.731 -10.953 4.150 168 HH TYR 21 HH TYR 21 7.359 -12.732 3.286 169 H THR 22 H THR 22 13.610 -8.666 -1.560 170 HA THR 22 HA THR 22 14.955 -6.165 -0.808 171 HB THR 22 HB THR 22 15.486 -7.621 -3.375 172 HG1 THR 22 HG1 THR 22 16.005 -8.527 -0.817 173 HG21 THR 22 HG21 THR 22 16.500 -5.422 -3.024 174 HG22 THR 22 HG22 THR 22 17.731 -6.686 -3.055 175 HG23 THR 22 HG23 THR 22 17.220 -5.987 -1.518 176 H ILE 23 H ILE 23 14.089 -4.314 -1.536 177 HA ILE 23 HA ILE 23 12.429 -4.412 -3.961 178 HB ILE 23 HB ILE 23 10.840 -2.825 -3.025 179 HG12 ILE 23 HG12 ILE 23 12.627 -2.010 -1.276 180 HG13 ILE 23 HG13 ILE 23 10.913 -1.904 -0.918 181 HG21 ILE 23 HG21 ILE 23 10.216 -5.104 -2.924 182 HG22 ILE 23 HG22 ILE 23 9.736 -4.364 -1.398 183 HG23 ILE 23 HG23 ILE 23 11.177 -5.378 -1.474 184 HD11 ILE 23 HD11 ILE 23 12.587 -4.218 0.006 185 HD12 ILE 23 HD12 ILE 23 11.014 -3.692 0.598 186 HD13 ILE 23 HD13 ILE 23 12.446 -2.721 0.920 187 H VAL 24 H VAL 24 11.940 -2.107 -4.724 188 HA VAL 24 HA VAL 24 14.489 -0.664 -4.776 189 HB VAL 24 HB VAL 24 12.096 -0.343 -6.599 190 HG11 VAL 24 HG11 VAL 24 13.685 0.848 -8.058 191 HG12 VAL 24 HG12 VAL 24 14.913 0.711 -6.802 192 HG13 VAL 24 HG13 VAL 24 13.455 1.659 -6.509 193 HG21 VAL 24 HG21 VAL 24 14.660 -1.876 -7.009 194 HG22 VAL 24 HG22 VAL 24 13.466 -1.550 -8.265 195 HG23 VAL 24 HG23 VAL 24 13.038 -2.553 -6.879 196 H GLY 25 H GLY 25 14.617 0.917 -3.310 197 HA2 GLY 25 HA2 GLY 25 12.815 3.117 -3.351 198 HA3 GLY 25 HA3 GLY 25 12.554 2.126 -1.919 199 H ALA 26 H ALA 26 13.743 4.910 -2.430 200 HA ALA 26 HA ALA 26 15.740 4.744 -0.403 201 HB1 ALA 26 HB1 ALA 26 17.649 5.509 -1.679 202 HB2 ALA 26 HB2 ALA 26 16.695 5.474 -3.162 203 HB3 ALA 26 HB3 ALA 26 17.066 3.972 -2.316 204 H GLU 27 H GLU 27 13.403 6.181 -0.466 205 HA GLU 27 HA GLU 27 14.023 8.895 -1.305 206 HB2 GLU 27 HB2 GLU 27 11.806 9.452 -0.755 207 HB3 GLU 27 HB3 GLU 27 11.688 7.810 -1.369 208 HG2 GLU 27 HG2 GLU 27 11.987 8.248 1.559 209 HG3 GLU 27 HG3 GLU 27 10.425 8.535 0.795 210 H SER 28 H SER 28 14.300 6.895 1.414 211 HA SER 28 HA SER 28 15.871 8.709 2.886 212 HB2 SER 28 HB2 SER 28 12.976 8.573 3.547 213 HB3 SER 28 HB3 SER 28 14.095 8.504 4.910 214 HG SER 28 HG SER 28 14.300 10.474 2.886 215 HA PRO 29 HA PRO 29 17.260 4.660 4.063 216 HB2 PRO 29 HB2 PRO 29 18.701 5.448 6.299 217 HB3 PRO 29 HB3 PRO 29 19.302 5.460 4.638 218 HG2 PRO 29 HG2 PRO 29 18.190 7.700 6.270 219 HG3 PRO 29 HG3 PRO 29 19.553 7.708 5.134 220 HD2 PRO 29 HD2 PRO 29 17.164 8.709 4.451 221 HD3 PRO 29 HD3 PRO 29 18.162 7.828 3.276 222 H ALA 30 H ALA 30 15.852 6.801 6.520 223 HA ALA 30 HA ALA 30 15.307 4.625 8.324 224 HB1 ALA 30 HB1 ALA 30 14.209 6.272 9.701 225 HB2 ALA 30 HB2 ALA 30 14.215 7.433 8.373 226 HB3 ALA 30 HB3 ALA 30 15.735 6.931 9.110 227 H HIS 31 H HIS 31 13.565 6.462 5.927 228 HA HIS 31 HA HIS 31 10.948 5.656 6.474 229 HB2 HIS 31 HB2 HIS 31 12.154 7.255 4.573 230 HB3 HIS 31 HB3 HIS 31 11.514 5.928 3.617 231 HD1 HIS 31 HD1 HIS 31 9.399 6.686 2.616 232 HD2 HIS 31 HD2 HIS 31 9.802 7.983 6.554 233 HE1 HIS 31 HE1 HIS 31 7.288 7.957 3.142 234 HE2 HIS 31 HE2 HIS 31 7.679 8.942 5.425 235 H ILE 32 H ILE 32 13.187 4.342 4.051 236 HA ILE 32 HA ILE 32 11.613 2.232 3.173 237 HB ILE 32 HB ILE 32 13.662 1.171 2.353 238 HG12 ILE 32 HG12 ILE 32 15.096 3.328 3.934 239 HG13 ILE 32 HG13 ILE 32 15.147 1.599 4.250 240 HG21 ILE 32 HG21 ILE 32 13.818 4.146 1.926 241 HG22 ILE 32 HG22 ILE 32 12.564 3.126 1.221 242 HG23 ILE 32 HG23 ILE 32 14.254 2.862 0.800 243 HD11 ILE 32 HD11 ILE 32 16.366 3.115 1.967 244 HD12 ILE 32 HD12 ILE 32 16.163 1.362 1.940 245 HD13 ILE 32 HD13 ILE 32 17.162 2.114 3.181 246 H ARG 33 H ARG 33 13.454 2.485 6.105 247 HA ARG 33 HA ARG 33 13.497 -0.344 6.617 248 HB2 ARG 33 HB2 ARG 33 14.194 2.069 8.279 249 HB3 ARG 33 HB3 ARG 33 14.214 0.441 8.944 250 HG2 ARG 33 HG2 ARG 33 15.880 -0.228 7.297 251 HG3 ARG 33 HG3 ARG 33 15.845 1.390 6.592 252 HD2 ARG 33 HD2 ARG 33 17.758 1.034 8.119 253 HD3 ARG 33 HD3 ARG 33 16.697 2.345 8.638 254 HE ARG 33 HE ARG 33 16.530 -0.363 9.799 255 HH11 ARG 33 HH11 ARG 33 16.848 3.100 10.180 256 HH12 ARG 33 HH12 ARG 33 16.574 3.069 11.890 257 HH21 ARG 33 HH21 ARG 33 16.182 -0.408 12.062 258 HH22 ARG 33 HH22 ARG 33 16.201 1.076 12.957 259 H LEU 34 H LEU 34 11.570 2.419 7.716 260 HA LEU 34 HA LEU 34 10.029 0.829 9.526 261 HB2 LEU 34 HB2 LEU 34 8.600 2.792 9.802 262 HB3 LEU 34 HB3 LEU 34 10.296 3.171 10.003 263 HG LEU 34 HG LEU 34 10.060 3.900 7.450 264 HD11 LEU 34 HD11 LEU 34 7.733 3.234 7.223 265 HD12 LEU 34 HD12 LEU 34 7.899 4.982 7.063 266 HD13 LEU 34 HD13 LEU 34 7.290 4.288 8.563 267 HD21 LEU 34 HD21 LEU 34 10.846 5.355 9.186 268 HD22 LEU 34 HD22 LEU 34 9.224 5.488 9.873 269 HD23 LEU 34 HD23 LEU 34 9.575 6.192 8.293 270 H VAL 35 H VAL 35 9.859 1.440 6.147 271 HA VAL 35 HA VAL 35 7.125 1.072 5.661 272 HB VAL 35 HB VAL 35 9.452 0.195 3.928 273 HG11 VAL 35 HG11 VAL 35 6.608 0.710 3.087 274 HG12 VAL 35 HG12 VAL 35 7.267 -0.896 3.391 275 HG13 VAL 35 HG13 VAL 35 7.928 0.098 2.091 276 HG21 VAL 35 HG21 VAL 35 9.167 2.272 2.746 277 HG22 VAL 35 HG22 VAL 35 9.396 2.615 4.461 278 HG23 VAL 35 HG23 VAL 35 7.786 2.699 3.754 279 H ALA 36 H ALA 36 9.757 -1.244 6.022 280 HA ALA 36 HA ALA 36 8.292 -3.580 5.461 281 HB1 ALA 36 HB1 ALA 36 10.797 -3.329 5.555 282 HB2 ALA 36 HB2 ALA 36 10.145 -4.774 6.328 283 HB3 ALA 36 HB3 ALA 36 10.658 -3.401 7.311 284 H ALA 37 H ALA 37 9.043 -1.924 8.497 285 HA ALA 37 HA ALA 37 7.871 -3.780 10.246 286 HB1 ALA 37 HB1 ALA 37 9.405 -2.012 10.976 287 HB2 ALA 37 HB2 ALA 37 7.900 -1.995 11.894 288 HB3 ALA 37 HB3 ALA 37 8.172 -0.803 10.624 289 H PHE 38 H PHE 38 6.520 -1.161 8.365 290 HA PHE 38 HA PHE 38 4.029 -0.955 9.656 291 HB2 PHE 38 HB2 PHE 38 4.979 0.665 7.972 292 HB3 PHE 38 HB3 PHE 38 4.554 -0.494 6.715 293 HD1 PHE 38 HD2 PHE 38 3.091 1.488 9.486 294 HD2 PHE 38 HD1 PHE 38 2.429 -0.460 5.764 295 HE1 PHE 38 HE2 PHE 38 0.825 2.433 9.403 296 HE2 PHE 38 HE1 PHE 38 0.158 0.483 5.673 297 HZ PHE 38 HZ PHE 38 -0.650 1.933 7.494 298 H VAL 39 H VAL 39 5.027 -2.838 6.810 299 HA VAL 39 HA VAL 39 2.502 -4.096 6.451 300 HB VAL 39 HB VAL 39 5.215 -5.014 5.479 301 HG11 VAL 39 HG11 VAL 39 2.448 -5.725 4.512 302 HG12 VAL 39 HG12 VAL 39 3.542 -6.788 5.399 303 HG13 VAL 39 HG13 VAL 39 3.964 -6.242 3.775 304 HG21 VAL 39 HG21 VAL 39 4.943 -2.890 4.554 305 HG22 VAL 39 HG22 VAL 39 3.205 -3.102 4.344 306 HG23 VAL 39 HG23 VAL 39 4.329 -3.975 3.307 307 H ASP 40 H ASP 40 5.450 -4.945 8.151 308 HA ASP 40 HA ASP 40 4.965 -7.618 8.731 309 HB2 ASP 40 HB2 ASP 40 7.057 -6.160 9.188 310 HB3 ASP 40 HB3 ASP 40 6.267 -5.758 10.710 311 H ASP 41 H ASP 41 4.154 -4.763 10.717 312 HA ASP 41 HA ASP 41 2.739 -6.296 12.663 313 HB2 ASP 41 HB2 ASP 41 3.754 -4.077 13.155 314 HB3 ASP 41 HB3 ASP 41 2.537 -3.324 12.127 315 H LYS 42 H LYS 42 1.818 -4.531 9.769 316 HA LYS 42 HA LYS 42 -0.961 -4.527 10.105 317 HB2 LYS 42 HB2 LYS 42 0.885 -4.296 7.794 318 HB3 LYS 42 HB3 LYS 42 -0.783 -4.708 7.432 319 HG2 LYS 42 HG2 LYS 42 -0.190 -2.401 9.225 320 HG3 LYS 42 HG3 LYS 42 -0.026 -2.222 7.476 321 HD2 LYS 42 HD2 LYS 42 -2.305 -2.676 7.104 322 HD3 LYS 42 HD3 LYS 42 -2.514 -3.354 8.724 323 HE2 LYS 42 HE2 LYS 42 -1.887 -0.460 8.149 324 HE3 LYS 42 HE3 LYS 42 -3.507 -1.093 8.446 325 HZ1 LYS 42 HZ1 LYS 42 -2.698 -1.880 10.635 326 HZ2 LYS 42 HZ2 LYS 42 -2.643 -0.194 10.467 327 HZ3 LYS 42 HZ3 LYS 42 -1.223 -1.095 10.339 328 H MET 43 H MET 43 1.160 -6.923 8.547 329 HA MET 43 HA MET 43 -0.918 -8.699 7.817 330 HB2 MET 43 HB2 MET 43 2.039 -9.093 8.245 331 HB3 MET 43 HB3 MET 43 0.978 -10.424 7.801 332 HG2 MET 43 HG2 MET 43 0.304 -9.156 5.786 333 HG3 MET 43 HG3 MET 43 1.487 -7.921 6.212 334 HE1 MET 43 HE1 MET 43 0.814 -11.495 4.989 335 HE2 MET 43 HE2 MET 43 1.762 -11.934 6.410 336 HE3 MET 43 HE3 MET 43 2.421 -12.200 4.796 337 H HIS 44 H HIS 44 1.041 -8.364 10.705 338 HA HIS 44 HA HIS 44 0.335 -10.743 11.998 339 HB2 HIS 44 HB2 HIS 44 2.192 -9.403 12.775 340 HB3 HIS 44 HB3 HIS 44 1.121 -8.051 13.126 341 HD1 HIS 44 HD1 HIS 44 0.016 -8.005 15.392 342 HD2 HIS 44 HD2 HIS 44 1.916 -11.614 14.594 343 HE1 HIS 44 HE1 HIS 44 -0.033 -9.286 17.552 344 HE2 HIS 44 HE2 HIS 44 1.224 -11.417 17.075 345 H GLU 45 H GLU 45 -1.120 -7.501 12.318 346 HA GLU 45 HA GLU 45 -3.099 -8.308 14.166 347 HB2 GLU 45 HB2 GLU 45 -4.186 -6.144 13.649 348 HB3 GLU 45 HB3 GLU 45 -2.474 -5.988 14.016 349 HG2 GLU 45 HG2 GLU 45 -1.918 -5.534 11.792 350 HG3 GLU 45 HG3 GLU 45 -3.442 -6.173 11.184 351 H PHE 46 H PHE 46 -3.057 -8.288 10.653 352 HA PHE 46 HA PHE 46 -5.905 -8.758 10.538 353 HB2 PHE 46 HB2 PHE 46 -3.771 -8.415 8.465 354 HB3 PHE 46 HB3 PHE 46 -5.349 -9.061 8.020 355 HD1 PHE 46 HD1 PHE 46 -7.361 -7.652 9.127 356 HD2 PHE 46 HD2 PHE 46 -3.497 -6.145 8.187 357 HE1 PHE 46 HE1 PHE 46 -8.276 -5.373 9.041 358 HE2 PHE 46 HE2 PHE 46 -4.407 -3.863 8.092 359 HZ PHE 46 HZ PHE 46 -6.797 -3.472 8.523 360 H SER 47 H SER 47 -3.088 -10.714 10.764 361 HA SER 47 HA SER 47 -4.029 -13.036 9.450 362 HB2 SER 47 HB2 SER 47 -2.091 -12.735 11.759 363 HB3 SER 47 HB3 SER 47 -2.393 -14.259 10.927 364 HG SER 47 HG SER 47 -1.501 -11.885 9.645 365 H GLU 48 H GLU 48 -4.559 -11.688 12.614 366 HA GLU 48 HA GLU 48 -5.760 -13.980 13.782 367 HB2 GLU 48 HB2 GLU 48 -5.996 -11.075 14.565 368 HB3 GLU 48 HB3 GLU 48 -6.452 -12.448 15.564 369 HG2 GLU 48 HG2 GLU 48 -4.115 -13.198 15.570 370 HG3 GLU 48 HG3 GLU 48 -3.674 -11.782 14.618 371 H LYS 49 H LYS 49 -6.892 -11.568 11.623 372 HA LYS 49 HA LYS 49 -9.665 -11.763 12.324 373 HB2 LYS 49 HB2 LYS 49 -8.332 -10.678 9.839 374 HB3 LYS 49 HB3 LYS 49 -10.045 -10.529 10.198 375 HG2 LYS 49 HG2 LYS 49 -7.880 -9.428 11.978 376 HG3 LYS 49 HG3 LYS 49 -8.631 -8.503 10.680 377 HD2 LYS 49 HD2 LYS 49 -10.241 -9.784 12.878 378 HD3 LYS 49 HD3 LYS 49 -9.550 -8.175 13.035 379 HE2 LYS 49 HE2 LYS 49 -10.785 -7.467 11.028 380 HE3 LYS 49 HE3 LYS 49 -11.497 -9.074 10.910 381 HZ1 LYS 49 HZ1 LYS 49 -11.877 -7.143 13.133 382 HZ2 LYS 49 HZ2 LYS 49 -12.492 -8.717 13.109 383 HZ3 LYS 49 HZ3 LYS 49 -13.028 -7.585 11.975 384 H GLN 50 H GLN 50 -7.488 -13.447 10.226 385 HA GLN 50 HA GLN 50 -7.685 -15.261 8.883 386 HB2 GLN 50 HB2 GLN 50 -10.143 -15.742 10.574 387 HB3 GLN 50 HB3 GLN 50 -9.447 -16.918 9.469 388 HG2 GLN 50 HG2 GLN 50 -7.447 -17.057 10.756 389 HG3 GLN 50 HG3 GLN 50 -7.950 -15.708 11.776 390 HE21 GLN 50 HE21 GLN 50 -7.839 -16.873 13.662 391 HE22 GLN 50 HE22 GLN 50 -8.952 -18.134 14.056 392 HA PRO 51 HA PRO 51 -10.652 -12.987 6.118 393 HB2 PRO 51 HB2 PRO 51 -8.955 -13.249 3.935 394 HB3 PRO 51 HB3 PRO 51 -9.073 -11.832 4.978 395 HG2 PRO 51 HG2 PRO 51 -7.048 -14.006 4.954 396 HG3 PRO 51 HG3 PRO 51 -6.864 -12.299 5.377 397 HD2 PRO 51 HD2 PRO 51 -6.960 -14.296 7.224 398 HD3 PRO 51 HD3 PRO 51 -7.496 -12.637 7.553 399 H MET 52 H MET 52 -8.546 -15.519 4.737 400 HA MET 52 HA MET 52 -10.948 -17.093 4.109 401 HB2 MET 52 HB2 MET 52 -8.620 -16.646 2.229 402 HB3 MET 52 HB3 MET 52 -10.038 -17.636 1.908 403 HG2 MET 52 HG2 MET 52 -10.138 -14.674 2.413 404 HG3 MET 52 HG3 MET 52 -10.037 -15.397 0.811 405 HE1 MET 52 HE1 MET 52 -13.766 -14.004 1.363 406 HE2 MET 52 HE2 MET 52 -12.251 -13.727 0.504 407 HE3 MET 52 HE3 MET 52 -12.359 -13.392 2.233 408 H LEU 53 H LEU 53 -8.687 -17.173 6.119 409 HA LEU 53 HA LEU 53 -7.288 -18.645 7.126 410 HB2 LEU 53 HB2 LEU 53 -9.313 -20.460 5.850 411 HB3 LEU 53 HB3 LEU 53 -8.008 -21.099 6.830 412 HG LEU 53 HG LEU 53 -10.024 -19.085 7.829 413 HD11 LEU 53 HD11 LEU 53 -11.117 -21.197 7.242 414 HD12 LEU 53 HD12 LEU 53 -11.083 -20.942 8.987 415 HD13 LEU 53 HD13 LEU 53 -9.953 -22.070 8.239 416 HD21 LEU 53 HD21 LEU 53 -7.802 -20.644 9.093 417 HD22 LEU 53 HD22 LEU 53 -9.173 -20.075 10.041 418 HD23 LEU 53 HD23 LEU 53 -8.147 -18.918 9.197 419 H ASP 54 H ASP 54 -5.880 -17.710 5.192 420 HA ASP 54 HA ASP 54 -4.231 -19.882 4.350 421 HB2 ASP 54 HB2 ASP 54 -5.958 -19.946 2.590 422 HB3 ASP 54 HB3 ASP 54 -5.629 -18.265 2.208 423 H VAL 55 H VAL 55 -2.163 -19.188 3.797 424 HA VAL 55 HA VAL 55 -1.361 -16.747 4.937 425 HB VAL 55 HB VAL 55 0.303 -18.464 3.100 426 HG11 VAL 55 HG11 VAL 55 1.249 -16.255 3.570 427 HG12 VAL 55 HG12 VAL 55 2.192 -17.535 4.335 428 HG13 VAL 55 HG13 VAL 55 1.088 -16.556 5.300 429 HG21 VAL 55 HG21 VAL 55 1.065 -19.611 5.119 430 HG22 VAL 55 HG22 VAL 55 -0.673 -19.819 4.881 431 HG23 VAL 55 HG23 VAL 55 -0.077 -18.676 6.083 432 HA PRO 56 HA PRO 56 -0.300 -15.089 0.491 433 HB2 PRO 56 HB2 PRO 56 -1.742 -16.283 -1.548 434 HB3 PRO 56 HB3 PRO 56 -0.050 -16.616 -1.168 435 HG2 PRO 56 HG2 PRO 56 -2.499 -18.153 -0.418 436 HG3 PRO 56 HG3 PRO 56 -0.901 -18.750 -0.899 437 HD2 PRO 56 HD2 PRO 56 -1.676 -18.737 1.670 438 HD3 PRO 56 HD3 PRO 56 0.005 -18.409 1.200 439 H LYS 57 H LYS 57 -3.481 -16.370 1.219 440 HA LYS 57 HA LYS 57 -4.956 -14.309 -0.086 441 HB2 LYS 57 HB2 LYS 57 -5.600 -16.476 1.853 442 HB3 LYS 57 HB3 LYS 57 -6.760 -15.180 1.634 443 HG2 LYS 57 HG2 LYS 57 -6.986 -17.347 0.238 444 HG3 LYS 57 HG3 LYS 57 -7.240 -15.784 -0.537 445 HD2 LYS 57 HD2 LYS 57 -5.161 -15.866 -1.628 446 HD3 LYS 57 HD3 LYS 57 -4.556 -17.138 -0.564 447 HE2 LYS 57 HE2 LYS 57 -6.806 -17.471 -2.544 448 HE3 LYS 57 HE3 LYS 57 -5.130 -17.934 -2.841 449 HZ1 LYS 57 HZ1 LYS 57 -5.429 -19.289 -0.678 450 HZ2 LYS 57 HZ2 LYS 57 -6.067 -19.892 -2.129 451 HZ3 LYS 57 HZ3 LYS 57 -7.089 -19.140 -1.007 452 H LEU 58 H LEU 58 -3.440 -14.653 2.999 453 HA LEU 58 HA LEU 58 -4.821 -12.433 4.207 454 HB2 LEU 58 HB2 LEU 58 -4.006 -14.348 5.537 455 HB3 LEU 58 HB3 LEU 58 -2.364 -13.988 5.062 456 HG LEU 58 HG LEU 58 -3.194 -13.334 7.428 457 HD11 LEU 58 HD11 LEU 58 -1.709 -11.386 7.465 458 HD12 LEU 58 HD12 LEU 58 -1.680 -11.391 5.700 459 HD13 LEU 58 HD13 LEU 58 -1.013 -12.755 6.598 460 HD21 LEU 58 HD21 LEU 58 -4.190 -11.183 7.673 461 HD22 LEU 58 HD22 LEU 58 -5.220 -12.142 6.614 462 HD23 LEU 58 HD23 LEU 58 -4.158 -10.907 5.934 463 H ALA 59 H ALA 59 -1.728 -13.100 2.706 464 HA ALA 59 HA ALA 59 -0.418 -10.687 3.233 465 HB1 ALA 59 HB1 ALA 59 1.024 -11.286 1.337 466 HB2 ALA 59 HB2 ALA 59 -0.117 -12.551 0.882 467 HB3 ALA 59 HB3 ALA 59 0.745 -12.649 2.421 468 H VAL 60 H VAL 60 -2.510 -11.611 0.505 469 HA VAL 60 HA VAL 60 -2.145 -9.117 -0.856 470 HB VAL 60 HB VAL 60 -3.981 -9.761 -2.325 471 HG11 VAL 60 HG11 VAL 60 -2.167 -12.106 -1.772 472 HG12 VAL 60 HG12 VAL 60 -1.743 -10.683 -2.728 473 HG13 VAL 60 HG13 VAL 60 -3.022 -11.768 -3.278 474 HG21 VAL 60 HG21 VAL 60 -5.429 -11.511 -1.988 475 HG22 VAL 60 HG22 VAL 60 -5.217 -10.921 -0.338 476 HG23 VAL 60 HG23 VAL 60 -4.335 -12.344 -0.889 477 H LEU 61 H LEU 61 -4.269 -10.249 1.632 478 HA LEU 61 HA LEU 61 -6.342 -8.362 1.345 479 HB2 LEU 61 HB2 LEU 61 -6.344 -10.460 2.778 480 HB3 LEU 61 HB3 LEU 61 -5.405 -9.555 3.951 481 HG LEU 61 HG LEU 61 -7.406 -7.844 3.754 482 HD11 LEU 61 HD11 LEU 61 -8.753 -10.448 3.066 483 HD12 LEU 61 HD12 LEU 61 -8.503 -9.117 1.937 484 HD13 LEU 61 HD13 LEU 61 -9.532 -8.892 3.352 485 HD21 LEU 61 HD21 LEU 61 -6.749 -8.927 5.811 486 HD22 LEU 61 HD22 LEU 61 -7.516 -10.429 5.297 487 HD23 LEU 61 HD23 LEU 61 -8.503 -9.009 5.635 488 H THR 62 H THR 62 -3.277 -8.313 3.078 489 HA THR 62 HA THR 62 -3.729 -5.790 4.320 490 HB THR 62 HB THR 62 -0.997 -6.054 4.215 491 HG1 THR 62 HG1 THR 62 -0.999 -8.050 3.209 492 HG21 THR 62 HG21 THR 62 -2.846 -7.386 6.186 493 HG22 THR 62 HG22 THR 62 -2.393 -5.680 6.202 494 HG23 THR 62 HG23 THR 62 -1.169 -6.918 6.466 495 H ALA 63 H ALA 63 -2.096 -6.859 1.386 496 HA ALA 63 HA ALA 63 -0.838 -4.489 0.648 497 HB1 ALA 63 HB1 ALA 63 -0.732 -5.408 -1.578 498 HB2 ALA 63 HB2 ALA 63 -2.019 -6.553 -1.204 499 HB3 ALA 63 HB3 ALA 63 -0.456 -6.688 -0.399 500 H VAL 64 H VAL 64 -4.103 -5.633 -0.147 501 HA VAL 64 HA VAL 64 -4.702 -3.337 -1.730 502 HB VAL 64 HB VAL 64 -5.773 -5.564 -2.062 503 HG11 VAL 64 HG11 VAL 64 -7.773 -6.085 -0.674 504 HG12 VAL 64 HG12 VAL 64 -7.250 -4.836 0.457 505 HG13 VAL 64 HG13 VAL 64 -6.236 -6.251 0.175 506 HG21 VAL 64 HG21 VAL 64 -6.712 -3.639 -3.129 507 HG22 VAL 64 HG22 VAL 64 -7.578 -3.189 -1.661 508 HG23 VAL 64 HG23 VAL 64 -8.028 -4.651 -2.537 509 H GLN 65 H GLN 65 -5.314 -4.197 1.654 510 HA GLN 65 HA GLN 65 -7.099 -2.054 2.152 511 HB2 GLN 65 HB2 GLN 65 -5.414 -3.771 3.953 512 HB3 GLN 65 HB3 GLN 65 -6.385 -2.445 4.587 513 HG2 GLN 65 HG2 GLN 65 -8.397 -3.468 3.605 514 HG3 GLN 65 HG3 GLN 65 -7.415 -4.809 3.020 515 HE21 GLN 65 HE21 GLN 65 -6.519 -6.249 4.512 516 HE22 GLN 65 HE22 GLN 65 -7.165 -6.408 6.109 517 H ILE 66 H ILE 66 -3.599 -2.402 2.682 518 HA ILE 66 HA ILE 66 -3.111 0.120 3.780 519 HB ILE 66 HB ILE 66 -1.355 -1.641 2.054 520 HG12 ILE 66 HG12 ILE 66 -1.229 -1.068 5.023 521 HG13 ILE 66 HG13 ILE 66 -2.084 -2.443 4.332 522 HG21 ILE 66 HG21 ILE 66 -0.559 0.840 3.572 523 HG22 ILE 66 HG22 ILE 66 -0.597 0.658 1.820 524 HG23 ILE 66 HG23 ILE 66 0.548 -0.279 2.775 525 HD11 ILE 66 HD11 ILE 66 0.862 -1.907 4.393 526 HD12 ILE 66 HD12 ILE 66 0.153 -3.069 3.272 527 HD13 ILE 66 HD13 ILE 66 -0.027 -3.299 5.011 528 H ALA 67 H ALA 67 -3.354 -0.956 0.445 529 HA ALA 67 HA ALA 67 -2.550 1.389 -0.846 530 HB1 ALA 67 HB1 ALA 67 -4.568 -0.615 -1.843 531 HB2 ALA 67 HB2 ALA 67 -2.822 -0.830 -1.920 532 HB3 ALA 67 HB3 ALA 67 -3.586 0.481 -2.816 533 H SER 68 H SER 68 -5.833 0.297 0.051 534 HA SER 68 HA SER 68 -7.180 2.520 -1.016 535 HB2 SER 68 HB2 SER 68 -8.856 1.757 0.967 536 HB3 SER 68 HB3 SER 68 -8.727 0.917 -0.581 537 HG SER 68 HG SER 68 -7.247 0.260 1.756 538 H GLU 69 H GLU 69 -5.996 1.927 2.290 539 HA GLU 69 HA GLU 69 -7.063 4.253 3.445 540 HB2 GLU 69 HB2 GLU 69 -4.767 2.459 4.174 541 HB3 GLU 69 HB3 GLU 69 -5.130 3.894 5.122 542 HG2 GLU 69 HG2 GLU 69 -7.068 1.658 4.572 543 HG3 GLU 69 HG3 GLU 69 -6.122 1.836 6.049 544 H TYR 70 H TYR 70 -4.116 3.727 1.612 545 HA TYR 70 HA TYR 70 -3.196 6.415 2.212 546 HB2 TYR 70 HB2 TYR 70 -2.015 4.052 0.820 547 HB3 TYR 70 HB3 TYR 70 -1.376 5.651 0.465 548 HD1 TYR 70 HD1 TYR 70 -0.470 7.041 2.367 549 HD2 TYR 70 HD2 TYR 70 -1.440 2.927 2.814 550 HE1 TYR 70 HE1 TYR 70 0.900 6.946 4.406 551 HE2 TYR 70 HE2 TYR 70 -0.070 2.818 4.854 552 HH TYR 70 HH TYR 70 1.030 5.555 6.474 553 H LEU 71 H LEU 71 -4.975 4.769 -0.236 554 HA LEU 71 HA LEU 71 -4.462 6.611 -2.347 555 HB2 LEU 71 HB2 LEU 71 -6.313 4.358 -1.902 556 HB3 LEU 71 HB3 LEU 71 -6.884 5.586 -3.014 557 HG LEU 71 HG LEU 71 -4.190 4.247 -3.331 558 HD11 LEU 71 HD11 LEU 71 -5.216 2.812 -5.025 559 HD12 LEU 71 HD12 LEU 71 -6.805 3.436 -4.595 560 HD13 LEU 71 HD13 LEU 71 -5.878 2.496 -3.425 561 HD21 LEU 71 HD21 LEU 71 -5.942 5.797 -5.241 562 HD22 LEU 71 HD22 LEU 71 -4.443 4.981 -5.671 563 HD23 LEU 71 HD23 LEU 71 -4.413 6.332 -4.545 564 H LYS 72 H LYS 72 -6.866 6.412 0.215 565 HA LYS 72 HA LYS 72 -8.425 8.580 -0.802 566 HB2 LYS 72 HB2 LYS 72 -9.604 8.506 1.315 567 HB3 LYS 72 HB3 LYS 72 -9.375 6.875 0.708 568 HG2 LYS 72 HG2 LYS 72 -8.681 6.408 2.776 569 HG3 LYS 72 HG3 LYS 72 -7.178 7.199 2.302 570 HD2 LYS 72 HD2 LYS 72 -7.882 8.136 4.391 571 HD3 LYS 72 HD3 LYS 72 -8.137 9.350 3.136 572 HE2 LYS 72 HE2 LYS 72 -10.526 8.574 3.023 573 HE3 LYS 72 HE3 LYS 72 -10.203 7.594 4.451 574 HZ1 LYS 72 HZ1 LYS 72 -11.194 9.693 5.056 575 HZ2 LYS 72 HZ2 LYS 72 -9.968 10.547 4.269 576 HZ3 LYS 72 HZ3 LYS 72 -9.610 9.624 5.640 577 H LEU 73 H LEU 73 -5.509 8.311 0.950 578 HA LEU 73 HA LEU 73 -5.572 10.878 2.209 579 HB2 LEU 73 HB2 LEU 73 -4.185 8.936 2.985 580 HB3 LEU 73 HB3 LEU 73 -3.175 9.152 1.571 581 HG LEU 73 HG LEU 73 -2.521 11.388 2.384 582 HD11 LEU 73 HD11 LEU 73 -4.323 12.160 3.659 583 HD12 LEU 73 HD12 LEU 73 -3.063 11.834 4.848 584 HD13 LEU 73 HD13 LEU 73 -4.387 10.690 4.626 585 HD21 LEU 73 HD21 LEU 73 -1.182 9.426 2.927 586 HD22 LEU 73 HD22 LEU 73 -2.127 9.184 4.395 587 HD23 LEU 73 HD23 LEU 73 -1.124 10.623 4.220 588 H LYS 74 H LYS 74 -4.013 9.536 -0.692 589 HA LYS 74 HA LYS 74 -2.902 12.017 -1.518 590 HB2 LYS 74 HB2 LYS 74 -2.476 10.919 -3.676 591 HB3 LYS 74 HB3 LYS 74 -1.975 9.907 -2.331 592 HG2 LYS 74 HG2 LYS 74 -3.046 8.291 -3.440 593 HG3 LYS 74 HG3 LYS 74 -4.504 9.007 -2.751 594 HD2 LYS 74 HD2 LYS 74 -5.055 8.874 -4.986 595 HD3 LYS 74 HD3 LYS 74 -4.434 10.521 -4.867 596 HE2 LYS 74 HE2 LYS 74 -2.310 9.839 -5.771 597 HE3 LYS 74 HE3 LYS 74 -2.797 8.143 -5.738 598 HZ1 LYS 74 HZ1 LYS 74 -4.099 10.250 -7.378 599 HZ2 LYS 74 HZ2 LYS 74 -4.469 8.600 -7.388 600 HZ3 LYS 74 HZ3 LYS 74 -2.971 9.132 -7.958 601 H GLU 75 H GLU 75 -5.985 10.498 -1.909 602 HA GLU 75 HA GLU 75 -7.005 11.974 -4.066 603 HB2 GLU 75 HB2 GLU 75 -8.079 9.956 -3.169 604 HB3 GLU 75 HB3 GLU 75 -8.435 10.798 -1.670 605 HG2 GLU 75 HG2 GLU 75 -10.423 10.683 -2.984 606 HG3 GLU 75 HG3 GLU 75 -9.874 12.360 -2.936 607 H GLU 76 H GLU 76 -6.973 12.571 -0.594 608 HA GLU 76 HA GLU 76 -8.490 14.967 -0.674 609 HB2 GLU 76 HB2 GLU 76 -8.196 13.581 1.361 610 HB3 GLU 76 HB3 GLU 76 -6.498 14.032 1.402 611 HG2 GLU 76 HG2 GLU 76 -6.920 16.111 2.185 612 HG3 GLU 76 HG3 GLU 76 -8.472 16.228 1.355 613 H TYR 77 H TYR 77 -5.073 14.220 -0.921 614 HA TYR 77 HA TYR 77 -3.984 16.767 -0.612 615 HB2 TYR 77 HB2 TYR 77 -2.629 14.731 -0.669 616 HB3 TYR 77 HB3 TYR 77 -3.058 14.463 -2.349 617 HD1 TYR 77 HD1 TYR 77 -2.133 17.783 -0.991 618 HD2 TYR 77 HD2 TYR 77 -0.835 14.373 -3.170 619 HE1 TYR 77 HE1 TYR 77 -0.117 19.001 -1.671 620 HE2 TYR 77 HE2 TYR 77 1.194 15.578 -3.860 621 HH TYR 77 HH TYR 77 2.583 17.465 -3.111 622 H GLN 78 H GLN 78 -5.222 15.138 -3.491 623 HA GLN 78 HA GLN 78 -4.616 17.288 -5.271 624 HB2 GLN 78 HB2 GLN 78 -6.446 14.904 -5.570 625 HB3 GLN 78 HB3 GLN 78 -6.047 16.017 -6.871 626 HG2 GLN 78 HG2 GLN 78 -3.806 15.330 -6.924 627 HG3 GLN 78 HG3 GLN 78 -3.927 14.530 -5.360 628 HE21 GLN 78 HE21 GLN 78 -4.677 14.325 -8.752 629 HE22 GLN 78 HE22 GLN 78 -5.032 12.632 -8.771 630 H ARG 79 H ARG 79 -7.299 16.492 -3.216 631 HA ARG 79 HA ARG 79 -9.201 18.205 -4.523 632 HB2 ARG 79 HB2 ARG 79 -9.596 16.130 -2.974 633 HB3 ARG 79 HB3 ARG 79 -9.452 17.302 -1.672 634 HG2 ARG 79 HG2 ARG 79 -11.774 16.937 -2.236 635 HG3 ARG 79 HG3 ARG 79 -11.302 18.590 -2.628 636 HD2 ARG 79 HD2 ARG 79 -12.716 17.325 -4.339 637 HD3 ARG 79 HD3 ARG 79 -11.285 18.169 -4.925 638 HE ARG 79 HE ARG 79 -11.215 15.279 -4.340 639 HH11 ARG 79 HH11 ARG 79 -10.828 17.944 -6.589 640 HH12 ARG 79 HH12 ARG 79 -10.025 16.968 -7.782 641 HH21 ARG 79 HH21 ARG 79 -10.142 14.002 -5.920 642 HH22 ARG 79 HH22 ARG 79 -9.633 14.753 -7.407 643 H LEU 80 H LEU 80 -7.015 18.419 -1.809 644 HA LEU 80 HA LEU 80 -7.925 20.942 -0.852 645 HB2 LEU 80 HB2 LEU 80 -6.806 19.522 0.677 646 HB3 LEU 80 HB3 LEU 80 -5.449 19.294 -0.410 647 HG LEU 80 HG LEU 80 -5.239 21.941 -0.049 648 HD11 LEU 80 HD11 LEU 80 -7.188 22.039 1.437 649 HD12 LEU 80 HD12 LEU 80 -5.701 22.538 2.248 650 HD13 LEU 80 HD13 LEU 80 -6.377 20.938 2.554 651 HD21 LEU 80 HD21 LEU 80 -3.444 20.373 0.307 652 HD22 LEU 80 HD22 LEU 80 -4.189 19.808 1.805 653 HD23 LEU 80 HD23 LEU 80 -3.565 21.454 1.695 654 H ARG 81 H ARG 81 -5.231 19.922 -2.923 655 HA ARG 81 HA ARG 81 -4.035 22.455 -3.167 656 HB2 ARG 81 HB2 ARG 81 -3.871 19.902 -4.695 657 HB3 ARG 81 HB3 ARG 81 -3.153 21.351 -5.386 658 HG2 ARG 81 HG2 ARG 81 -2.397 21.073 -2.622 659 HG3 ARG 81 HG3 ARG 81 -2.008 19.611 -3.527 660 HD2 ARG 81 HD2 ARG 81 -0.144 21.158 -3.580 661 HD3 ARG 81 HD3 ARG 81 -0.828 20.969 -5.194 662 HE ARG 81 HE ARG 81 -1.618 23.266 -3.540 663 HH11 ARG 81 HH11 ARG 81 0.034 22.010 -6.371 664 HH12 ARG 81 HH12 ARG 81 0.139 23.559 -7.145 665 HH21 ARG 81 HH21 ARG 81 -1.478 25.296 -4.563 666 HH22 ARG 81 HH22 ARG 81 -0.743 25.424 -6.130 667 H GLU 82 H GLU 82 -6.594 20.928 -5.081 668 HA GLU 82 HA GLU 82 -6.531 22.937 -7.111 669 HB2 GLU 82 HB2 GLU 82 -8.476 21.901 -8.028 670 HB3 GLU 82 HB3 GLU 82 -7.399 20.627 -7.472 671 HG2 GLU 82 HG2 GLU 82 -8.758 20.118 -5.644 672 HG3 GLU 82 HG3 GLU 82 -9.646 21.635 -5.773 673 H GLN 83 H GLN 83 -7.680 22.963 -3.946 674 HA GLN 83 HA GLN 83 -9.976 24.606 -4.260 675 HB2 GLN 83 HB2 GLN 83 -9.609 23.397 -2.184 676 HB3 GLN 83 HB3 GLN 83 -8.101 24.260 -1.913 677 HG2 GLN 83 HG2 GLN 83 -9.493 26.381 -1.876 678 HG3 GLN 83 HG3 GLN 83 -10.901 25.327 -1.778 679 HE21 GLN 83 HE21 GLN 83 -11.290 24.184 0.083 680 HE22 GLN 83 HE22 GLN 83 -10.471 24.516 1.568 681 H LEU 84 H LEU 84 -6.566 25.183 -4.235 682 HA LEU 84 HA LEU 84 -6.888 28.057 -3.931 683 HB2 LEU 84 HB2 LEU 84 -4.711 26.161 -3.662 684 HB3 LEU 84 HB3 LEU 84 -4.241 27.512 -4.667 685 HG LEU 84 HG LEU 84 -3.652 27.802 -2.274 686 HD11 LEU 84 HD11 LEU 84 -3.767 29.808 -3.458 687 HD12 LEU 84 HD12 LEU 84 -4.779 30.090 -2.042 688 HD13 LEU 84 HD13 LEU 84 -5.521 29.736 -3.600 689 HD21 LEU 84 HD21 LEU 84 -6.598 28.136 -1.756 690 HD22 LEU 84 HD22 LEU 84 -5.280 28.119 -0.590 691 HD23 LEU 84 HD23 LEU 84 -5.733 26.635 -1.426 692 H LYS 85 H LYS 85 -7.742 26.268 -6.291 693 HA LYS 85 HA LYS 85 -6.463 27.867 -8.404 694 HB2 LYS 85 HB2 LYS 85 -7.725 25.122 -8.527 695 HB3 LYS 85 HB3 LYS 85 -7.223 26.027 -9.946 696 HG2 LYS 85 HG2 LYS 85 -4.915 26.019 -9.118 697 HG3 LYS 85 HG3 LYS 85 -5.431 25.072 -7.724 698 HD2 LYS 85 HD2 LYS 85 -4.508 23.550 -9.313 699 HD3 LYS 85 HD3 LYS 85 -6.259 23.325 -9.322 700 HE2 LYS 85 HE2 LYS 85 -5.149 25.286 -11.246 701 HE3 LYS 85 HE3 LYS 85 -4.800 23.586 -11.556 702 HZ1 LYS 85 HZ1 LYS 85 -7.550 24.535 -11.027 703 HZ2 LYS 85 HZ2 LYS 85 -7.057 23.093 -11.756 704 HZ3 LYS 85 HZ3 LYS 85 -6.888 24.555 -12.581 705 H LYS 86 H LYS 86 -8.099 27.869 -10.415 706 HA LYS 86 HA LYS 86 -10.686 28.793 -9.351 707 HB2 LYS 86 HB2 LYS 86 -9.243 30.588 -10.293 708 HB3 LYS 86 HB3 LYS 86 -9.258 29.747 -11.837 709 HG2 LYS 86 HG2 LYS 86 -11.715 30.015 -11.914 710 HG3 LYS 86 HG3 LYS 86 -11.624 30.955 -10.423 711 HD2 LYS 86 HD2 LYS 86 -9.728 31.973 -12.309 712 HD3 LYS 86 HD3 LYS 86 -11.315 31.862 -13.076 713 HE2 LYS 86 HE2 LYS 86 -10.902 33.124 -10.378 714 HE3 LYS 86 HE3 LYS 86 -10.777 34.033 -11.882 715 HZ1 LYS 86 HZ1 LYS 86 -13.164 32.571 -10.907 716 HZ2 LYS 86 HZ2 LYS 86 -13.057 33.346 -12.403 717 HZ3 LYS 86 HZ3 LYS 86 -12.969 34.247 -10.978 718 H1 GLY 1 H1 GLY 1 -26.675 -8.146 -0.659 719 H2 GLY 1 H2 GLY 1 -26.196 -7.158 0.624 720 H3 GLY 1 H3 GLY 1 -25.474 -6.984 -0.891 721 HA2 GLY 1 HA3 GLY 1 -27.545 -6.234 -1.847 722 HA3 GLY 1 HA2 GLY 1 -28.329 -6.449 -0.288 723 H SER 2 H SER 2 -28.288 -4.007 -1.690 724 HA SER 2 HA SER 2 -26.806 -2.388 0.244 725 HB2 SER 2 HB2 SER 2 -26.846 -1.825 -2.731 726 HB3 SER 2 HB3 SER 2 -26.053 -0.853 -1.497 727 HG SER 2 HG SER 2 -25.368 -3.417 -2.449 728 H HIS 3 H HIS 3 -27.591 -0.137 0.338 729 HA HIS 3 HA HIS 3 -30.385 0.151 -0.553 730 HB2 HIS 3 HB2 HIS 3 -29.251 0.664 2.197 731 HB3 HIS 3 HB3 HIS 3 -30.737 1.429 1.652 732 HD1 HIS 3 HD1 HIS 3 -32.310 -0.750 0.412 733 HD2 HIS 3 HD2 HIS 3 -29.966 -1.384 3.784 734 HE1 HIS 3 HE1 HIS 3 -33.250 -2.808 1.511 735 HE2 HIS 3 HE2 HIS 3 -31.878 -3.114 3.603 736 H MET 4 H MET 4 -31.029 2.244 -1.076 737 HA MET 4 HA MET 4 -28.902 3.959 -1.944 738 HB2 MET 4 HB2 MET 4 -31.906 4.256 -2.016 739 HB3 MET 4 HB3 MET 4 -30.808 5.478 -2.640 740 HG2 MET 4 HG2 MET 4 -31.092 2.646 -3.607 741 HG3 MET 4 HG3 MET 4 -31.613 4.111 -4.439 742 HE1 MET 4 HE1 MET 4 -28.595 2.696 -6.559 743 HE2 MET 4 HE2 MET 4 -30.342 2.929 -6.485 744 HE3 MET 4 HE3 MET 4 -29.580 1.660 -5.528 745 H THR 5 H THR 5 -27.824 4.673 -0.155 746 HA THR 5 HA THR 5 -29.139 6.805 1.325 747 HB THR 5 HB THR 5 -27.502 5.210 3.129 748 HG1 THR 5 HG1 THR 5 -28.829 3.715 1.540 749 HG21 THR 5 HG21 THR 5 -29.034 7.035 3.793 750 HG22 THR 5 HG22 THR 5 -29.407 5.517 4.608 751 HG23 THR 5 HG23 THR 5 -30.400 6.057 3.256 752 H GLU 6 H GLU 6 -26.891 6.968 3.213 753 HA GLU 6 HA GLU 6 -25.046 8.328 1.466 754 HB2 GLU 6 HB2 GLU 6 -23.834 8.637 3.813 755 HB3 GLU 6 HB3 GLU 6 -25.219 9.611 3.348 756 HG2 GLU 6 HG2 GLU 6 -25.899 9.037 5.415 757 HG3 GLU 6 HG3 GLU 6 -26.512 7.628 4.565 758 H GLN 7 H GLN 7 -22.596 7.996 2.041 759 HA GLN 7 HA GLN 7 -22.129 5.090 1.956 760 HB2 GLN 7 HB2 GLN 7 -20.393 7.216 0.692 761 HB3 GLN 7 HB3 GLN 7 -20.288 5.474 0.464 762 HG2 GLN 7 HG2 GLN 7 -22.259 5.412 -0.813 763 HG3 GLN 7 HG3 GLN 7 -22.726 7.037 -0.311 764 HE21 GLN 7 HE21 GLN 7 -22.459 6.010 -2.995 765 HE22 GLN 7 HE22 GLN 7 -21.255 6.978 -3.778 766 HA PRO 8 HA PRO 8 -19.615 6.395 5.535 767 HB2 PRO 8 HB2 PRO 8 -20.422 4.525 7.260 768 HB3 PRO 8 HB3 PRO 8 -21.448 5.917 6.897 769 HG2 PRO 8 HG2 PRO 8 -21.655 3.107 5.926 770 HG3 PRO 8 HG3 PRO 8 -22.942 4.251 6.341 771 HD2 PRO 8 HD2 PRO 8 -22.022 3.672 3.757 772 HD3 PRO 8 HD3 PRO 8 -23.020 5.063 4.221 773 H LYS 9 H LYS 9 -17.952 5.022 6.794 774 HA LYS 9 HA LYS 9 -16.489 3.419 4.968 775 HB2 LYS 9 HB2 LYS 9 -16.200 3.932 7.915 776 HB3 LYS 9 HB3 LYS 9 -15.162 2.782 7.086 777 HG2 LYS 9 HG2 LYS 9 -14.679 4.748 5.473 778 HG3 LYS 9 HG3 LYS 9 -15.320 5.753 6.776 779 HD2 LYS 9 HD2 LYS 9 -13.122 5.746 7.385 780 HD3 LYS 9 HD3 LYS 9 -13.630 4.278 8.214 781 HE2 LYS 9 HE2 LYS 9 -12.885 2.964 6.253 782 HE3 LYS 9 HE3 LYS 9 -12.291 4.447 5.516 783 HZ1 LYS 9 HZ1 LYS 9 -11.303 3.151 7.989 784 HZ2 LYS 9 HZ2 LYS 9 -10.854 4.710 7.525 785 HZ3 LYS 9 HZ3 LYS 9 -10.453 3.386 6.546 786 H THR 10 H THR 10 -17.638 1.697 4.256 787 HA THR 10 HA THR 10 -18.394 -0.308 6.269 788 HB THR 10 HB THR 10 -20.314 0.745 5.043 789 HG1 THR 10 HG1 THR 10 -21.362 -1.147 5.021 790 HG21 THR 10 HG21 THR 10 -20.727 0.008 2.718 791 HG22 THR 10 HG22 THR 10 -19.104 -0.685 2.674 792 HG23 THR 10 HG23 THR 10 -19.316 1.057 2.859 793 H ARG 11 H ARG 11 -18.779 -2.487 4.693 794 HA ARG 11 HA ARG 11 -16.052 -2.972 3.727 795 HB2 ARG 11 HB2 ARG 11 -16.411 -5.297 4.153 796 HB3 ARG 11 HB3 ARG 11 -16.966 -4.410 5.565 797 HG2 ARG 11 HG2 ARG 11 -19.288 -4.615 4.722 798 HG3 ARG 11 HG3 ARG 11 -18.681 -5.626 3.410 799 HD2 ARG 11 HD2 ARG 11 -17.768 -7.190 5.090 800 HD3 ARG 11 HD3 ARG 11 -18.482 -6.197 6.362 801 HE ARG 11 HE ARG 11 -20.402 -7.023 4.408 802 HH11 ARG 11 HH11 ARG 11 -18.671 -8.023 7.280 803 HH12 ARG 11 HH12 ARG 11 -19.874 -9.171 7.763 804 HH21 ARG 11 HH21 ARG 11 -21.979 -8.540 5.028 805 HH22 ARG 11 HH22 ARG 11 -21.757 -9.471 6.473 806 H VAL 12 H VAL 12 -15.641 -3.868 1.745 807 HA VAL 12 HA VAL 12 -17.931 -4.146 -0.081 808 HB VAL 12 HB VAL 12 -16.838 -1.963 -0.468 809 HG11 VAL 12 HG11 VAL 12 -14.558 -1.976 -1.522 810 HG12 VAL 12 HG12 VAL 12 -14.395 -3.642 -0.967 811 HG13 VAL 12 HG13 VAL 12 -14.604 -2.337 0.199 812 HG21 VAL 12 HG21 VAL 12 -16.442 -3.953 -2.700 813 HG22 VAL 12 HG22 VAL 12 -16.499 -2.200 -2.892 814 HG23 VAL 12 HG23 VAL 12 -17.925 -3.073 -2.331 815 H SER 13 H SER 13 -17.744 -5.744 -1.630 816 HA SER 13 HA SER 13 -15.726 -7.770 -1.101 817 HB2 SER 13 HB2 SER 13 -17.949 -8.004 -3.122 818 HB3 SER 13 HB3 SER 13 -17.168 -9.282 -2.191 819 HG SER 13 HG SER 13 -18.677 -9.027 -0.763 820 H VAL 14 H VAL 14 -13.925 -7.922 -2.316 821 HA VAL 14 HA VAL 14 -13.995 -6.762 -5.030 822 HB VAL 14 HB VAL 14 -11.569 -6.238 -4.752 823 HG11 VAL 14 HG11 VAL 14 -11.939 -4.192 -3.434 824 HG12 VAL 14 HG12 VAL 14 -13.486 -4.845 -2.890 825 HG13 VAL 14 HG13 VAL 14 -13.231 -4.490 -4.598 826 HG21 VAL 14 HG21 VAL 14 -12.071 -6.614 -1.804 827 HG22 VAL 14 HG22 VAL 14 -10.560 -6.156 -2.590 828 HG23 VAL 14 HG23 VAL 14 -11.213 -7.779 -2.813 829 H ARG 15 H ARG 15 -12.432 -7.643 -6.531 830 HA ARG 15 HA ARG 15 -11.756 -10.446 -5.941 831 HB2 ARG 15 HB2 ARG 15 -13.663 -10.124 -7.548 832 HB3 ARG 15 HB3 ARG 15 -12.531 -9.330 -8.635 833 HG2 ARG 15 HG2 ARG 15 -11.323 -11.752 -7.968 834 HG3 ARG 15 HG3 ARG 15 -13.025 -12.133 -8.233 835 HD2 ARG 15 HD2 ARG 15 -12.040 -12.337 -10.345 836 HD3 ARG 15 HD3 ARG 15 -12.824 -10.761 -10.375 837 HE ARG 15 HE ARG 15 -10.452 -9.945 -9.723 838 HH11 ARG 15 HH11 ARG 15 -11.197 -12.604 -11.879 839 HH12 ARG 15 HH12 ARG 15 -9.737 -12.438 -12.799 840 HH21 ARG 15 HH21 ARG 15 -8.495 -9.740 -10.923 841 HH22 ARG 15 HH22 ARG 15 -8.214 -10.811 -12.261 842 H ILE 16 H ILE 16 -9.605 -10.520 -5.691 843 HA ILE 16 HA ILE 16 -7.930 -9.049 -7.624 844 HB ILE 16 HB ILE 16 -7.081 -9.722 -4.806 845 HG12 ILE 16 HG12 ILE 16 -7.889 -6.969 -5.695 846 HG13 ILE 16 HG13 ILE 16 -9.087 -8.092 -5.062 847 HG21 ILE 16 HG21 ILE 16 -5.296 -9.371 -6.456 848 HG22 ILE 16 HG22 ILE 16 -5.307 -8.118 -5.212 849 HG23 ILE 16 HG23 ILE 16 -5.958 -7.775 -6.815 850 HD11 ILE 16 HD11 ILE 16 -8.318 -6.620 -3.321 851 HD12 ILE 16 HD12 ILE 16 -6.645 -7.083 -3.626 852 HD13 ILE 16 HD13 ILE 16 -7.783 -8.269 -2.987 853 H TYR 17 H TYR 17 -6.526 -10.218 -8.764 854 HA TYR 17 HA TYR 17 -5.318 -11.949 -9.583 855 HB2 TYR 17 HB2 TYR 17 -4.544 -11.739 -6.969 856 HB3 TYR 17 HB3 TYR 17 -5.034 -13.427 -7.052 857 HD1 TYR 17 HD1 TYR 17 -2.744 -10.907 -8.540 858 HD2 TYR 17 HD2 TYR 17 -3.662 -15.045 -8.132 859 HE1 TYR 17 HE1 TYR 17 -0.576 -11.485 -9.560 860 HE2 TYR 17 HE2 TYR 17 -1.497 -15.630 -9.146 861 HH TYR 17 HH TYR 17 1.009 -13.354 -9.615 862 H GLY 18 H GLY 18 -8.255 -12.159 -9.234 863 HA2 GLY 18 HA2 GLY 18 -9.678 -13.762 -10.173 864 HA3 GLY 18 HA3 GLY 18 -8.420 -14.965 -9.961 865 H GLN 19 H GLN 19 -8.755 -13.335 -7.063 866 HA GLN 19 HA GLN 19 -10.699 -15.339 -6.112 867 HB2 GLN 19 HB2 GLN 19 -8.187 -14.320 -4.813 868 HB3 GLN 19 HB3 GLN 19 -9.471 -15.062 -3.872 869 HG2 GLN 19 HG2 GLN 19 -8.265 -16.923 -4.245 870 HG3 GLN 19 HG3 GLN 19 -9.187 -16.940 -5.745 871 HE21 GLN 19 HE21 GLN 19 -6.550 -14.760 -4.930 872 HE22 GLN 19 HE22 GLN 19 -5.466 -15.328 -6.153 873 H ASP 20 H ASP 20 -11.979 -14.745 -4.259 874 HA ASP 20 HA ASP 20 -12.727 -11.918 -4.361 875 HB2 ASP 20 HB2 ASP 20 -14.621 -13.251 -4.706 876 HB3 ASP 20 HB3 ASP 20 -14.128 -14.435 -3.505 877 H TYR 21 H TYR 21 -12.620 -10.559 -2.651 878 HA TYR 21 HA TYR 21 -11.821 -11.637 -0.040 879 HB2 TYR 21 HB2 TYR 21 -10.443 -9.302 -1.385 880 HB3 TYR 21 HB3 TYR 21 -10.095 -9.924 0.223 881 HD1 TYR 21 HD2 TYR 21 -9.206 -12.309 0.407 882 HD2 TYR 21 HD1 TYR 21 -9.355 -10.158 -3.260 883 HE1 TYR 21 HE2 TYR 21 -7.553 -13.852 -0.558 884 HE2 TYR 21 HE1 TYR 21 -7.707 -11.706 -4.238 885 HH TYR 21 HH TYR 21 -5.828 -13.226 -3.277 886 H THR 22 H THR 22 -12.367 -10.319 1.724 887 HA THR 22 HA THR 22 -14.344 -8.222 1.126 888 HB THR 22 HB THR 22 -14.083 -9.512 3.823 889 HG1 THR 22 HG1 THR 22 -15.169 -10.642 1.466 890 HG21 THR 22 HG21 THR 22 -16.499 -9.049 3.898 891 HG22 THR 22 HG22 THR 22 -16.420 -8.400 2.260 892 HG23 THR 22 HG23 THR 22 -15.567 -7.585 3.573 893 H ILE 23 H ILE 23 -13.645 -6.185 1.491 894 HA ILE 23 HA ILE 23 -11.678 -5.771 3.642 895 HB ILE 23 HB ILE 23 -10.642 -3.962 2.230 896 HG12 ILE 23 HG12 ILE 23 -12.168 -5.349 0.013 897 HG13 ILE 23 HG13 ILE 23 -12.520 -3.742 0.630 898 HG21 ILE 23 HG21 ILE 23 -10.421 -6.732 1.066 899 HG22 ILE 23 HG22 ILE 23 -9.671 -6.226 2.578 900 HG23 ILE 23 HG23 ILE 23 -9.190 -5.466 1.062 901 HD11 ILE 23 HD11 ILE 23 -11.321 -3.346 -1.309 902 HD12 ILE 23 HD12 ILE 23 -10.194 -4.667 -1.001 903 HD13 ILE 23 HD13 ILE 23 -10.103 -3.184 -0.040 904 H VAL 24 H VAL 24 -11.590 -3.527 4.428 905 HA VAL 24 HA VAL 24 -14.278 -2.365 4.464 906 HB VAL 24 HB VAL 24 -11.943 -1.808 6.304 907 HG11 VAL 24 HG11 VAL 24 -13.608 -0.737 7.738 908 HG12 VAL 24 HG12 VAL 24 -14.855 -1.052 6.530 909 HG13 VAL 24 HG13 VAL 24 -13.524 0.045 6.160 910 HG21 VAL 24 HG21 VAL 24 -14.382 -3.517 6.786 911 HG22 VAL 24 HG22 VAL 24 -13.102 -3.172 7.947 912 HG23 VAL 24 HG23 VAL 24 -12.750 -4.121 6.504 913 H GLY 25 H GLY 25 -14.641 -0.637 3.222 914 HA2 GLY 25 HA2 GLY 25 -13.113 1.692 3.213 915 HA3 GLY 25 HA3 GLY 25 -12.602 0.739 1.823 916 H ALA 26 H ALA 26 -14.283 3.309 2.325 917 HA ALA 26 HA ALA 26 -15.980 2.935 0.075 918 HB1 ALA 26 HB1 ALA 26 -17.305 1.828 1.874 919 HB2 ALA 26 HB2 ALA 26 -18.127 3.159 1.060 920 HB3 ALA 26 HB3 ALA 26 -17.430 3.404 2.661 921 H GLU 27 H GLU 27 -13.996 4.756 0.387 922 HA GLU 27 HA GLU 27 -15.100 7.256 1.360 923 HB2 GLU 27 HB2 GLU 27 -12.998 8.197 1.013 924 HB3 GLU 27 HB3 GLU 27 -12.589 6.526 1.360 925 HG2 GLU 27 HG2 GLU 27 -12.912 7.493 -1.456 926 HG3 GLU 27 HG3 GLU 27 -11.402 7.711 -0.576 927 H SER 28 H SER 28 -14.772 5.484 -1.548 928 HA SER 28 HA SER 28 -16.695 7.058 -2.925 929 HB2 SER 28 HB2 SER 28 -13.792 7.370 -3.589 930 HB3 SER 28 HB3 SER 28 -14.954 7.359 -4.913 931 HG SER 28 HG SER 28 -15.363 8.997 -2.656 932 HA PRO 29 HA PRO 29 -17.406 2.886 -4.259 933 HB2 PRO 29 HB2 PRO 29 -18.893 3.559 -6.513 934 HB3 PRO 29 HB3 PRO 29 -19.532 3.361 -4.880 935 HG2 PRO 29 HG2 PRO 29 -18.776 5.856 -6.333 936 HG3 PRO 29 HG3 PRO 29 -20.137 5.563 -5.234 937 HD2 PRO 29 HD2 PRO 29 -17.963 6.904 -4.436 938 HD3 PRO 29 HD3 PRO 29 -18.807 5.793 -3.339 939 H ALA 30 H ALA 30 -16.494 5.274 -6.767 940 HA ALA 30 HA ALA 30 -15.524 3.245 -8.544 941 HB1 ALA 30 HB1 ALA 30 -14.768 5.053 -9.923 942 HB2 ALA 30 HB2 ALA 30 -14.914 6.193 -8.588 943 HB3 ALA 30 HB3 ALA 30 -16.359 5.462 -9.284 944 H HIS 31 H HIS 31 -14.232 4.965 -5.886 945 HA HIS 31 HA HIS 31 -11.461 4.757 -6.557 946 HB2 HIS 31 HB2 HIS 31 -12.925 6.102 -4.620 947 HB3 HIS 31 HB3 HIS 31 -12.030 4.902 -3.701 948 HD1 HIS 31 HD1 HIS 31 -10.035 5.988 -2.748 949 HD2 HIS 31 HD2 HIS 31 -10.845 7.332 -6.603 950 HE1 HIS 31 HE1 HIS 31 -8.206 7.632 -3.301 951 HE2 HIS 31 HE2 HIS 31 -8.926 8.656 -5.493 952 H ILE 32 H ILE 32 -13.442 3.115 -4.113 953 HA ILE 32 HA ILE 32 -11.570 1.232 -3.310 954 HB ILE 32 HB ILE 32 -13.436 -0.119 -2.460 955 HG12 ILE 32 HG12 ILE 32 -15.204 1.883 -3.900 956 HG13 ILE 32 HG13 ILE 32 -15.013 0.188 -4.324 957 HG21 ILE 32 HG21 ILE 32 -12.558 1.942 -1.318 958 HG22 ILE 32 HG22 ILE 32 -14.179 1.444 -0.845 959 HG23 ILE 32 HG23 ILE 32 -13.960 2.797 -1.956 960 HD11 ILE 32 HD11 ILE 32 -15.901 -0.330 -2.006 961 HD12 ILE 32 HD12 ILE 32 -17.040 0.336 -3.173 962 HD13 ILE 32 HD13 ILE 32 -16.358 1.371 -1.922 963 H ARG 33 H ARG 33 -13.591 1.204 -6.151 964 HA ARG 33 HA ARG 33 -13.282 -1.579 -6.698 965 HB2 ARG 33 HB2 ARG 33 -14.167 0.740 -8.411 966 HB3 ARG 33 HB3 ARG 33 -14.115 -0.919 -8.996 967 HG2 ARG 33 HG2 ARG 33 -15.730 -1.604 -7.347 968 HG3 ARG 33 HG3 ARG 33 -15.715 0.001 -6.616 969 HD2 ARG 33 HD2 ARG 33 -17.647 -0.033 -7.936 970 HD3 ARG 33 HD3 ARG 33 -16.470 0.865 -8.890 971 HE ARG 33 HE ARG 33 -16.266 -1.790 -9.668 972 HH11 ARG 33 HH11 ARG 33 -18.682 0.747 -9.755 973 HH12 ARG 33 HH12 ARG 33 -19.485 0.101 -11.151 974 HH21 ARG 33 HH21 ARG 33 -17.320 -2.630 -11.502 975 HH22 ARG 33 HH22 ARG 33 -18.713 -1.814 -12.142 976 H LEU 34 H LEU 34 -11.529 1.337 -7.695 977 HA LEU 34 HA LEU 34 -9.913 -0.119 -9.569 978 HB2 LEU 34 HB2 LEU 34 -8.652 1.928 -9.872 979 HB3 LEU 34 HB3 LEU 34 -10.371 2.231 -9.971 980 HG LEU 34 HG LEU 34 -10.019 2.881 -7.405 981 HD11 LEU 34 HD11 LEU 34 -7.912 4.062 -7.092 982 HD12 LEU 34 HD12 LEU 34 -7.356 3.512 -8.674 983 HD13 LEU 34 HD13 LEU 34 -7.635 2.343 -7.381 984 HD21 LEU 34 HD21 LEU 34 -9.753 5.224 -8.165 985 HD22 LEU 34 HD22 LEU 34 -10.998 4.338 -9.047 986 HD23 LEU 34 HD23 LEU 34 -9.427 4.624 -9.792 987 H VAL 35 H VAL 35 -9.797 0.438 -6.188 988 HA VAL 35 HA VAL 35 -7.028 0.262 -5.719 989 HB VAL 35 HB VAL 35 -9.225 -0.805 -3.930 990 HG11 VAL 35 HG11 VAL 35 -7.631 -0.392 -2.119 991 HG12 VAL 35 HG12 VAL 35 -6.420 0.100 -3.302 992 HG13 VAL 35 HG13 VAL 35 -7.008 -1.561 -3.284 993 HG21 VAL 35 HG21 VAL 35 -9.207 1.365 -2.837 994 HG22 VAL 35 HG22 VAL 35 -9.621 1.539 -4.542 995 HG23 VAL 35 HG23 VAL 35 -8.003 1.951 -3.982 996 H ALA 36 H ALA 36 -9.522 -2.214 -6.042 997 HA ALA 36 HA ALA 36 -7.903 -4.442 -5.448 998 HB1 ALA 36 HB1 ALA 36 -10.331 -4.396 -7.230 999 HB2 ALA 36 HB2 ALA 36 -10.394 -4.407 -5.470 1000 HB3 ALA 36 HB3 ALA 36 -9.683 -5.770 -6.335 1001 H ALA 37 H ALA 37 -8.831 -2.939 -8.520 1002 HA ALA 37 HA ALA 37 -7.502 -4.735 -10.219 1003 HB1 ALA 37 HB1 ALA 37 -7.704 -2.972 -11.920 1004 HB2 ALA 37 HB2 ALA 37 -8.169 -1.825 -10.662 1005 HB3 ALA 37 HB3 ALA 37 -9.208 -3.203 -11.024 1006 H PHE 38 H PHE 38 -6.419 -1.892 -8.490 1007 HA PHE 38 HA PHE 38 -3.978 -1.450 -9.780 1008 HB2 PHE 38 HB2 PHE 38 -5.051 0.099 -8.142 1009 HB3 PHE 38 HB3 PHE 38 -4.622 -1.018 -6.854 1010 HD1 PHE 38 HD2 PHE 38 -3.018 0.873 -9.641 1011 HD2 PHE 38 HD1 PHE 38 -2.688 -0.631 -5.671 1012 HE1 PHE 38 HE2 PHE 38 -0.841 1.994 -9.402 1013 HE2 PHE 38 HE1 PHE 38 -0.511 0.489 -5.424 1014 HZ PHE 38 HZ PHE 38 0.417 1.804 -7.289 1015 H VAL 39 H VAL 39 -4.676 -3.333 -6.830 1016 HA VAL 39 HA VAL 39 -2.033 -4.313 -6.547 1017 HB VAL 39 HB VAL 39 -4.620 -5.422 -5.447 1018 HG11 VAL 39 HG11 VAL 39 -1.789 -6.029 -4.593 1019 HG12 VAL 39 HG12 VAL 39 -2.850 -7.125 -5.479 1020 HG13 VAL 39 HG13 VAL 39 -3.263 -6.633 -3.837 1021 HG21 VAL 39 HG21 VAL 39 -2.665 -3.378 -4.501 1022 HG22 VAL 39 HG22 VAL 39 -3.539 -4.358 -3.328 1023 HG23 VAL 39 HG23 VAL 39 -4.430 -3.348 -4.470 1024 H ASP 40 H ASP 40 -4.899 -5.554 -8.157 1025 HA ASP 40 HA ASP 40 -4.096 -8.163 -8.693 1026 HB2 ASP 40 HB2 ASP 40 -6.336 -6.898 -9.214 1027 HB3 ASP 40 HB3 ASP 40 -5.567 -6.551 -10.759 1028 H ASP 41 H ASP 41 -3.559 -5.221 -10.583 1029 HA ASP 41 HA ASP 41 -2.008 -6.534 -12.594 1030 HB2 ASP 41 HB2 ASP 41 -3.330 -4.394 -12.886 1031 HB3 ASP 41 HB3 ASP 41 -2.056 -3.574 -11.989 1032 H LYS 42 H LYS 42 -1.258 -4.609 -9.721 1033 HA LYS 42 HA LYS 42 1.493 -4.322 -10.089 1034 HB2 LYS 42 HB2 LYS 42 -0.211 -4.472 -7.613 1035 HB3 LYS 42 HB3 LYS 42 1.534 -4.295 -7.506 1036 HG2 LYS 42 HG2 LYS 42 0.449 -2.370 -9.345 1037 HG3 LYS 42 HG3 LYS 42 -0.378 -2.277 -7.790 1038 HD2 LYS 42 HD2 LYS 42 1.422 -0.811 -7.554 1039 HD3 LYS 42 HD3 LYS 42 1.989 -2.283 -6.762 1040 HE2 LYS 42 HE2 LYS 42 3.739 -1.383 -8.164 1041 HE3 LYS 42 HE3 LYS 42 3.162 -2.906 -8.837 1042 HZ1 LYS 42 HZ1 LYS 42 3.156 -0.305 -9.998 1043 HZ2 LYS 42 HZ2 LYS 42 1.616 -0.992 -10.028 1044 HZ3 LYS 42 HZ3 LYS 42 2.918 -1.753 -10.735 1045 H MET 43 H MET 43 -0.318 -6.948 -8.515 1046 HA MET 43 HA MET 43 1.970 -8.404 -7.714 1047 HB2 MET 43 HB2 MET 43 -0.900 -9.169 -8.145 1048 HB3 MET 43 HB3 MET 43 0.311 -10.374 -7.729 1049 HG2 MET 43 HG2 MET 43 0.859 -9.014 -5.708 1050 HG3 MET 43 HG3 MET 43 -0.522 -7.990 -6.104 1051 HE1 MET 43 HE1 MET 43 -0.246 -11.993 -6.450 1052 HE2 MET 43 HE2 MET 43 -0.721 -12.401 -4.803 1053 HE3 MET 43 HE3 MET 43 0.749 -11.471 -5.091 1054 H HIS 44 H HIS 44 -0.005 -8.473 -10.626 1055 HA HIS 44 HA HIS 44 1.051 -10.770 -11.808 1056 HB2 HIS 44 HB2 HIS 44 -0.962 -9.655 -12.639 1057 HB3 HIS 44 HB3 HIS 44 -0.003 -8.267 -13.138 1058 HD1 HIS 44 HD1 HIS 44 0.947 -8.318 -15.439 1059 HD2 HIS 44 HD2 HIS 44 -0.371 -12.057 -14.191 1060 HE1 HIS 44 HE1 HIS 44 1.137 -9.807 -17.451 1061 HE2 HIS 44 HE2 HIS 44 0.160 -12.009 -16.721 1062 H GLU 45 H GLU 45 2.068 -7.374 -12.222 1063 HA GLU 45 HA GLU 45 4.148 -7.966 -14.039 1064 HB2 GLU 45 HB2 GLU 45 4.936 -5.692 -13.628 1065 HB3 GLU 45 HB3 GLU 45 3.194 -5.725 -13.845 1066 HG2 GLU 45 HG2 GLU 45 2.812 -5.427 -11.513 1067 HG3 GLU 45 HG3 GLU 45 4.517 -5.685 -11.142 1068 H PHE 46 H PHE 46 4.088 -7.813 -10.516 1069 HA PHE 46 HA PHE 46 6.961 -8.015 -10.355 1070 HB2 PHE 46 HB2 PHE 46 4.759 -7.886 -8.326 1071 HB3 PHE 46 HB3 PHE 46 6.388 -8.351 -7.843 1072 HD1 PHE 46 HD1 PHE 46 8.252 -6.721 -8.956 1073 HD2 PHE 46 HD2 PHE 46 4.237 -5.665 -8.038 1074 HE1 PHE 46 HE1 PHE 46 8.898 -4.354 -8.875 1075 HE2 PHE 46 HE2 PHE 46 4.884 -3.298 -7.949 1076 HZ PHE 46 HZ PHE 46 7.210 -2.637 -8.372 1077 H SER 47 H SER 47 4.384 -10.240 -10.654 1078 HA SER 47 HA SER 47 5.452 -12.439 -9.247 1079 HB2 SER 47 HB2 SER 47 3.645 -12.351 -11.675 1080 HB3 SER 47 HB3 SER 47 4.027 -13.825 -10.791 1081 HG SER 47 HG SER 47 2.931 -11.544 -9.517 1082 H GLU 48 H GLU 48 6.145 -11.063 -12.363 1083 HA GLU 48 HA GLU 48 7.617 -13.314 -13.359 1084 HB2 GLU 48 HB2 GLU 48 7.732 -10.469 -14.355 1085 HB3 GLU 48 HB3 GLU 48 8.138 -11.930 -15.244 1086 HG2 GLU 48 HG2 GLU 48 5.639 -12.544 -14.732 1087 HG3 GLU 48 HG3 GLU 48 5.480 -10.796 -14.565 1088 H LYS 49 H LYS 49 8.323 -10.797 -11.191 1089 HA LYS 49 HA LYS 49 11.118 -10.572 -11.779 1090 HB2 LYS 49 HB2 LYS 49 9.539 -9.750 -9.336 1091 HB3 LYS 49 HB3 LYS 49 11.230 -9.355 -9.610 1092 HG2 LYS 49 HG2 LYS 49 9.354 -8.597 -11.755 1093 HG3 LYS 49 HG3 LYS 49 9.193 -7.727 -10.232 1094 HD2 LYS 49 HD2 LYS 49 10.695 -6.437 -11.475 1095 HD3 LYS 49 HD3 LYS 49 11.731 -7.366 -10.393 1096 HE2 LYS 49 HE2 LYS 49 12.225 -8.938 -12.156 1097 HE3 LYS 49 HE3 LYS 49 11.103 -8.121 -13.242 1098 HZ1 LYS 49 HZ1 LYS 49 13.665 -7.082 -12.174 1099 HZ2 LYS 49 HZ2 LYS 49 12.538 -6.108 -12.973 1100 HZ3 LYS 49 HZ3 LYS 49 13.266 -7.397 -13.788 1101 H GLN 50 H GLN 50 9.135 -12.630 -9.855 1102 HA GLN 50 HA GLN 50 9.533 -14.406 -8.499 1103 HB2 GLN 50 HB2 GLN 50 11.986 -14.583 -10.252 1104 HB3 GLN 50 HB3 GLN 50 11.420 -15.867 -9.190 1105 HG2 GLN 50 HG2 GLN 50 9.583 -16.329 -10.504 1106 HG3 GLN 50 HG3 GLN 50 9.590 -14.737 -11.260 1107 HE21 GLN 50 HE21 GLN 50 9.496 -15.666 -13.307 1108 HE22 GLN 50 HE22 GLN 50 10.878 -16.405 -14.039 1109 HA PRO 51 HA PRO 51 12.473 -11.964 -5.812 1110 HB2 PRO 51 HB2 PRO 51 10.790 -12.017 -3.624 1111 HB3 PRO 51 HB3 PRO 51 10.890 -10.699 -4.790 1112 HG2 PRO 51 HG2 PRO 51 8.871 -12.867 -4.559 1113 HG3 PRO 51 HG3 PRO 51 8.673 -11.189 -5.087 1114 HD2 PRO 51 HD2 PRO 51 8.753 -13.302 -6.815 1115 HD3 PRO 51 HD3 PRO 51 9.265 -11.661 -7.248 1116 H MET 52 H MET 52 10.278 -14.439 -4.480 1117 HA MET 52 HA MET 52 12.641 -15.930 -3.566 1118 HB2 MET 52 HB2 MET 52 10.021 -15.491 -2.128 1119 HB3 MET 52 HB3 MET 52 11.209 -16.688 -1.637 1120 HG2 MET 52 HG2 MET 52 11.674 -13.721 -1.788 1121 HG3 MET 52 HG3 MET 52 11.349 -14.641 -0.317 1122 HE1 MET 52 HE1 MET 52 15.251 -13.432 -0.645 1123 HE2 MET 52 HE2 MET 52 13.709 -12.986 0.085 1124 HE3 MET 52 HE3 MET 52 13.972 -12.739 -1.643 1125 H LEU 53 H LEU 53 10.484 -16.020 -5.861 1126 HA LEU 53 HA LEU 53 9.326 -17.576 -7.047 1127 HB2 LEU 53 HB2 LEU 53 11.423 -19.305 -5.739 1128 HB3 LEU 53 HB3 LEU 53 10.337 -19.888 -6.985 1129 HG LEU 53 HG LEU 53 12.005 -17.471 -7.531 1130 HD11 LEU 53 HD11 LEU 53 13.817 -18.866 -8.334 1131 HD12 LEU 53 HD12 LEU 53 12.970 -20.312 -7.784 1132 HD13 LEU 53 HD13 LEU 53 13.553 -19.132 -6.612 1133 HD21 LEU 53 HD21 LEU 53 11.030 -19.743 -9.251 1134 HD22 LEU 53 HD22 LEU 53 11.874 -18.297 -9.808 1135 HD23 LEU 53 HD23 LEU 53 10.263 -18.164 -9.108 1136 H ASP 54 H ASP 54 7.806 -16.893 -5.096 1137 HA ASP 54 HA ASP 54 6.345 -19.248 -4.378 1138 HB2 ASP 54 HB2 ASP 54 7.954 -19.330 -2.578 1139 HB3 ASP 54 HB3 ASP 54 7.735 -17.618 -2.242 1140 H VAL 55 H VAL 55 4.203 -18.761 -4.078 1141 HA VAL 55 HA VAL 55 3.246 -16.315 -5.014 1142 HB VAL 55 HB VAL 55 1.715 -18.369 -3.420 1143 HG11 VAL 55 HG11 VAL 55 0.732 -16.199 -5.271 1144 HG12 VAL 55 HG12 VAL 55 0.557 -16.218 -3.518 1145 HG13 VAL 55 HG13 VAL 55 -0.271 -17.427 -4.498 1146 HG21 VAL 55 HG21 VAL 55 2.704 -19.391 -5.359 1147 HG22 VAL 55 HG22 VAL 55 2.167 -18.060 -6.383 1148 HG23 VAL 55 HG23 VAL 55 0.984 -19.151 -5.664 1149 HA PRO 56 HA PRO 56 1.832 -15.056 -0.529 1150 HB2 PRO 56 HB2 PRO 56 3.364 -16.252 1.471 1151 HB3 PRO 56 HB3 PRO 56 1.689 -16.641 1.079 1152 HG2 PRO 56 HG2 PRO 56 4.196 -18.042 0.308 1153 HG3 PRO 56 HG3 PRO 56 2.593 -18.712 0.658 1154 HD2 PRO 56 HD2 PRO 56 3.551 -18.489 -1.854 1155 HD3 PRO 56 HD3 PRO 56 1.824 -18.314 -1.476 1156 H LYS 57 H LYS 57 5.205 -16.040 -1.007 1157 HA LYS 57 HA LYS 57 6.322 -13.810 0.376 1158 HB2 LYS 57 HB2 LYS 57 7.371 -15.976 -1.365 1159 HB3 LYS 57 HB3 LYS 57 8.356 -14.535 -1.206 1160 HG2 LYS 57 HG2 LYS 57 8.737 -16.544 0.385 1161 HG3 LYS 57 HG3 LYS 57 8.780 -14.903 1.028 1162 HD2 LYS 57 HD2 LYS 57 6.858 -15.176 2.219 1163 HD3 LYS 57 HD3 LYS 57 6.156 -16.283 1.037 1164 HE2 LYS 57 HE2 LYS 57 8.453 -17.037 2.830 1165 HE3 LYS 57 HE3 LYS 57 6.766 -17.278 3.283 1166 HZ1 LYS 57 HZ1 LYS 57 7.138 -19.264 2.320 1167 HZ2 LYS 57 HZ2 LYS 57 8.384 -18.694 1.328 1168 HZ3 LYS 57 HZ3 LYS 57 6.766 -18.419 0.897 1169 H LEU 58 H LEU 58 5.040 -14.240 -2.781 1170 HA LEU 58 HA LEU 58 6.379 -11.932 -3.899 1171 HB2 LEU 58 HB2 LEU 58 5.856 -13.872 -5.313 1172 HB3 LEU 58 HB3 LEU 58 4.153 -13.686 -4.967 1173 HG LEU 58 HG LEU 58 5.053 -12.915 -7.249 1174 HD11 LEU 58 HD11 LEU 58 3.443 -11.078 -7.361 1175 HD12 LEU 58 HD12 LEU 58 3.329 -11.077 -5.602 1176 HD13 LEU 58 HD13 LEU 58 2.793 -12.483 -6.521 1177 HD21 LEU 58 HD21 LEU 58 6.950 -11.616 -6.331 1178 HD22 LEU 58 HD22 LEU 58 5.792 -10.467 -5.659 1179 HD23 LEU 58 HD23 LEU 58 5.907 -10.683 -7.403 1180 H ALA 59 H ALA 59 3.254 -12.842 -2.616 1181 HA ALA 59 HA ALA 59 1.771 -10.573 -3.282 1182 HB1 ALA 59 HB1 ALA 59 1.538 -12.468 -0.959 1183 HB2 ALA 59 HB2 ALA 59 0.656 -12.516 -2.487 1184 HB3 ALA 59 HB3 ALA 59 0.349 -11.221 -1.327 1185 H VAL 60 H VAL 60 3.980 -11.144 -0.599 1186 HA VAL 60 HA VAL 60 3.265 -8.704 0.743 1187 HB VAL 60 HB VAL 60 5.148 -9.116 2.235 1188 HG11 VAL 60 HG11 VAL 60 3.652 -11.681 1.744 1189 HG12 VAL 60 HG12 VAL 60 2.980 -10.278 2.572 1190 HG13 VAL 60 HG13 VAL 60 4.364 -11.128 3.258 1191 HG21 VAL 60 HG21 VAL 60 6.523 -10.172 0.294 1192 HG22 VAL 60 HG22 VAL 60 5.783 -11.676 0.843 1193 HG23 VAL 60 HG23 VAL 60 6.765 -10.723 1.950 1194 H LEU 61 H LEU 61 5.497 -9.609 -1.745 1195 HA LEU 61 HA LEU 61 7.356 -7.494 -1.458 1196 HB2 LEU 61 HB2 LEU 61 7.642 -9.569 -2.890 1197 HB3 LEU 61 HB3 LEU 61 6.578 -8.813 -4.060 1198 HG LEU 61 HG LEU 61 8.337 -6.833 -3.842 1199 HD11 LEU 61 HD11 LEU 61 9.952 -9.292 -3.194 1200 HD12 LEU 61 HD12 LEU 61 9.676 -7.913 -2.127 1201 HD13 LEU 61 HD13 LEU 61 10.607 -7.709 -3.611 1202 HD21 LEU 61 HD21 LEU 61 9.484 -7.733 -5.804 1203 HD22 LEU 61 HD22 LEU 61 7.739 -7.961 -5.916 1204 HD23 LEU 61 HD23 LEU 61 8.781 -9.317 -5.491 1205 H THR 62 H THR 62 4.250 -7.800 -3.019 1206 HA THR 62 HA THR 62 4.355 -5.289 -4.361 1207 HB THR 62 HB THR 62 1.662 -5.926 -4.006 1208 HG1 THR 62 HG1 THR 62 1.942 -7.954 -3.223 1209 HG21 THR 62 HG21 THR 62 3.450 -6.869 -6.232 1210 HG22 THR 62 HG22 THR 62 2.837 -5.222 -6.078 1211 HG23 THR 62 HG23 THR 62 1.715 -6.561 -6.314 1212 H ALA 63 H ALA 63 2.997 -6.460 -1.322 1213 HA ALA 63 HA ALA 63 1.559 -4.193 -0.560 1214 HB1 ALA 63 HB1 ALA 63 1.633 -5.083 1.685 1215 HB2 ALA 63 HB2 ALA 63 2.991 -6.124 1.258 1216 HB3 ALA 63 HB3 ALA 63 1.407 -6.400 0.535 1217 H VAL 64 H VAL 64 4.911 -5.088 0.221 1218 HA VAL 64 HA VAL 64 5.442 -2.793 1.760 1219 HB VAL 64 HB VAL 64 6.773 -4.862 1.903 1220 HG11 VAL 64 HG11 VAL 64 7.788 -4.021 -0.797 1221 HG12 VAL 64 HG12 VAL 64 7.027 -5.547 -0.345 1222 HG13 VAL 64 HG13 VAL 64 8.640 -5.154 0.250 1223 HG21 VAL 64 HG21 VAL 64 9.002 -3.757 2.057 1224 HG22 VAL 64 HG22 VAL 64 7.699 -2.897 2.876 1225 HG23 VAL 64 HG23 VAL 64 8.286 -2.330 1.313 1226 H GLN 65 H GLN 65 5.744 -3.387 -1.706 1227 HA GLN 65 HA GLN 65 7.210 -0.963 -2.172 1228 HB2 GLN 65 HB2 GLN 65 5.875 -2.943 -4.004 1229 HB3 GLN 65 HB3 GLN 65 6.604 -1.460 -4.610 1230 HG2 GLN 65 HG2 GLN 65 8.759 -2.121 -3.660 1231 HG3 GLN 65 HG3 GLN 65 8.029 -3.600 -3.037 1232 HE21 GLN 65 HE21 GLN 65 7.393 -5.201 -4.486 1233 HE22 GLN 65 HE22 GLN 65 8.055 -5.286 -6.081 1234 H ILE 66 H ILE 66 3.818 -1.944 -2.459 1235 HA ILE 66 HA ILE 66 2.876 0.452 -3.590 1236 HB ILE 66 HB ILE 66 1.501 -1.606 -1.853 1237 HG12 ILE 66 HG12 ILE 66 1.030 -0.999 -4.768 1238 HG13 ILE 66 HG13 ILE 66 2.298 -2.103 -4.249 1239 HG21 ILE 66 HG21 ILE 66 0.365 0.498 -1.502 1240 HG22 ILE 66 HG22 ILE 66 -0.629 -0.556 -2.505 1241 HG23 ILE 66 HG23 ILE 66 0.271 0.768 -3.240 1242 HD11 ILE 66 HD11 ILE 66 0.560 -3.460 -3.109 1243 HD12 ILE 66 HD12 ILE 66 0.366 -3.368 -4.859 1244 HD13 ILE 66 HD13 ILE 66 -0.664 -2.402 -3.807 1245 H ALA 67 H ALA 67 3.408 -0.587 -0.274 1246 HA ALA 67 HA ALA 67 2.277 1.604 1.050 1247 HB1 ALA 67 HB1 ALA 67 2.901 -0.499 2.158 1248 HB2 ALA 67 HB2 ALA 67 3.576 0.912 2.974 1249 HB3 ALA 67 HB3 ALA 67 4.605 -0.089 1.948 1250 H SER 68 H SER 68 5.683 1.028 0.085 1251 HA SER 68 HA SER 68 6.669 3.473 1.056 1252 HB2 SER 68 HB2 SER 68 8.511 3.009 -0.734 1253 HB3 SER 68 HB3 SER 68 8.330 1.903 0.627 1254 HG SER 68 HG SER 68 8.231 1.306 -1.918 1255 H GLU 69 H GLU 69 5.418 2.553 -2.112 1256 HA GLU 69 HA GLU 69 6.005 4.862 -3.537 1257 HB2 GLU 69 HB2 GLU 69 4.175 2.612 -3.868 1258 HB3 GLU 69 HB3 GLU 69 3.521 4.104 -4.522 1259 HG2 GLU 69 HG2 GLU 69 6.216 2.963 -5.203 1260 HG3 GLU 69 HG3 GLU 69 4.759 2.790 -6.182 1261 H TYR 70 H TYR 70 3.245 4.209 -1.418 1262 HA TYR 70 HA TYR 70 2.137 6.831 -1.972 1263 HB2 TYR 70 HB2 TYR 70 1.244 4.555 -0.213 1264 HB3 TYR 70 HB3 TYR 70 0.443 6.124 -0.200 1265 HD1 TYR 70 HD1 TYR 70 -0.029 7.003 -2.746 1266 HD2 TYR 70 HD2 TYR 70 0.218 2.946 -1.490 1267 HE1 TYR 70 HE1 TYR 70 -1.379 6.327 -4.684 1268 HE2 TYR 70 HE2 TYR 70 -1.132 2.262 -3.426 1269 HH TYR 70 HH TYR 70 -2.695 3.176 -4.989 1270 H LEU 71 H LEU 71 4.066 5.291 0.489 1271 HA LEU 71 HA LEU 71 3.662 7.243 2.500 1272 HB2 LEU 71 HB2 LEU 71 5.538 5.010 2.079 1273 HB3 LEU 71 HB3 LEU 71 6.094 6.285 3.142 1274 HG LEU 71 HG LEU 71 3.428 4.922 3.548 1275 HD11 LEU 71 HD11 LEU 71 6.078 4.123 4.745 1276 HD12 LEU 71 HD12 LEU 71 5.090 3.164 3.638 1277 HD13 LEU 71 HD13 LEU 71 4.499 3.527 5.258 1278 HD21 LEU 71 HD21 LEU 71 3.724 7.051 4.699 1279 HD22 LEU 71 HD22 LEU 71 5.224 6.467 5.417 1280 HD23 LEU 71 HD23 LEU 71 3.690 5.713 5.843 1281 H LYS 72 H LYS 72 6.010 6.938 -0.118 1282 HA LYS 72 HA LYS 72 7.544 9.201 0.721 1283 HB2 LYS 72 HB2 LYS 72 8.721 8.993 -1.369 1284 HB3 LYS 72 HB3 LYS 72 8.461 7.385 -0.714 1285 HG2 LYS 72 HG2 LYS 72 6.482 7.188 -2.245 1286 HG3 LYS 72 HG3 LYS 72 7.006 8.697 -2.993 1287 HD2 LYS 72 HD2 LYS 72 8.765 6.262 -2.752 1288 HD3 LYS 72 HD3 LYS 72 7.758 6.600 -4.159 1289 HE2 LYS 72 HE2 LYS 72 9.862 8.477 -3.093 1290 HE3 LYS 72 HE3 LYS 72 10.134 7.322 -4.395 1291 HZ1 LYS 72 HZ1 LYS 72 8.481 8.429 -5.720 1292 HZ2 LYS 72 HZ2 LYS 72 9.615 9.568 -5.196 1293 HZ3 LYS 72 HZ3 LYS 72 8.100 9.484 -4.457 1294 H LEU 73 H LEU 73 4.553 8.838 -0.808 1295 HA LEU 73 HA LEU 73 4.629 11.332 -2.257 1296 HB2 LEU 73 HB2 LEU 73 3.282 9.209 -2.861 1297 HB3 LEU 73 HB3 LEU 73 2.169 9.717 -1.613 1298 HG LEU 73 HG LEU 73 1.518 10.283 -3.983 1299 HD11 LEU 73 HD11 LEU 73 0.715 12.537 -3.428 1300 HD12 LEU 73 HD12 LEU 73 1.755 12.537 -2.004 1301 HD13 LEU 73 HD13 LEU 73 0.437 11.372 -2.134 1302 HD21 LEU 73 HD21 LEU 73 3.917 11.021 -4.547 1303 HD22 LEU 73 HD22 LEU 73 3.458 12.557 -3.808 1304 HD23 LEU 73 HD23 LEU 73 2.569 11.948 -5.200 1305 H LYS 74 H LYS 74 2.912 10.041 0.578 1306 HA LYS 74 HA LYS 74 1.751 12.499 1.337 1307 HB2 LYS 74 HB2 LYS 74 1.332 11.442 3.525 1308 HB3 LYS 74 HB3 LYS 74 0.860 10.407 2.190 1309 HG2 LYS 74 HG2 LYS 74 1.912 8.861 3.466 1310 HG3 LYS 74 HG3 LYS 74 3.309 9.450 2.568 1311 HD2 LYS 74 HD2 LYS 74 4.107 9.501 4.722 1312 HD3 LYS 74 HD3 LYS 74 3.506 11.148 4.532 1313 HE2 LYS 74 HE2 LYS 74 1.459 10.572 5.684 1314 HE3 LYS 74 HE3 LYS 74 1.966 8.885 5.796 1315 HZ1 LYS 74 HZ1 LYS 74 2.812 11.181 7.357 1316 HZ2 LYS 74 HZ2 LYS 74 4.040 10.102 6.934 1317 HZ3 LYS 74 HZ3 LYS 74 2.696 9.553 7.804 1318 H GLU 75 H GLU 75 4.921 11.265 1.671 1319 HA GLU 75 HA GLU 75 5.809 12.702 3.925 1320 HB2 GLU 75 HB2 GLU 75 7.017 10.797 2.883 1321 HB3 GLU 75 HB3 GLU 75 7.394 11.817 1.505 1322 HG2 GLU 75 HG2 GLU 75 9.332 11.841 2.785 1323 HG3 GLU 75 HG3 GLU 75 8.539 13.364 3.176 1324 H GLU 76 H GLU 76 5.775 13.468 0.458 1325 HA GLU 76 HA GLU 76 7.007 16.025 0.835 1326 HB2 GLU 76 HB2 GLU 76 6.872 16.319 -1.466 1327 HB3 GLU 76 HB3 GLU 76 6.999 14.574 -1.307 1328 HG2 GLU 76 HG2 GLU 76 4.935 14.217 -2.131 1329 HG3 GLU 76 HG3 GLU 76 4.262 15.652 -1.360 1330 H TYR 77 H TYR 77 3.812 14.779 0.977 1331 HA TYR 77 HA TYR 77 2.304 17.078 0.463 1332 HB2 TYR 77 HB2 TYR 77 1.263 14.888 0.612 1333 HB3 TYR 77 HB3 TYR 77 1.741 14.735 2.297 1334 HD1 TYR 77 HD1 TYR 77 0.264 17.764 0.728 1335 HD2 TYR 77 HD2 TYR 77 -0.388 14.420 3.280 1336 HE1 TYR 77 HE1 TYR 77 -1.902 18.706 1.396 1337 HE2 TYR 77 HE2 TYR 77 -2.559 15.359 3.956 1338 HH TYR 77 HH TYR 77 -4.016 17.014 3.703 1339 H GLN 78 H GLN 78 4.028 15.996 3.312 1340 HA GLN 78 HA GLN 78 2.955 18.096 4.982 1341 HB2 GLN 78 HB2 GLN 78 5.232 16.158 5.441 1342 HB3 GLN 78 HB3 GLN 78 4.587 17.258 6.652 1343 HG2 GLN 78 HG2 GLN 78 3.045 15.053 5.302 1344 HG3 GLN 78 HG3 GLN 78 3.754 14.974 6.914 1345 HE21 GLN 78 HE21 GLN 78 1.176 16.230 4.975 1346 HE22 GLN 78 HE22 GLN 78 0.223 16.846 6.281 1347 H ARG 79 H ARG 79 5.667 17.603 2.904 1348 HA ARG 79 HA ARG 79 7.393 19.581 3.983 1349 HB2 ARG 79 HB2 ARG 79 7.894 17.606 2.365 1350 HB3 ARG 79 HB3 ARG 79 7.458 18.754 1.106 1351 HG2 ARG 79 HG2 ARG 79 9.804 18.845 1.319 1352 HG3 ARG 79 HG3 ARG 79 9.177 20.311 2.077 1353 HD2 ARG 79 HD2 ARG 79 10.959 19.279 3.411 1354 HD3 ARG 79 HD3 ARG 79 9.423 19.295 4.274 1355 HE ARG 79 HE ARG 79 10.443 16.898 2.885 1356 HH11 ARG 79 HH11 ARG 79 8.964 18.436 5.672 1357 HH12 ARG 79 HH12 ARG 79 8.765 16.939 6.531 1358 HH21 ARG 79 HH21 ARG 79 10.153 14.941 4.005 1359 HH22 ARG 79 HH22 ARG 79 9.424 14.946 5.578 1360 H LEU 80 H LEU 80 5.258 19.629 1.100 1361 HA LEU 80 HA LEU 80 5.857 22.372 0.562 1362 HB2 LEU 80 HB2 LEU 80 4.683 22.113 -1.342 1363 HB3 LEU 80 HB3 LEU 80 4.871 20.414 -0.960 1364 HG LEU 80 HG LEU 80 2.448 21.833 0.058 1365 HD11 LEU 80 HD11 LEU 80 2.537 22.545 -2.264 1366 HD12 LEU 80 HD12 LEU 80 1.261 21.349 -2.030 1367 HD13 LEU 80 HD13 LEU 80 2.785 20.875 -2.782 1368 HD21 LEU 80 HD21 LEU 80 2.756 19.073 -1.094 1369 HD22 LEU 80 HD22 LEU 80 1.469 19.694 -0.061 1370 HD23 LEU 80 HD23 LEU 80 3.084 19.451 0.596 1371 H ARG 81 H ARG 81 3.842 20.906 2.830 1372 HA ARG 81 HA ARG 81 2.003 23.164 2.938 1373 HB2 ARG 81 HB2 ARG 81 2.099 20.535 4.409 1374 HB3 ARG 81 HB3 ARG 81 0.968 21.812 4.832 1375 HG2 ARG 81 HG2 ARG 81 1.097 20.837 2.017 1376 HG3 ARG 81 HG3 ARG 81 0.244 19.887 3.232 1377 HD2 ARG 81 HD2 ARG 81 -0.334 22.677 2.285 1378 HD3 ARG 81 HD3 ARG 81 -1.387 21.264 2.252 1379 HE ARG 81 HE ARG 81 -0.809 22.970 4.548 1380 HH11 ARG 81 HH11 ARG 81 -2.390 20.109 3.294 1381 HH12 ARG 81 HH12 ARG 81 -3.407 19.908 4.680 1382 HH21 ARG 81 HH21 ARG 81 -2.122 22.682 6.387 1383 HH22 ARG 81 HH22 ARG 81 -3.243 21.358 6.446 1384 H GLU 82 H GLU 82 4.811 21.907 4.568 1385 HA GLU 82 HA GLU 82 4.440 23.557 6.900 1386 HB2 GLU 82 HB2 GLU 82 6.482 22.658 7.711 1387 HB3 GLU 82 HB3 GLU 82 5.642 21.337 6.915 1388 HG2 GLU 82 HG2 GLU 82 7.056 21.555 4.974 1389 HG3 GLU 82 HG3 GLU 82 7.843 22.971 5.673 1390 H GLN 83 H GLN 83 5.923 23.844 3.812 1391 HA GLN 83 HA GLN 83 7.732 25.954 4.455 1392 HB2 GLN 83 HB2 GLN 83 8.111 26.128 2.101 1393 HB3 GLN 83 HB3 GLN 83 7.937 24.419 2.478 1394 HG2 GLN 83 HG2 GLN 83 5.534 24.628 1.762 1395 HG3 GLN 83 HG3 GLN 83 5.946 26.228 1.150 1396 HE21 GLN 83 HE21 GLN 83 5.467 25.621 -0.964 1397 HE22 GLN 83 HE22 GLN 83 6.509 24.598 -1.887 1398 H LEU 84 H LEU 84 4.428 25.869 4.369 1399 HA LEU 84 HA LEU 84 4.234 28.705 3.605 1400 HB2 LEU 84 HB2 LEU 84 2.747 26.463 2.773 1401 HB3 LEU 84 HB3 LEU 84 1.682 27.385 3.816 1402 HG LEU 84 HG LEU 84 3.104 28.490 1.381 1403 HD11 LEU 84 HD11 LEU 84 0.862 28.575 0.372 1404 HD12 LEU 84 HD12 LEU 84 0.212 27.711 1.765 1405 HD13 LEU 84 HD13 LEU 84 1.384 26.924 0.706 1406 HD21 LEU 84 HD21 LEU 84 0.851 29.811 2.845 1407 HD22 LEU 84 HD22 LEU 84 2.043 30.517 1.753 1408 HD23 LEU 84 HD23 LEU 84 2.518 30.027 3.378 1409 H LYS 85 H LYS 85 4.873 27.259 6.210 1410 HA LYS 85 HA LYS 85 2.740 28.398 7.886 1411 HB2 LYS 85 HB2 LYS 85 4.839 26.307 8.498 1412 HB3 LYS 85 HB3 LYS 85 3.785 27.014 9.715 1413 HG2 LYS 85 HG2 LYS 85 1.842 26.108 8.637 1414 HG3 LYS 85 HG3 LYS 85 2.816 25.519 7.289 1415 HD2 LYS 85 HD2 LYS 85 2.460 23.633 8.645 1416 HD3 LYS 85 HD3 LYS 85 4.096 24.164 9.029 1417 HE2 LYS 85 HE2 LYS 85 3.366 25.189 11.055 1418 HE3 LYS 85 HE3 LYS 85 1.674 24.926 10.640 1419 HZ1 LYS 85 HZ1 LYS 85 2.556 23.314 12.263 1420 HZ2 LYS 85 HZ2 LYS 85 3.642 22.751 11.092 1421 HZ3 LYS 85 HZ3 LYS 85 1.975 22.580 10.856 1422 H LYS 86 H LYS 86 6.267 27.960 7.964 1423 HA LYS 86 HA LYS 86 6.479 30.465 9.464 1424 HB2 LYS 86 HB2 LYS 86 8.833 29.606 9.948 1425 HB3 LYS 86 HB3 LYS 86 7.502 28.749 10.709 1426 HG2 LYS 86 HG2 LYS 86 7.894 26.845 9.568 1427 HG3 LYS 86 HG3 LYS 86 8.366 27.700 8.097 1428 HD2 LYS 86 HD2 LYS 86 10.086 27.518 10.564 1429 HD3 LYS 86 HD3 LYS 86 10.209 26.412 9.196 1430 HE2 LYS 86 HE2 LYS 86 10.674 29.393 9.176 1431 HE3 LYS 86 HE3 LYS 86 11.886 28.131 8.976 1432 HZ1 LYS 86 HZ1 LYS 86 11.395 28.934 6.834 1433 HZ2 LYS 86 HZ2 LYS 86 9.721 28.898 7.095 1434 HZ3 LYS 86 HZ3 LYS 86 10.592 27.448 6.943 Start of MODEL 13 1 H1 GLY 1 H1 GLY 1 32.602 -11.169 -8.367 2 H2 GLY 1 H2 GLY 1 33.585 -12.233 -9.234 3 H3 GLY 1 H3 GLY 1 32.208 -11.574 -9.959 4 HA2 GLY 1 HA3 GLY 1 34.627 -10.077 -9.120 5 HA3 GLY 1 HA2 GLY 1 34.181 -10.470 -10.775 6 H SER 2 H SER 2 34.623 -7.865 -10.096 7 HA SER 2 HA SER 2 32.082 -6.599 -9.507 8 HB2 SER 2 HB2 SER 2 33.545 -4.494 -9.949 9 HB3 SER 2 HB3 SER 2 33.862 -5.456 -8.504 10 HG SER 2 HG SER 2 35.600 -4.803 -10.285 11 H HIS 3 H HIS 3 31.185 -4.948 -10.922 12 HA HIS 3 HA HIS 3 31.954 -5.056 -13.717 13 HB2 HIS 3 HB2 HIS 3 30.300 -6.934 -13.357 14 HB3 HIS 3 HB3 HIS 3 29.108 -5.709 -12.936 15 HD1 HIS 3 HD1 HIS 3 31.036 -7.071 -15.847 16 HD2 HIS 3 HD2 HIS 3 28.063 -4.263 -15.097 17 HE1 HIS 3 HE1 HIS 3 30.130 -6.426 -18.101 18 HE2 HIS 3 HE2 HIS 3 28.436 -4.620 -17.630 19 H MET 4 H MET 4 32.305 -2.937 -13.926 20 HA MET 4 HA MET 4 30.835 -0.926 -12.579 21 HB2 MET 4 HB2 MET 4 32.630 -0.751 -15.003 22 HB3 MET 4 HB3 MET 4 32.003 0.639 -14.128 23 HG2 MET 4 HG2 MET 4 33.121 -0.480 -12.069 24 HG3 MET 4 HG3 MET 4 34.041 -1.369 -13.280 25 HE1 MET 4 HE1 MET 4 34.195 3.167 -12.527 26 HE2 MET 4 HE2 MET 4 33.428 1.978 -11.473 27 HE3 MET 4 HE3 MET 4 32.714 2.362 -13.038 28 H THR 5 H THR 5 29.169 0.313 -13.196 29 HA THR 5 HA THR 5 28.141 0.484 -15.822 30 HB THR 5 HB THR 5 27.449 -1.855 -15.276 31 HG1 THR 5 HG1 THR 5 24.973 -0.899 -15.390 32 HG21 THR 5 HG21 THR 5 27.122 -1.618 -12.874 33 HG22 THR 5 HG22 THR 5 25.647 -2.207 -13.640 34 HG23 THR 5 HG23 THR 5 25.773 -0.518 -13.149 35 H GLU 6 H GLU 6 25.938 1.611 -15.757 36 HA GLU 6 HA GLU 6 26.129 3.868 -14.059 37 HB2 GLU 6 HB2 GLU 6 25.079 3.799 -16.360 38 HB3 GLU 6 HB3 GLU 6 23.699 2.995 -15.628 39 HG2 GLU 6 HG2 GLU 6 23.528 4.992 -14.086 40 HG3 GLU 6 HG3 GLU 6 24.684 5.786 -15.157 41 H GLN 7 H GLN 7 24.999 4.442 -12.258 42 HA GLN 7 HA GLN 7 24.003 2.354 -10.594 43 HB2 GLN 7 HB2 GLN 7 25.236 4.265 -9.688 44 HB3 GLN 7 HB3 GLN 7 23.969 5.355 -10.228 45 HG2 GLN 7 HG2 GLN 7 22.491 3.724 -8.723 46 HG3 GLN 7 HG3 GLN 7 24.042 3.523 -7.909 47 HE21 GLN 7 HE21 GLN 7 21.489 5.717 -8.704 48 HE22 GLN 7 HE22 GLN 7 21.942 6.976 -7.608 49 HA PRO 8 HA PRO 8 19.784 3.014 -12.027 50 HB2 PRO 8 HB2 PRO 8 18.974 0.486 -11.810 51 HB3 PRO 8 HB3 PRO 8 20.149 0.940 -13.051 52 HG2 PRO 8 HG2 PRO 8 20.565 -0.486 -10.469 53 HG3 PRO 8 HG3 PRO 8 21.402 -0.693 -12.017 54 HD2 PRO 8 HD2 PRO 8 22.276 0.830 -9.789 55 HD3 PRO 8 HD3 PRO 8 23.007 0.783 -11.404 56 H LYS 9 H LYS 9 17.612 1.934 -10.963 57 HA LYS 9 HA LYS 9 17.195 3.110 -8.500 58 HB2 LYS 9 HB2 LYS 9 15.160 1.706 -8.319 59 HB3 LYS 9 HB3 LYS 9 15.328 2.438 -9.905 60 HG2 LYS 9 HG2 LYS 9 16.181 0.298 -10.780 61 HG3 LYS 9 HG3 LYS 9 15.952 -0.420 -9.187 62 HD2 LYS 9 HD2 LYS 9 14.019 -1.046 -10.291 63 HD3 LYS 9 HD3 LYS 9 13.511 0.414 -9.440 64 HE2 LYS 9 HE2 LYS 9 12.690 0.955 -11.478 65 HE3 LYS 9 HE3 LYS 9 14.342 1.517 -11.734 66 HZ1 LYS 9 HZ1 LYS 9 14.865 -0.559 -12.815 67 HZ2 LYS 9 HZ2 LYS 9 13.522 0.133 -13.566 68 HZ3 LYS 9 HZ3 LYS 9 13.319 -1.169 -12.508 69 H THR 10 H THR 10 17.713 2.598 -6.448 70 HA THR 10 HA THR 10 19.418 0.340 -6.011 71 HB THR 10 HB THR 10 19.705 2.636 -4.959 72 HG1 THR 10 HG1 THR 10 20.966 0.990 -4.195 73 HG21 THR 10 HG21 THR 10 18.578 2.982 -2.795 74 HG22 THR 10 HG22 THR 10 17.569 1.569 -3.113 75 HG23 THR 10 HG23 THR 10 17.448 2.993 -4.148 76 H ARG 11 H ARG 11 19.141 -1.234 -4.332 77 HA ARG 11 HA ARG 11 16.321 -1.860 -3.775 78 HB2 ARG 11 HB2 ARG 11 17.028 -4.298 -3.933 79 HB3 ARG 11 HB3 ARG 11 16.940 -3.416 -5.451 80 HG2 ARG 11 HG2 ARG 11 19.367 -3.120 -5.414 81 HG3 ARG 11 HG3 ARG 11 19.452 -4.026 -3.903 82 HD2 ARG 11 HD2 ARG 11 18.551 -5.992 -5.015 83 HD3 ARG 11 HD3 ARG 11 18.396 -5.087 -6.519 84 HE ARG 11 HE ARG 11 21.071 -4.993 -5.614 85 HH11 ARG 11 HH11 ARG 11 18.754 -7.190 -7.054 86 HH12 ARG 11 HH12 ARG 11 19.961 -8.151 -7.844 87 HH21 ARG 11 HH21 ARG 11 22.668 -6.256 -6.660 88 HH22 ARG 11 HH22 ARG 11 22.189 -7.621 -7.619 89 H VAL 12 H VAL 12 15.858 -2.756 -1.774 90 HA VAL 12 HA VAL 12 18.105 -2.936 0.121 91 HB VAL 12 HB VAL 12 16.896 -0.756 0.355 92 HG11 VAL 12 HG11 VAL 12 14.660 -1.274 -0.186 93 HG12 VAL 12 HG12 VAL 12 14.660 -0.886 1.535 94 HG13 VAL 12 HG13 VAL 12 14.589 -2.566 1.012 95 HG21 VAL 12 HG21 VAL 12 18.116 -1.634 2.236 96 HG22 VAL 12 HG22 VAL 12 16.754 -2.663 2.685 97 HG23 VAL 12 HG23 VAL 12 16.615 -0.907 2.810 98 H SER 13 H SER 13 17.969 -4.541 1.635 99 HA SER 13 HA SER 13 15.850 -6.503 1.235 100 HB2 SER 13 HB2 SER 13 18.382 -6.701 2.886 101 HB3 SER 13 HB3 SER 13 17.306 -8.031 2.455 102 HG SER 13 HG SER 13 18.190 -8.128 0.543 103 H VAL 14 H VAL 14 14.163 -6.599 2.586 104 HA VAL 14 HA VAL 14 14.519 -5.593 5.335 105 HB VAL 14 HB VAL 14 12.096 -4.860 5.229 106 HG11 VAL 14 HG11 VAL 14 14.175 -3.432 3.576 107 HG12 VAL 14 HG12 VAL 14 13.851 -3.228 5.299 108 HG13 VAL 14 HG13 VAL 14 12.657 -2.706 4.110 109 HG21 VAL 14 HG21 VAL 14 11.551 -6.075 3.128 110 HG22 VAL 14 HG22 VAL 14 12.563 -4.927 2.248 111 HG23 VAL 14 HG23 VAL 14 11.119 -4.367 3.088 112 H ARG 15 H ARG 15 13.364 -6.656 6.952 113 HA ARG 15 HA ARG 15 12.507 -9.349 6.196 114 HB2 ARG 15 HB2 ARG 15 14.237 -9.152 7.920 115 HB3 ARG 15 HB3 ARG 15 13.154 -8.183 8.909 116 HG2 ARG 15 HG2 ARG 15 11.599 -10.123 8.993 117 HG3 ARG 15 HG3 ARG 15 12.837 -11.080 8.172 118 HD2 ARG 15 HD2 ARG 15 13.163 -9.672 10.819 119 HD3 ARG 15 HD3 ARG 15 12.892 -11.398 10.602 120 HE ARG 15 HE ARG 15 15.068 -11.399 9.374 121 HH11 ARG 15 HH11 ARG 15 14.369 -8.950 11.785 122 HH12 ARG 15 HH12 ARG 15 16.037 -8.644 12.138 123 HH21 ARG 15 HH21 ARG 15 17.267 -10.995 9.846 124 HH22 ARG 15 HH22 ARG 15 17.683 -9.808 11.041 125 H ILE 16 H ILE 16 10.431 -9.872 6.109 126 HA ILE 16 HA ILE 16 8.519 -8.469 7.849 127 HB ILE 16 HB ILE 16 7.680 -9.227 5.072 128 HG12 ILE 16 HG12 ILE 16 8.743 -6.488 5.774 129 HG13 ILE 16 HG13 ILE 16 9.701 -7.703 4.935 130 HG21 ILE 16 HG21 ILE 16 5.935 -7.636 5.444 131 HG22 ILE 16 HG22 ILE 16 6.727 -7.029 6.898 132 HG23 ILE 16 HG23 ILE 16 6.051 -8.658 6.877 133 HD11 ILE 16 HD11 ILE 16 8.859 -6.280 3.279 134 HD12 ILE 16 HD12 ILE 16 7.240 -6.292 3.975 135 HD13 ILE 16 HD13 ILE 16 7.874 -7.740 3.194 136 H TYR 17 H TYR 17 7.433 -9.910 9.019 137 HA TYR 17 HA TYR 17 6.540 -11.855 9.770 138 HB2 TYR 17 HB2 TYR 17 5.466 -11.511 7.328 139 HB3 TYR 17 HB3 TYR 17 6.281 -13.049 7.068 140 HD1 TYR 17 HD1 TYR 17 4.049 -11.417 9.589 141 HD2 TYR 17 HD2 TYR 17 5.095 -14.980 7.511 142 HE1 TYR 17 HE1 TYR 17 2.161 -12.582 10.652 143 HE2 TYR 17 HE2 TYR 17 3.211 -16.155 8.570 144 HH TYR 17 HH TYR 17 0.743 -14.525 10.285 145 H GLY 18 H GLY 18 9.432 -11.655 9.293 146 HA2 GLY 18 HA2 GLY 18 10.977 -13.279 10.131 147 HA3 GLY 18 HA3 GLY 18 10.002 -14.537 9.390 148 H GLN 19 H GLN 19 9.743 -13.711 6.816 149 HA GLN 19 HA GLN 19 12.373 -14.283 5.802 150 HB2 GLN 19 HB2 GLN 19 9.698 -13.862 4.489 151 HB3 GLN 19 HB3 GLN 19 11.167 -14.066 3.551 152 HG2 GLN 19 HG2 GLN 19 10.230 -16.186 3.615 153 HG3 GLN 19 HG3 GLN 19 11.487 -16.240 4.848 154 HE21 GLN 19 HE21 GLN 19 8.381 -14.648 5.217 155 HE22 GLN 19 HE22 GLN 19 7.773 -15.713 6.434 156 H ASP 20 H ASP 20 13.602 -13.021 4.418 157 HA ASP 20 HA ASP 20 12.983 -10.152 4.512 158 HB2 ASP 20 HB2 ASP 20 15.308 -9.665 4.521 159 HB3 ASP 20 HB3 ASP 20 15.090 -10.962 5.689 160 H TYR 21 H TYR 21 12.889 -9.005 2.664 161 HA TYR 21 HA TYR 21 13.427 -10.446 0.149 162 HB2 TYR 21 HB2 TYR 21 11.195 -8.449 0.454 163 HB3 TYR 21 HB3 TYR 21 11.442 -9.625 -0.831 164 HD1 TYR 21 HD2 TYR 21 11.084 -12.065 -0.331 165 HD2 TYR 21 HD1 TYR 21 9.959 -8.989 2.383 166 HE1 TYR 21 HE2 TYR 21 9.610 -13.647 0.840 167 HE2 TYR 21 HE1 TYR 21 8.485 -10.563 3.561 168 HH TYR 21 HH TYR 21 7.388 -12.594 3.309 169 H THR 22 H THR 22 14.132 -9.211 -1.598 170 HA THR 22 HA THR 22 15.340 -6.660 -0.847 171 HB THR 22 HB THR 22 15.887 -7.784 -3.525 172 HG1 THR 22 HG1 THR 22 16.235 -9.239 -1.173 173 HG21 THR 22 HG21 THR 22 17.065 -5.825 -2.555 174 HG22 THR 22 HG22 THR 22 18.158 -7.143 -2.976 175 HG23 THR 22 HG23 THR 22 17.710 -6.874 -1.290 176 H ILE 23 H ILE 23 13.820 -5.122 -1.075 177 HA ILE 23 HA ILE 23 12.288 -5.033 -3.584 178 HB ILE 23 HB ILE 23 10.790 -3.442 -2.442 179 HG12 ILE 23 HG12 ILE 23 12.265 -4.123 0.104 180 HG13 ILE 23 HG13 ILE 23 12.602 -2.662 -0.820 181 HG21 ILE 23 HG21 ILE 23 9.697 -5.060 -0.993 182 HG22 ILE 23 HG22 ILE 23 11.172 -6.025 -0.933 183 HG23 ILE 23 HG23 ILE 23 10.298 -5.842 -2.453 184 HD11 ILE 23 HD11 ILE 23 10.139 -2.131 -0.563 185 HD12 ILE 23 HD12 ILE 23 11.138 -2.025 0.885 186 HD13 ILE 23 HD13 ILE 23 10.102 -3.426 0.633 187 H VAL 24 H VAL 24 11.706 -2.614 -4.126 188 HA VAL 24 HA VAL 24 14.262 -1.310 -4.561 189 HB VAL 24 HB VAL 24 11.539 -0.503 -5.596 190 HG11 VAL 24 HG11 VAL 24 14.248 0.214 -6.698 191 HG12 VAL 24 HG12 VAL 24 13.376 1.231 -5.551 192 HG13 VAL 24 HG13 VAL 24 12.679 0.892 -7.138 193 HG21 VAL 24 HG21 VAL 24 13.672 -2.213 -6.873 194 HG22 VAL 24 HG22 VAL 24 12.250 -1.584 -7.705 195 HG23 VAL 24 HG23 VAL 24 12.060 -2.730 -6.378 196 H GLY 25 H GLY 25 14.958 0.386 -3.399 197 HA2 GLY 25 HA2 GLY 25 12.983 1.744 -1.675 198 HA3 GLY 25 HA3 GLY 25 14.680 1.531 -1.257 199 H ALA 26 H ALA 26 12.422 3.273 -3.288 200 HA ALA 26 HA ALA 26 14.496 4.936 -4.429 201 HB1 ALA 26 HB1 ALA 26 12.600 6.122 -5.512 202 HB2 ALA 26 HB2 ALA 26 11.497 5.034 -4.666 203 HB3 ALA 26 HB3 ALA 26 12.648 4.388 -5.838 204 H GLU 27 H GLU 27 13.560 4.891 -1.433 205 HA GLU 27 HA GLU 27 13.564 7.820 -1.170 206 HB2 GLU 27 HB2 GLU 27 12.372 6.497 1.124 207 HB3 GLU 27 HB3 GLU 27 11.761 7.838 0.172 208 HG2 GLU 27 HG2 GLU 27 10.773 6.322 -1.411 209 HG3 GLU 27 HG3 GLU 27 11.488 4.939 -0.583 210 H SER 28 H SER 28 13.978 8.155 1.450 211 HA SER 28 HA SER 28 16.692 7.550 1.814 212 HB2 SER 28 HB2 SER 28 15.302 8.126 4.296 213 HB3 SER 28 HB3 SER 28 16.476 9.111 3.419 214 HG SER 28 HG SER 28 14.754 10.329 3.164 215 HA PRO 29 HA PRO 29 16.887 3.450 3.438 216 HB2 PRO 29 HB2 PRO 29 18.618 3.969 5.588 217 HB3 PRO 29 HB3 PRO 29 19.085 3.505 3.950 218 HG2 PRO 29 HG2 PRO 29 18.988 6.197 5.204 219 HG3 PRO 29 HG3 PRO 29 20.111 5.559 3.992 220 HD2 PRO 29 HD2 PRO 29 18.164 7.270 3.322 221 HD3 PRO 29 HD3 PRO 29 18.637 5.941 2.242 222 H ALA 30 H ALA 30 16.562 6.017 5.889 223 HA ALA 30 HA ALA 30 15.435 4.299 7.860 224 HB1 ALA 30 HB1 ALA 30 14.964 6.309 9.106 225 HB2 ALA 30 HB2 ALA 30 15.220 7.300 7.671 226 HB3 ALA 30 HB3 ALA 30 16.572 6.428 8.390 227 H HIS 31 H HIS 31 14.135 6.191 5.247 228 HA HIS 31 HA HIS 31 11.413 6.201 6.107 229 HB2 HIS 31 HB2 HIS 31 12.757 7.548 4.180 230 HB3 HIS 31 HB3 HIS 31 12.013 6.292 3.201 231 HD1 HIS 31 HD1 HIS 31 9.612 6.606 2.565 232 HD2 HIS 31 HD2 HIS 31 10.842 9.215 5.567 233 HE1 HIS 31 HE1 HIS 31 7.741 8.270 2.842 234 HE2 HIS 31 HE2 HIS 31 8.636 9.984 4.460 235 H ILE 32 H ILE 32 13.163 4.336 3.645 236 HA ILE 32 HA ILE 32 11.034 2.549 3.088 237 HB ILE 32 HB ILE 32 12.646 1.195 1.877 238 HG12 ILE 32 HG12 ILE 32 14.731 2.949 3.202 239 HG13 ILE 32 HG13 ILE 32 14.534 1.216 3.387 240 HG21 ILE 32 HG21 ILE 32 11.749 3.317 0.935 241 HG22 ILE 32 HG22 ILE 32 13.283 2.809 0.235 242 HG23 ILE 32 HG23 ILE 32 13.246 4.112 1.422 243 HD11 ILE 32 HD11 ILE 32 16.384 1.526 1.984 244 HD12 ILE 32 HD12 ILE 32 15.549 2.733 1.007 245 HD13 ILE 32 HD13 ILE 32 15.064 1.040 0.920 246 H ARG 33 H ARG 33 13.137 2.729 5.723 247 HA ARG 33 HA ARG 33 13.236 -0.073 6.339 248 HB2 ARG 33 HB2 ARG 33 14.518 2.243 7.299 249 HB3 ARG 33 HB3 ARG 33 13.612 1.596 8.658 250 HG2 ARG 33 HG2 ARG 33 15.808 0.689 8.713 251 HG3 ARG 33 HG3 ARG 33 14.698 -0.601 8.255 252 HD2 ARG 33 HD2 ARG 33 15.453 -0.645 6.069 253 HD3 ARG 33 HD3 ARG 33 16.069 1.006 6.141 254 HE ARG 33 HE ARG 33 17.868 0.138 7.575 255 HH11 ARG 33 HH11 ARG 33 16.143 -2.107 5.508 256 HH12 ARG 33 HH12 ARG 33 17.433 -3.267 5.477 257 HH21 ARG 33 HH21 ARG 33 19.563 -1.381 7.530 258 HH22 ARG 33 HH22 ARG 33 19.380 -2.854 6.623 259 H LEU 34 H LEU 34 11.409 2.715 7.568 260 HA LEU 34 HA LEU 34 9.896 1.206 9.435 261 HB2 LEU 34 HB2 LEU 34 8.509 3.182 9.673 262 HB3 LEU 34 HB3 LEU 34 10.205 3.617 9.676 263 HG LEU 34 HG LEU 34 9.621 3.985 7.055 264 HD11 LEU 34 HD11 LEU 34 7.121 4.690 8.588 265 HD12 LEU 34 HD12 LEU 34 7.268 3.469 7.325 266 HD13 LEU 34 HD13 LEU 34 7.480 5.175 6.931 267 HD21 LEU 34 HD21 LEU 34 10.776 5.567 8.482 268 HD22 LEU 34 HD22 LEU 34 9.267 5.963 9.307 269 HD23 LEU 34 HD23 LEU 34 9.477 6.379 7.606 270 H VAL 35 H VAL 35 9.635 1.713 6.051 271 HA VAL 35 HA VAL 35 6.918 1.342 5.584 272 HB VAL 35 HB VAL 35 9.308 0.520 3.923 273 HG11 VAL 35 HG11 VAL 35 7.766 0.357 2.026 274 HG12 VAL 35 HG12 VAL 35 6.406 0.604 3.117 275 HG13 VAL 35 HG13 VAL 35 7.402 -0.843 3.267 276 HG21 VAL 35 HG21 VAL 35 8.773 2.513 2.623 277 HG22 VAL 35 HG22 VAL 35 9.066 2.923 4.314 278 HG23 VAL 35 HG23 VAL 35 7.417 2.854 3.695 279 H ALA 36 H ALA 36 9.507 -1.056 5.941 280 HA ALA 36 HA ALA 36 7.854 -3.313 5.478 281 HB1 ALA 36 HB1 ALA 36 10.282 -3.379 5.220 282 HB2 ALA 36 HB2 ALA 36 9.710 -4.624 6.332 283 HB3 ALA 36 HB3 ALA 36 10.472 -3.163 6.960 284 H ALA 37 H ALA 37 8.812 -1.571 8.391 285 HA ALA 37 HA ALA 37 7.773 -3.425 10.262 286 HB1 ALA 37 HB1 ALA 37 8.137 -0.447 10.583 287 HB2 ALA 37 HB2 ALA 37 9.394 -1.656 10.833 288 HB3 ALA 37 HB3 ALA 37 7.977 -1.632 11.882 289 H PHE 38 H PHE 38 6.395 -0.840 8.393 290 HA PHE 38 HA PHE 38 3.945 -0.561 9.779 291 HB2 PHE 38 HB2 PHE 38 5.020 0.995 8.028 292 HB3 PHE 38 HB3 PHE 38 4.332 -0.087 6.822 293 HD1 PHE 38 HD1 PHE 38 1.857 -0.331 6.668 294 HD2 PHE 38 HD2 PHE 38 3.707 2.602 9.134 295 HE1 PHE 38 HE1 PHE 38 -0.262 0.915 6.764 296 HE2 PHE 38 HE2 PHE 38 1.591 3.850 9.247 297 HZ PHE 38 HZ PHE 38 -0.398 3.010 8.056 298 H VAL 39 H VAL 39 4.988 -2.559 7.069 299 HA VAL 39 HA VAL 39 2.421 -3.674 6.525 300 HB VAL 39 HB VAL 39 5.149 -4.699 5.738 301 HG11 VAL 39 HG11 VAL 39 3.446 -6.433 5.560 302 HG12 VAL 39 HG12 VAL 39 3.956 -5.898 3.958 303 HG13 VAL 39 HG13 VAL 39 2.417 -5.346 4.622 304 HG21 VAL 39 HG21 VAL 39 5.197 -3.205 4.075 305 HG22 VAL 39 HG22 VAL 39 3.993 -2.328 5.016 306 HG23 VAL 39 HG23 VAL 39 3.483 -3.407 3.718 307 H ASP 40 H ASP 40 5.300 -4.851 8.259 308 HA ASP 40 HA ASP 40 4.363 -7.417 8.861 309 HB2 ASP 40 HB2 ASP 40 6.703 -6.452 9.238 310 HB3 ASP 40 HB3 ASP 40 6.069 -5.774 10.734 311 H ASP 41 H ASP 41 3.905 -4.350 10.498 312 HA ASP 41 HA ASP 41 2.525 -5.370 12.760 313 HB2 ASP 41 HB2 ASP 41 3.592 -3.209 12.888 314 HB3 ASP 41 HB3 ASP 41 2.646 -2.611 11.529 315 H LYS 42 H LYS 42 1.519 -4.137 9.615 316 HA LYS 42 HA LYS 42 -1.262 -4.077 10.165 317 HB2 LYS 42 HB2 LYS 42 -0.063 -2.878 8.285 318 HB3 LYS 42 HB3 LYS 42 0.008 -4.423 7.450 319 HG2 LYS 42 HG2 LYS 42 -1.975 -3.962 6.578 320 HG3 LYS 42 HG3 LYS 42 -2.664 -4.125 8.195 321 HD2 LYS 42 HD2 LYS 42 -1.403 -1.540 7.398 322 HD3 LYS 42 HD3 LYS 42 -3.016 -1.932 6.803 323 HE2 LYS 42 HE2 LYS 42 -2.546 -2.324 9.698 324 HE3 LYS 42 HE3 LYS 42 -2.554 -0.656 9.127 325 HZ1 LYS 42 HZ1 LYS 42 -4.753 -1.059 9.633 326 HZ2 LYS 42 HZ2 LYS 42 -4.728 -2.649 9.058 327 HZ3 LYS 42 HZ3 LYS 42 -4.721 -1.341 7.961 328 H MET 43 H MET 43 0.835 -6.504 8.606 329 HA MET 43 HA MET 43 -1.329 -8.315 8.130 330 HB2 MET 43 HB2 MET 43 0.290 -9.845 7.323 331 HB3 MET 43 HB3 MET 43 0.846 -8.252 6.840 332 HG2 MET 43 HG2 MET 43 2.338 -8.282 8.863 333 HG3 MET 43 HG3 MET 43 1.906 -9.979 9.050 334 HE1 MET 43 HE1 MET 43 3.163 -11.376 5.535 335 HE2 MET 43 HE2 MET 43 1.626 -10.529 5.706 336 HE3 MET 43 HE3 MET 43 2.131 -11.696 6.929 337 H HIS 44 H HIS 44 0.179 -7.394 10.919 338 HA HIS 44 HA HIS 44 0.034 -9.968 12.239 339 HB2 HIS 44 HB2 HIS 44 1.721 -8.045 12.705 340 HB3 HIS 44 HB3 HIS 44 0.415 -7.339 13.645 341 HD1 HIS 44 HD1 HIS 44 2.916 -10.094 13.665 342 HD2 HIS 44 HD2 HIS 44 -0.192 -8.696 16.043 343 HE1 HIS 44 HE1 HIS 44 3.163 -11.283 15.865 344 HE2 HIS 44 HE2 HIS 44 1.427 -10.228 17.352 345 H GLU 45 H GLU 45 -2.110 -7.493 11.435 346 HA GLU 45 HA GLU 45 -3.877 -8.081 13.702 347 HB2 GLU 45 HB2 GLU 45 -4.992 -6.081 13.293 348 HB3 GLU 45 HB3 GLU 45 -3.331 -5.683 12.889 349 HG2 GLU 45 HG2 GLU 45 -3.803 -5.892 10.527 350 HG3 GLU 45 HG3 GLU 45 -5.440 -6.446 10.871 351 H PHE 46 H PHE 46 -3.399 -8.889 10.435 352 HA PHE 46 HA PHE 46 -6.192 -9.631 10.053 353 HB2 PHE 46 HB2 PHE 46 -3.842 -9.460 8.182 354 HB3 PHE 46 HB3 PHE 46 -5.351 -10.239 7.714 355 HD1 PHE 46 HD1 PHE 46 -7.495 -8.835 7.948 356 HD2 PHE 46 HD2 PHE 46 -3.580 -7.181 7.887 357 HE1 PHE 46 HE1 PHE 46 -8.432 -6.654 7.307 358 HE2 PHE 46 HE2 PHE 46 -4.508 -4.998 7.240 359 HZ PHE 46 HZ PHE 46 -6.935 -4.731 6.951 360 H SER 47 H SER 47 -3.285 -11.007 11.083 361 HA SER 47 HA SER 47 -3.483 -13.628 10.097 362 HB2 SER 47 HB2 SER 47 -2.304 -13.857 12.596 363 HB3 SER 47 HB3 SER 47 -1.462 -13.520 11.077 364 HG SER 47 HG SER 47 -1.769 -11.935 13.217 365 H GLU 48 H GLU 48 -5.300 -11.971 12.475 366 HA GLU 48 HA GLU 48 -6.269 -14.418 13.712 367 HB2 GLU 48 HB2 GLU 48 -7.464 -12.974 15.256 368 HB3 GLU 48 HB3 GLU 48 -5.779 -12.485 15.147 369 HG2 GLU 48 HG2 GLU 48 -6.382 -10.629 13.711 370 HG3 GLU 48 HG3 GLU 48 -8.065 -11.149 13.715 371 H LYS 49 H LYS 49 -7.012 -12.602 11.023 372 HA LYS 49 HA LYS 49 -9.884 -12.861 11.175 373 HB2 LYS 49 HB2 LYS 49 -8.070 -12.065 8.892 374 HB3 LYS 49 HB3 LYS 49 -9.824 -12.045 8.819 375 HG2 LYS 49 HG2 LYS 49 -8.222 -10.439 10.795 376 HG3 LYS 49 HG3 LYS 49 -8.737 -9.828 9.221 377 HD2 LYS 49 HD2 LYS 49 -11.095 -10.350 9.887 378 HD3 LYS 49 HD3 LYS 49 -10.496 -10.735 11.500 379 HE2 LYS 49 HE2 LYS 49 -11.127 -8.534 11.766 380 HE3 LYS 49 HE3 LYS 49 -9.418 -8.367 11.371 381 HZ1 LYS 49 HZ1 LYS 49 -10.354 -8.191 8.955 382 HZ2 LYS 49 HZ2 LYS 49 -10.351 -6.841 9.973 383 HZ3 LYS 49 HZ3 LYS 49 -11.772 -7.726 9.747 384 H GLN 50 H GLN 50 -7.330 -14.228 9.113 385 HA GLN 50 HA GLN 50 -7.233 -16.101 7.811 386 HB2 GLN 50 HB2 GLN 50 -8.663 -17.209 10.227 387 HB3 GLN 50 HB3 GLN 50 -7.894 -18.188 8.988 388 HG2 GLN 50 HG2 GLN 50 -5.742 -17.359 9.556 389 HG3 GLN 50 HG3 GLN 50 -6.433 -16.140 10.627 390 HE21 GLN 50 HE21 GLN 50 -4.477 -18.206 11.223 391 HE22 GLN 50 HE22 GLN 50 -5.165 -19.173 12.482 392 HA PRO 51 HA PRO 51 -11.544 -15.646 6.169 393 HB2 PRO 51 HB2 PRO 51 -10.737 -15.440 3.544 394 HB3 PRO 51 HB3 PRO 51 -11.003 -14.071 4.626 395 HG2 PRO 51 HG2 PRO 51 -8.458 -15.357 3.785 396 HG3 PRO 51 HG3 PRO 51 -8.796 -13.656 4.138 397 HD2 PRO 51 HD2 PRO 51 -7.486 -15.324 5.866 398 HD3 PRO 51 HD3 PRO 51 -8.438 -13.920 6.388 399 H MET 52 H MET 52 -9.022 -17.342 4.267 400 HA MET 52 HA MET 52 -10.827 -19.660 4.185 401 HB2 MET 52 HB2 MET 52 -8.794 -18.921 2.079 402 HB3 MET 52 HB3 MET 52 -10.012 -20.183 1.988 403 HG2 MET 52 HG2 MET 52 -11.329 -18.733 0.964 404 HG3 MET 52 HG3 MET 52 -11.452 -17.864 2.496 405 HE1 MET 52 HE1 MET 52 -11.003 -15.054 -0.236 406 HE2 MET 52 HE2 MET 52 -12.030 -15.650 1.067 407 HE3 MET 52 HE3 MET 52 -11.854 -16.588 -0.415 408 H LEU 53 H LEU 53 -8.234 -18.688 5.742 409 HA LEU 53 HA LEU 53 -6.379 -19.604 6.685 410 HB2 LEU 53 HB2 LEU 53 -8.182 -21.995 6.412 411 HB3 LEU 53 HB3 LEU 53 -6.675 -22.031 7.308 412 HG LEU 53 HG LEU 53 -8.543 -19.869 8.051 413 HD11 LEU 53 HD11 LEU 53 -10.105 -21.703 7.687 414 HD12 LEU 53 HD12 LEU 53 -9.934 -21.336 9.402 415 HD13 LEU 53 HD13 LEU 53 -9.127 -22.746 8.716 416 HD21 LEU 53 HD21 LEU 53 -6.915 -21.867 9.616 417 HD22 LEU 53 HD22 LEU 53 -7.782 -20.486 10.287 418 HD23 LEU 53 HD23 LEU 53 -6.419 -20.227 9.197 419 H ASP 54 H ASP 54 -5.565 -19.144 4.278 420 HA ASP 54 HA ASP 54 -4.381 -21.650 3.300 421 HB2 ASP 54 HB2 ASP 54 -5.039 -19.106 1.794 422 HB3 ASP 54 HB3 ASP 54 -4.031 -20.390 1.122 423 H VAL 55 H VAL 55 -2.954 -18.807 2.026 424 HA VAL 55 HA VAL 55 -1.025 -18.422 4.077 425 HB VAL 55 HB VAL 55 0.549 -18.957 1.703 426 HG11 VAL 55 HG11 VAL 55 1.950 -20.144 3.297 427 HG12 VAL 55 HG12 VAL 55 0.659 -20.083 4.498 428 HG13 VAL 55 HG13 VAL 55 1.428 -18.592 3.952 429 HG21 VAL 55 HG21 VAL 55 -1.056 -20.734 1.239 430 HG22 VAL 55 HG22 VAL 55 -0.884 -21.340 2.887 431 HG23 VAL 55 HG23 VAL 55 0.484 -21.411 1.775 432 HA PRO 56 HA PRO 56 -0.159 -15.209 0.595 433 HB2 PRO 56 HB2 PRO 56 -1.538 -15.427 -1.758 434 HB3 PRO 56 HB3 PRO 56 0.079 -16.095 -1.513 435 HG2 PRO 56 HG2 PRO 56 -2.578 -17.474 -1.357 436 HG3 PRO 56 HG3 PRO 56 -1.080 -18.018 -2.139 437 HD2 PRO 56 HD2 PRO 56 -1.808 -18.953 0.248 438 HD3 PRO 56 HD3 PRO 56 -0.109 -18.632 -0.127 439 H LYS 57 H LYS 57 -3.192 -16.628 1.214 440 HA LYS 57 HA LYS 57 -5.009 -14.623 0.540 441 HB2 LYS 57 HB2 LYS 57 -5.008 -17.013 2.217 442 HB3 LYS 57 HB3 LYS 57 -6.028 -15.742 2.864 443 HG2 LYS 57 HG2 LYS 57 -7.292 -17.258 1.455 444 HG3 LYS 57 HG3 LYS 57 -7.263 -15.633 0.778 445 HD2 LYS 57 HD2 LYS 57 -5.503 -16.321 -0.785 446 HD3 LYS 57 HD3 LYS 57 -5.535 -17.945 -0.101 447 HE2 LYS 57 HE2 LYS 57 -8.087 -16.781 -1.101 448 HE3 LYS 57 HE3 LYS 57 -6.898 -17.327 -2.283 449 HZ1 LYS 57 HZ1 LYS 57 -7.512 -19.165 -0.090 450 HZ2 LYS 57 HZ2 LYS 57 -7.199 -19.483 -1.727 451 HZ3 LYS 57 HZ3 LYS 57 -8.721 -18.928 -1.254 452 H LEU 58 H LEU 58 -2.731 -14.820 3.120 453 HA LEU 58 HA LEU 58 -4.001 -12.789 4.735 454 HB2 LEU 58 HB2 LEU 58 -2.163 -14.817 5.228 455 HB3 LEU 58 HB3 LEU 58 -1.193 -13.365 5.317 456 HG LEU 58 HG LEU 58 -2.033 -14.136 7.517 457 HD11 LEU 58 HD11 LEU 58 -3.018 -11.915 8.207 458 HD12 LEU 58 HD12 LEU 58 -2.870 -11.440 6.514 459 HD13 LEU 58 HD13 LEU 58 -1.432 -11.879 7.435 460 HD21 LEU 58 HD21 LEU 58 -4.193 -14.492 8.008 461 HD22 LEU 58 HD22 LEU 58 -4.371 -14.680 6.266 462 HD23 LEU 58 HD23 LEU 58 -4.755 -13.138 7.032 463 H ALA 59 H ALA 59 -1.243 -13.054 2.554 464 HA ALA 59 HA ALA 59 -0.342 -10.380 3.010 465 HB1 ALA 59 HB1 ALA 59 1.167 -10.853 1.083 466 HB2 ALA 59 HB2 ALA 59 0.391 -12.430 0.938 467 HB3 ALA 59 HB3 ALA 59 1.274 -12.013 2.405 468 H VAL 60 H VAL 60 -2.385 -11.920 0.557 469 HA VAL 60 HA VAL 60 -2.432 -9.663 -1.184 470 HB VAL 60 HB VAL 60 -4.382 -10.617 -2.270 471 HG11 VAL 60 HG11 VAL 60 -2.437 -12.819 -1.615 472 HG12 VAL 60 HG12 VAL 60 -2.174 -11.545 -2.808 473 HG13 VAL 60 HG13 VAL 60 -3.479 -12.709 -3.031 474 HG21 VAL 60 HG21 VAL 60 -4.559 -12.284 0.192 475 HG22 VAL 60 HG22 VAL 60 -5.128 -12.940 -1.341 476 HG23 VAL 60 HG23 VAL 60 -5.827 -11.451 -0.707 477 H LEU 61 H LEU 61 -4.158 -10.541 1.680 478 HA LEU 61 HA LEU 61 -6.321 -8.722 1.389 479 HB2 LEU 61 HB2 LEU 61 -5.857 -10.784 3.055 480 HB3 LEU 61 HB3 LEU 61 -5.384 -9.464 4.106 481 HG LEU 61 HG LEU 61 -7.664 -8.445 3.648 482 HD11 LEU 61 HD11 LEU 61 -8.362 -9.573 1.689 483 HD12 LEU 61 HD12 LEU 61 -9.389 -10.177 2.988 484 HD13 LEU 61 HD13 LEU 61 -8.045 -11.156 2.399 485 HD21 LEU 61 HD21 LEU 61 -7.534 -11.127 5.031 486 HD22 LEU 61 HD22 LEU 61 -8.785 -9.904 5.271 487 HD23 LEU 61 HD23 LEU 61 -7.117 -9.568 5.744 488 H THR 62 H THR 62 -3.172 -8.581 2.988 489 HA THR 62 HA THR 62 -3.553 -5.997 4.092 490 HB THR 62 HB THR 62 -0.966 -6.081 4.210 491 HG1 THR 62 HG1 THR 62 -0.777 -7.769 2.597 492 HG21 THR 62 HG21 THR 62 -2.986 -7.696 5.626 493 HG22 THR 62 HG22 THR 62 -1.843 -6.502 6.248 494 HG23 THR 62 HG23 THR 62 -1.302 -8.143 5.885 495 H ALA 63 H ALA 63 -2.207 -7.195 1.074 496 HA ALA 63 HA ALA 63 -0.908 -4.905 0.177 497 HB1 ALA 63 HB1 ALA 63 -0.741 -7.116 -0.884 498 HB2 ALA 63 HB2 ALA 63 -1.102 -5.840 -2.044 499 HB3 ALA 63 HB3 ALA 63 -2.380 -6.926 -1.503 500 H VAL 64 H VAL 64 -4.278 -5.894 -0.356 501 HA VAL 64 HA VAL 64 -4.898 -3.497 -1.791 502 HB VAL 64 HB VAL 64 -6.058 -5.671 -2.201 503 HG11 VAL 64 HG11 VAL 64 -7.928 -6.306 -0.756 504 HG12 VAL 64 HG12 VAL 64 -7.472 -5.045 0.389 505 HG13 VAL 64 HG13 VAL 64 -6.389 -6.405 0.094 506 HG21 VAL 64 HG21 VAL 64 -6.967 -3.579 -3.036 507 HG22 VAL 64 HG22 VAL 64 -7.820 -3.321 -1.514 508 HG23 VAL 64 HG23 VAL 64 -8.266 -4.671 -2.557 509 H GLN 65 H GLN 65 -5.283 -4.582 1.538 510 HA GLN 65 HA GLN 65 -6.994 -2.471 2.332 511 HB2 GLN 65 HB2 GLN 65 -5.643 -4.673 3.647 512 HB3 GLN 65 HB3 GLN 65 -5.562 -3.204 4.616 513 HG2 GLN 65 HG2 GLN 65 -8.158 -4.112 3.421 514 HG3 GLN 65 HG3 GLN 65 -7.575 -4.783 4.946 515 HE21 GLN 65 HE21 GLN 65 -8.640 -1.886 3.309 516 HE22 GLN 65 HE22 GLN 65 -8.992 -0.979 4.737 517 H ILE 66 H ILE 66 -3.464 -2.868 2.608 518 HA ILE 66 HA ILE 66 -2.913 -0.450 3.901 519 HB ILE 66 HB ILE 66 -1.256 -2.080 1.970 520 HG12 ILE 66 HG12 ILE 66 -0.921 -1.643 4.945 521 HG13 ILE 66 HG13 ILE 66 -1.831 -2.983 4.260 522 HG21 ILE 66 HG21 ILE 66 0.650 -0.735 2.440 523 HG22 ILE 66 HG22 ILE 66 -0.231 0.206 3.645 524 HG23 ILE 66 HG23 ILE 66 -0.637 0.359 1.936 525 HD11 ILE 66 HD11 ILE 66 0.332 -3.780 4.829 526 HD12 ILE 66 HD12 ILE 66 1.113 -2.441 3.990 527 HD13 ILE 66 HD13 ILE 66 0.257 -3.678 3.070 528 H ALA 67 H ALA 67 -3.254 -1.231 0.481 529 HA ALA 67 HA ALA 67 -2.546 1.251 -0.588 530 HB1 ALA 67 HB1 ALA 67 -4.529 -0.734 -1.680 531 HB2 ALA 67 HB2 ALA 67 -2.785 -0.803 -1.910 532 HB3 ALA 67 HB3 ALA 67 -3.708 0.534 -2.591 533 H SER 68 H SER 68 -5.809 -0.022 0.203 534 HA SER 68 HA SER 68 -7.203 2.291 -0.514 535 HB2 SER 68 HB2 SER 68 -8.877 1.350 1.316 536 HB3 SER 68 HB3 SER 68 -8.640 0.524 -0.223 537 HG SER 68 HG SER 68 -6.957 -0.157 1.905 538 H GLU 69 H GLU 69 -5.566 1.479 2.497 539 HA GLU 69 HA GLU 69 -6.657 3.597 4.033 540 HB2 GLU 69 HB2 GLU 69 -4.150 1.943 4.355 541 HB3 GLU 69 HB3 GLU 69 -4.639 3.170 5.518 542 HG2 GLU 69 HG2 GLU 69 -6.773 1.946 5.834 543 HG3 GLU 69 HG3 GLU 69 -6.167 0.678 4.768 544 H TYR 70 H TYR 70 -4.236 3.496 1.606 545 HA TYR 70 HA TYR 70 -3.183 6.115 2.411 546 HB2 TYR 70 HB2 TYR 70 -2.141 3.899 0.702 547 HB3 TYR 70 HB3 TYR 70 -1.572 5.538 0.408 548 HD1 TYR 70 HD1 TYR 70 -1.574 2.731 2.762 549 HD2 TYR 70 HD2 TYR 70 -0.178 6.684 2.031 550 HE1 TYR 70 HE1 TYR 70 0.059 2.483 4.579 551 HE2 TYR 70 HE2 TYR 70 1.460 6.446 3.851 552 HH TYR 70 HH TYR 70 2.074 3.392 5.378 553 H LEU 71 H LEU 71 -5.262 4.661 0.086 554 HA LEU 71 HA LEU 71 -4.987 6.482 -2.040 555 HB2 LEU 71 HB2 LEU 71 -6.972 4.483 -1.206 556 HB3 LEU 71 HB3 LEU 71 -7.665 5.826 -2.078 557 HG LEU 71 HG LEU 71 -7.183 3.917 -3.539 558 HD11 LEU 71 HD11 LEU 71 -7.096 6.249 -4.412 559 HD12 LEU 71 HD12 LEU 71 -6.144 5.079 -5.327 560 HD13 LEU 71 HD13 LEU 71 -5.342 6.193 -4.226 561 HD21 LEU 71 HD21 LEU 71 -5.201 3.084 -2.290 562 HD22 LEU 71 HD22 LEU 71 -4.266 4.404 -2.991 563 HD23 LEU 71 HD23 LEU 71 -4.973 3.177 -4.037 564 H LYS 72 H LYS 72 -7.083 6.537 0.796 565 HA LYS 72 HA LYS 72 -8.492 8.867 0.189 566 HB2 LYS 72 HB2 LYS 72 -8.972 9.010 2.625 567 HB3 LYS 72 HB3 LYS 72 -9.281 7.428 1.938 568 HG2 LYS 72 HG2 LYS 72 -8.284 6.925 3.952 569 HG3 LYS 72 HG3 LYS 72 -6.927 6.830 2.838 570 HD2 LYS 72 HD2 LYS 72 -6.168 8.013 4.743 571 HD3 LYS 72 HD3 LYS 72 -6.382 9.208 3.466 572 HE2 LYS 72 HE2 LYS 72 -8.509 9.880 4.418 573 HE3 LYS 72 HE3 LYS 72 -8.378 8.628 5.653 574 HZ1 LYS 72 HZ1 LYS 72 -6.387 9.739 6.488 575 HZ2 LYS 72 HZ2 LYS 72 -7.731 10.757 6.539 576 HZ3 LYS 72 HZ3 LYS 72 -6.564 10.904 5.324 577 H LEU 73 H LEU 73 -5.241 8.495 1.234 578 HA LEU 73 HA LEU 73 -4.861 10.990 2.498 579 HB2 LEU 73 HB2 LEU 73 -3.353 8.864 2.441 580 HB3 LEU 73 HB3 LEU 73 -2.698 9.562 0.977 581 HG LEU 73 HG LEU 73 -1.330 9.964 3.022 582 HD11 LEU 73 HD11 LEU 73 -1.126 11.414 1.071 583 HD12 LEU 73 HD12 LEU 73 -0.861 12.297 2.574 584 HD13 LEU 73 HD13 LEU 73 -2.393 12.459 1.716 585 HD21 LEU 73 HD21 LEU 73 -3.460 10.339 4.451 586 HD22 LEU 73 HD22 LEU 73 -3.335 12.009 3.884 587 HD23 LEU 73 HD23 LEU 73 -2.010 11.282 4.787 588 H LYS 74 H LYS 74 -4.337 9.920 -0.858 589 HA LYS 74 HA LYS 74 -3.475 12.501 -1.722 590 HB2 LYS 74 HB2 LYS 74 -3.427 11.623 -3.928 591 HB3 LYS 74 HB3 LYS 74 -2.893 10.333 -2.862 592 HG2 LYS 74 HG2 LYS 74 -4.847 9.107 -3.156 593 HG3 LYS 74 HG3 LYS 74 -5.751 10.512 -3.730 594 HD2 LYS 74 HD2 LYS 74 -5.303 9.110 -5.616 595 HD3 LYS 74 HD3 LYS 74 -4.278 10.536 -5.751 596 HE2 LYS 74 HE2 LYS 74 -2.388 9.268 -4.862 597 HE3 LYS 74 HE3 LYS 74 -3.412 7.844 -4.698 598 HZ1 LYS 74 HZ1 LYS 74 -2.234 7.569 -6.685 599 HZ2 LYS 74 HZ2 LYS 74 -2.502 9.160 -7.183 600 HZ3 LYS 74 HZ3 LYS 74 -3.779 8.053 -7.169 601 H GLU 75 H GLU 75 -6.533 10.958 -1.310 602 HA GLU 75 HA GLU 75 -8.054 12.591 -3.059 603 HB2 GLU 75 HB2 GLU 75 -8.736 10.361 -2.025 604 HB3 GLU 75 HB3 GLU 75 -9.077 11.259 -0.553 605 HG2 GLU 75 HG2 GLU 75 -11.096 10.874 -1.847 606 HG3 GLU 75 HG3 GLU 75 -10.731 12.593 -1.724 607 H GLU 76 H GLU 76 -7.465 12.722 0.463 608 HA GLU 76 HA GLU 76 -8.912 15.144 0.799 609 HB2 GLU 76 HB2 GLU 76 -8.007 15.231 3.038 610 HB3 GLU 76 HB3 GLU 76 -8.520 13.596 2.669 611 HG2 GLU 76 HG2 GLU 76 -6.058 13.160 2.099 612 HG3 GLU 76 HG3 GLU 76 -5.740 14.677 2.944 613 H TYR 77 H TYR 77 -5.614 14.398 -0.034 614 HA TYR 77 HA TYR 77 -4.438 16.906 0.410 615 HB2 TYR 77 HB2 TYR 77 -2.979 15.096 -0.066 616 HB3 TYR 77 HB3 TYR 77 -3.860 14.668 -1.524 617 HD1 TYR 77 HD1 TYR 77 -2.584 18.023 -0.520 618 HD2 TYR 77 HD2 TYR 77 -2.216 14.719 -3.169 619 HE1 TYR 77 HE1 TYR 77 -0.958 19.292 -1.854 620 HE2 TYR 77 HE2 TYR 77 -0.587 15.976 -4.520 621 HH TYR 77 HH TYR 77 1.055 18.481 -3.589 622 H GLN 78 H GLN 78 -5.999 15.559 -2.467 623 HA GLN 78 HA GLN 78 -5.794 17.862 -4.081 624 HB2 GLN 78 HB2 GLN 78 -6.305 16.023 -5.352 625 HB3 GLN 78 HB3 GLN 78 -7.376 15.342 -4.141 626 HG2 GLN 78 HG2 GLN 78 -8.690 17.629 -4.968 627 HG3 GLN 78 HG3 GLN 78 -7.980 16.980 -6.446 628 HE21 GLN 78 HE21 GLN 78 -8.976 15.040 -3.696 629 HE22 GLN 78 HE22 GLN 78 -10.275 14.222 -4.501 630 H ARG 79 H ARG 79 -8.113 16.876 -1.663 631 HA ARG 79 HA ARG 79 -10.112 18.801 -2.333 632 HB2 ARG 79 HB2 ARG 79 -9.638 17.052 0.065 633 HB3 ARG 79 HB3 ARG 79 -10.937 18.237 0.033 634 HG2 ARG 79 HG2 ARG 79 -11.910 17.164 -1.911 635 HG3 ARG 79 HG3 ARG 79 -10.586 16.001 -1.957 636 HD2 ARG 79 HD2 ARG 79 -11.285 14.952 0.008 637 HD3 ARG 79 HD3 ARG 79 -12.289 16.322 0.481 638 HE ARG 79 HE ARG 79 -13.002 14.772 -1.908 639 HH11 ARG 79 HH11 ARG 79 -13.711 15.790 1.370 640 HH12 ARG 79 HH12 ARG 79 -15.340 15.202 1.330 641 HH21 ARG 79 HH21 ARG 79 -15.157 14.027 -1.966 642 HH22 ARG 79 HH22 ARG 79 -16.169 14.217 -0.570 643 H LEU 80 H LEU 80 -7.336 18.730 -0.225 644 HA LEU 80 HA LEU 80 -7.935 21.088 1.235 645 HB2 LEU 80 HB2 LEU 80 -6.387 19.642 2.234 646 HB3 LEU 80 HB3 LEU 80 -5.453 19.472 0.758 647 HG LEU 80 HG LEU 80 -5.195 22.151 1.279 648 HD11 LEU 80 HD11 LEU 80 -6.319 21.864 3.455 649 HD12 LEU 80 HD12 LEU 80 -4.651 22.417 3.609 650 HD13 LEU 80 HD13 LEU 80 -5.055 20.730 3.933 651 HD21 LEU 80 HD21 LEU 80 -3.424 19.875 2.150 652 HD22 LEU 80 HD22 LEU 80 -2.928 21.563 2.050 653 HD23 LEU 80 HD23 LEU 80 -3.406 20.697 0.590 654 H ARG 81 H ARG 81 -6.151 20.419 -1.716 655 HA ARG 81 HA ARG 81 -4.984 22.951 -2.063 656 HB2 ARG 81 HB2 ARG 81 -5.749 20.855 -4.088 657 HB3 ARG 81 HB3 ARG 81 -4.785 22.275 -4.460 658 HG2 ARG 81 HG2 ARG 81 -3.169 21.471 -2.679 659 HG3 ARG 81 HG3 ARG 81 -4.077 19.957 -2.692 660 HD2 ARG 81 HD2 ARG 81 -2.120 19.825 -4.143 661 HD3 ARG 81 HD3 ARG 81 -3.612 19.684 -5.071 662 HE ARG 81 HE ARG 81 -3.207 22.217 -5.439 663 HH11 ARG 81 HH11 ARG 81 -0.703 19.758 -5.256 664 HH12 ARG 81 HH12 ARG 81 0.367 20.600 -6.329 665 HH21 ARG 81 HH21 ARG 81 -1.795 23.318 -6.833 666 HH22 ARG 81 HH22 ARG 81 -0.254 22.629 -7.230 667 H GLU 82 H GLU 82 -7.995 21.611 -3.435 668 HA GLU 82 HA GLU 82 -8.703 23.988 -4.801 669 HB2 GLU 82 HB2 GLU 82 -10.912 22.987 -5.072 670 HB3 GLU 82 HB3 GLU 82 -9.652 21.804 -5.392 671 HG2 GLU 82 HG2 GLU 82 -9.996 20.759 -3.281 672 HG3 GLU 82 HG3 GLU 82 -11.097 22.033 -2.769 673 H GLN 83 H GLN 83 -9.111 22.945 -1.511 674 HA GLN 83 HA GLN 83 -11.192 24.705 -0.765 675 HB2 GLN 83 HB2 GLN 83 -10.501 22.760 0.595 676 HB3 GLN 83 HB3 GLN 83 -8.974 23.556 0.944 677 HG2 GLN 83 HG2 GLN 83 -9.877 24.556 2.693 678 HG3 GLN 83 HG3 GLN 83 -11.068 25.336 1.652 679 HE21 GLN 83 HE21 GLN 83 -13.138 24.513 1.545 680 HE22 GLN 83 HE22 GLN 83 -13.714 23.279 2.613 681 H LEU 84 H LEU 84 -7.760 25.072 -1.155 682 HA LEU 84 HA LEU 84 -7.506 27.554 0.224 683 HB2 LEU 84 HB2 LEU 84 -5.609 26.030 -0.245 684 HB3 LEU 84 HB3 LEU 84 -5.774 26.384 -1.954 685 HG LEU 84 HG LEU 84 -5.354 28.839 -1.327 686 HD11 LEU 84 HD11 LEU 84 -4.256 27.579 1.179 687 HD12 LEU 84 HD12 LEU 84 -5.720 28.560 1.093 688 HD13 LEU 84 HD13 LEU 84 -4.156 29.277 0.711 689 HD21 LEU 84 HD21 LEU 84 -3.168 26.777 -1.042 690 HD22 LEU 84 HD22 LEU 84 -2.893 28.506 -1.239 691 HD23 LEU 84 HD23 LEU 84 -3.685 27.590 -2.519 692 H LYS 85 H LYS 85 -8.556 26.610 -2.920 693 HA LYS 85 HA LYS 85 -8.243 29.237 -4.088 694 HB2 LYS 85 HB2 LYS 85 -9.495 26.681 -5.091 695 HB3 LYS 85 HB3 LYS 85 -9.468 28.175 -6.021 696 HG2 LYS 85 HG2 LYS 85 -7.110 28.131 -6.193 697 HG3 LYS 85 HG3 LYS 85 -6.976 26.862 -4.977 698 HD2 LYS 85 HD2 LYS 85 -6.631 25.900 -7.150 699 HD3 LYS 85 HD3 LYS 85 -8.167 25.328 -6.509 700 HE2 LYS 85 HE2 LYS 85 -8.368 25.897 -8.862 701 HE3 LYS 85 HE3 LYS 85 -9.364 26.962 -7.874 702 HZ1 LYS 85 HZ1 LYS 85 -8.113 28.109 -9.645 703 HZ2 LYS 85 HZ2 LYS 85 -6.663 27.670 -8.893 704 HZ3 LYS 85 HZ3 LYS 85 -7.751 28.698 -8.102 705 H LYS 86 H LYS 86 -10.376 28.009 -1.921 706 HA LYS 86 HA LYS 86 -12.331 30.049 -2.548 707 HB2 LYS 86 HB2 LYS 86 -13.026 27.909 -3.744 708 HB3 LYS 86 HB3 LYS 86 -13.273 27.206 -2.151 709 HG2 LYS 86 HG2 LYS 86 -14.956 28.876 -1.650 710 HG3 LYS 86 HG3 LYS 86 -14.666 29.667 -3.200 711 HD2 LYS 86 HD2 LYS 86 -15.633 26.829 -2.868 712 HD3 LYS 86 HD3 LYS 86 -16.677 28.218 -3.190 713 HE2 LYS 86 HE2 LYS 86 -15.352 28.641 -5.263 714 HE3 LYS 86 HE3 LYS 86 -14.487 27.135 -4.959 715 HZ1 LYS 86 HZ1 LYS 86 -17.420 27.359 -5.354 716 HZ2 LYS 86 HZ2 LYS 86 -16.547 25.927 -5.148 717 HZ3 LYS 86 HZ3 LYS 86 -16.315 26.866 -6.535 718 H1 GLY 1 H1 GLY 1 -33.917 -13.402 6.623 719 H2 GLY 1 H2 GLY 1 -33.498 -14.939 7.180 720 H3 GLY 1 H3 GLY 1 -32.309 -13.921 6.540 721 HA2 GLY 1 HA3 GLY 1 -33.844 -13.442 9.031 722 HA3 GLY 1 HA2 GLY 1 -32.177 -13.992 8.948 723 H SER 2 H SER 2 -33.917 -11.393 9.643 724 HA SER 2 HA SER 2 -31.885 -9.565 8.544 725 HB2 SER 2 HB2 SER 2 -34.827 -9.001 9.006 726 HB3 SER 2 HB3 SER 2 -33.634 -7.804 8.500 727 HG SER 2 HG SER 2 -33.696 -8.565 6.536 728 H HIS 3 H HIS 3 -31.301 -7.785 9.887 729 HA HIS 3 HA HIS 3 -32.320 -7.575 12.559 730 HB2 HIS 3 HB2 HIS 3 -30.671 -9.577 12.518 731 HB3 HIS 3 HB3 HIS 3 -29.418 -8.350 12.369 732 HD1 HIS 3 HD1 HIS 3 -32.066 -9.576 14.753 733 HD2 HIS 3 HD2 HIS 3 -28.773 -7.041 14.711 734 HE1 HIS 3 HE1 HIS 3 -31.656 -8.964 17.153 735 HE2 HIS 3 HE2 HIS 3 -29.567 -7.560 17.117 736 H MET 4 H MET 4 -32.029 -5.553 13.283 737 HA MET 4 HA MET 4 -30.480 -3.750 11.597 738 HB2 MET 4 HB2 MET 4 -32.379 -3.159 13.879 739 HB3 MET 4 HB3 MET 4 -31.607 -1.949 12.862 740 HG2 MET 4 HG2 MET 4 -32.767 -2.831 10.915 741 HG3 MET 4 HG3 MET 4 -33.527 -4.064 11.918 742 HE1 MET 4 HE1 MET 4 -32.897 -0.154 12.373 743 HE2 MET 4 HE2 MET 4 -34.491 0.434 11.899 744 HE3 MET 4 HE3 MET 4 -33.479 -0.413 10.729 745 H THR 5 H THR 5 -28.877 -2.368 12.416 746 HA THR 5 HA THR 5 -27.981 -2.572 15.126 747 HB THR 5 HB THR 5 -27.102 -4.702 14.228 748 HG1 THR 5 HG1 THR 5 -24.739 -3.273 14.396 749 HG21 THR 5 HG21 THR 5 -26.878 -4.099 11.882 750 HG22 THR 5 HG22 THR 5 -25.335 -4.674 12.510 751 HG23 THR 5 HG23 THR 5 -25.603 -2.947 12.276 752 H GLU 6 H GLU 6 -25.656 -1.499 15.196 753 HA GLU 6 HA GLU 6 -25.904 1.133 14.256 754 HB2 GLU 6 HB2 GLU 6 -24.589 0.584 16.225 755 HB3 GLU 6 HB3 GLU 6 -23.504 -0.403 15.264 756 HG2 GLU 6 HG2 GLU 6 -23.099 1.856 13.987 757 HG3 GLU 6 HG3 GLU 6 -23.669 2.552 15.506 758 H GLN 7 H GLN 7 -24.830 2.232 12.572 759 HA GLN 7 HA GLN 7 -24.100 0.537 10.323 760 HB2 GLN 7 HB2 GLN 7 -24.655 3.486 10.601 761 HB3 GLN 7 HB3 GLN 7 -24.012 2.790 9.119 762 HG2 GLN 7 HG2 GLN 7 -25.960 1.425 8.845 763 HG3 GLN 7 HG3 GLN 7 -26.575 1.914 10.422 764 HE21 GLN 7 HE21 GLN 7 -25.014 4.201 8.344 765 HE22 GLN 7 HE22 GLN 7 -26.435 5.080 7.907 766 HA PRO 8 HA PRO 8 -19.828 1.546 11.393 767 HB2 PRO 8 HB2 PRO 8 -18.826 -0.897 10.962 768 HB3 PRO 8 HB3 PRO 8 -19.828 -0.556 12.375 769 HG2 PRO 8 HG2 PRO 8 -20.480 -2.086 9.935 770 HG3 PRO 8 HG3 PRO 8 -21.177 -2.204 11.557 771 HD2 PRO 8 HD2 PRO 8 -22.201 -0.774 9.268 772 HD3 PRO 8 HD3 PRO 8 -22.930 -0.945 10.877 773 H LYS 9 H LYS 9 -17.714 0.783 10.147 774 HA LYS 9 HA LYS 9 -17.619 2.023 7.686 775 HB2 LYS 9 HB2 LYS 9 -15.407 0.981 7.427 776 HB3 LYS 9 HB3 LYS 9 -15.640 1.597 9.057 777 HG2 LYS 9 HG2 LYS 9 -16.398 -0.861 9.554 778 HG3 LYS 9 HG3 LYS 9 -15.466 -1.219 8.102 779 HD2 LYS 9 HD2 LYS 9 -13.817 -1.442 9.661 780 HD3 LYS 9 HD3 LYS 9 -13.662 0.282 9.332 781 HE2 LYS 9 HE2 LYS 9 -14.951 0.823 11.291 782 HE3 LYS 9 HE3 LYS 9 -15.315 -0.875 11.573 783 HZ1 LYS 9 HZ1 LYS 9 -13.582 -0.274 13.041 784 HZ2 LYS 9 HZ2 LYS 9 -12.679 0.460 11.814 785 HZ3 LYS 9 HZ3 LYS 9 -12.872 -1.223 11.834 786 H THR 10 H THR 10 -18.131 1.443 5.655 787 HA THR 10 HA THR 10 -19.456 -1.046 5.216 788 HB THR 10 HB THR 10 -20.102 1.142 4.132 789 HG1 THR 10 HG1 THR 10 -20.875 0.076 2.348 790 HG21 THR 10 HG21 THR 10 -18.986 1.756 2.042 791 HG22 THR 10 HG22 THR 10 -17.782 0.495 2.309 792 HG23 THR 10 HG23 THR 10 -17.878 1.869 3.410 793 H ARG 11 H ARG 11 -18.905 -2.663 3.732 794 HA ARG 11 HA ARG 11 -16.018 -2.883 3.197 795 HB2 ARG 11 HB2 ARG 11 -16.250 -5.314 3.435 796 HB3 ARG 11 HB3 ARG 11 -16.752 -4.488 4.902 797 HG2 ARG 11 HG2 ARG 11 -19.112 -4.746 4.176 798 HG3 ARG 11 HG3 ARG 11 -18.539 -5.693 2.800 799 HD2 ARG 11 HD2 ARG 11 -17.511 -7.290 4.379 800 HD3 ARG 11 HD3 ARG 11 -18.168 -6.356 5.723 801 HE ARG 11 HE ARG 11 -20.260 -7.034 3.985 802 HH11 ARG 11 HH11 ARG 11 -18.081 -8.570 6.258 803 HH12 ARG 11 HH12 ARG 11 -19.165 -9.880 6.602 804 HH21 ARG 11 HH21 ARG 11 -21.678 -8.760 4.443 805 HH22 ARG 11 HH22 ARG 11 -21.197 -9.992 5.567 806 H VAL 12 H VAL 12 -15.398 -3.903 1.237 807 HA VAL 12 HA VAL 12 -17.529 -4.042 -0.792 808 HB VAL 12 HB VAL 12 -16.185 -1.941 -0.970 809 HG11 VAL 12 HG11 VAL 12 -13.936 -3.841 -1.599 810 HG12 VAL 12 HG12 VAL 12 -14.030 -2.710 -0.252 811 HG13 VAL 12 HG13 VAL 12 -13.898 -2.105 -1.904 812 HG21 VAL 12 HG21 VAL 12 -15.917 -3.830 -3.307 813 HG22 VAL 12 HG22 VAL 12 -15.837 -2.068 -3.380 814 HG23 VAL 12 HG23 VAL 12 -17.340 -2.865 -2.914 815 H SER 13 H SER 13 -17.255 -5.547 -2.449 816 HA SER 13 HA SER 13 -15.305 -7.659 -1.858 817 HB2 SER 13 HB2 SER 13 -17.724 -7.933 -3.638 818 HB3 SER 13 HB3 SER 13 -16.822 -9.202 -2.813 819 HG SER 13 HG SER 13 -17.550 -7.980 -0.828 820 H VAL 14 H VAL 14 -13.616 -7.853 -3.197 821 HA VAL 14 HA VAL 14 -13.913 -6.993 -5.997 822 HB VAL 14 HB VAL 14 -11.586 -6.115 -5.954 823 HG11 VAL 14 HG11 VAL 14 -12.104 -4.014 -4.754 824 HG12 VAL 14 HG12 VAL 14 -13.539 -4.790 -4.080 825 HG13 VAL 14 HG13 VAL 14 -13.401 -4.546 -5.822 826 HG21 VAL 14 HG21 VAL 14 -11.839 -6.378 -2.958 827 HG22 VAL 14 HG22 VAL 14 -10.502 -5.634 -3.832 828 HG23 VAL 14 HG23 VAL 14 -10.802 -7.366 -3.990 829 H ARG 15 H ARG 15 -11.914 -7.825 -7.295 830 HA ARG 15 HA ARG 15 -11.197 -10.500 -6.309 831 HB2 ARG 15 HB2 ARG 15 -12.946 -10.658 -8.038 832 HB3 ARG 15 HB3 ARG 15 -11.923 -9.758 -9.151 833 HG2 ARG 15 HG2 ARG 15 -10.574 -11.531 -9.565 834 HG3 ARG 15 HG3 ARG 15 -10.775 -12.203 -7.948 835 HD2 ARG 15 HD2 ARG 15 -11.826 -13.645 -9.588 836 HD3 ARG 15 HD3 ARG 15 -13.047 -12.922 -8.540 837 HE ARG 15 HE ARG 15 -13.113 -11.220 -10.559 838 HH11 ARG 15 HH11 ARG 15 -12.999 -14.724 -10.605 839 HH12 ARG 15 HH12 ARG 15 -13.832 -14.852 -12.122 840 HH21 ARG 15 HH21 ARG 15 -14.209 -11.396 -12.545 841 HH22 ARG 15 HH22 ARG 15 -14.511 -12.964 -13.227 842 H ILE 16 H ILE 16 -9.077 -10.860 -6.228 843 HA ILE 16 HA ILE 16 -7.308 -9.357 -8.034 844 HB ILE 16 HB ILE 16 -6.782 -9.822 -5.086 845 HG12 ILE 16 HG12 ILE 16 -7.110 -7.146 -6.438 846 HG13 ILE 16 HG13 ILE 16 -8.495 -8.018 -5.791 847 HG21 ILE 16 HG21 ILE 16 -4.766 -9.916 -6.490 848 HG22 ILE 16 HG22 ILE 16 -4.764 -8.511 -5.427 849 HG23 ILE 16 HG23 ILE 16 -5.153 -8.320 -7.137 850 HD11 ILE 16 HD11 ILE 16 -7.686 -6.363 -4.220 851 HD12 ILE 16 HD12 ILE 16 -6.093 -7.114 -4.226 852 HD13 ILE 16 HD13 ILE 16 -7.477 -7.991 -3.575 853 H TYR 17 H TYR 17 -5.839 -10.578 -9.017 854 HA TYR 17 HA TYR 17 -4.590 -12.339 -9.682 855 HB2 TYR 17 HB2 TYR 17 -3.965 -12.063 -7.085 856 HB3 TYR 17 HB3 TYR 17 -4.622 -13.694 -7.044 857 HD1 TYR 17 HD1 TYR 17 -2.132 -11.593 -8.853 858 HD2 TYR 17 HD2 TYR 17 -3.264 -15.507 -7.621 859 HE1 TYR 17 HE1 TYR 17 0.020 -12.464 -9.664 860 HE2 TYR 17 HE2 TYR 17 -1.116 -16.388 -8.430 861 HH TYR 17 HH TYR 17 0.634 -15.779 -10.048 862 H GLY 18 H GLY 18 -7.627 -12.532 -9.407 863 HA2 GLY 18 HA2 GLY 18 -8.994 -14.146 -10.440 864 HA3 GLY 18 HA3 GLY 18 -7.751 -15.352 -10.149 865 H GLN 19 H GLN 19 -8.462 -13.474 -7.404 866 HA GLN 19 HA GLN 19 -10.436 -15.438 -6.464 867 HB2 GLN 19 HB2 GLN 19 -7.932 -14.545 -5.032 868 HB3 GLN 19 HB3 GLN 19 -9.273 -15.341 -4.216 869 HG2 GLN 19 HG2 GLN 19 -7.858 -16.563 -6.566 870 HG3 GLN 19 HG3 GLN 19 -7.320 -16.796 -4.904 871 HE21 GLN 19 HE21 GLN 19 -9.924 -17.360 -7.168 872 HE22 GLN 19 HE22 GLN 19 -10.665 -18.654 -6.289 873 H ASP 20 H ASP 20 -12.079 -14.602 -5.248 874 HA ASP 20 HA ASP 20 -12.219 -11.706 -5.138 875 HB2 ASP 20 HB2 ASP 20 -14.561 -11.952 -4.706 876 HB3 ASP 20 HB3 ASP 20 -14.133 -13.077 -5.988 877 H TYR 21 H TYR 21 -12.264 -10.468 -3.348 878 HA TYR 21 HA TYR 21 -12.123 -11.808 -0.738 879 HB2 TYR 21 HB2 TYR 21 -10.259 -9.614 -1.675 880 HB3 TYR 21 HB3 TYR 21 -10.304 -10.288 -0.049 881 HD1 TYR 21 HD2 TYR 21 -9.913 -12.850 0.138 882 HD2 TYR 21 HD1 TYR 21 -8.804 -10.519 -3.246 883 HE1 TYR 21 HE2 TYR 21 -8.306 -14.585 -0.527 884 HE2 TYR 21 HE1 TYR 21 -7.192 -12.250 -3.917 885 HH TYR 21 HH TYR 21 -5.996 -14.070 -3.068 886 H THR 22 H THR 22 -12.479 -10.318 1.069 887 HA THR 22 HA THR 22 -14.213 -8.058 0.329 888 HB THR 22 HB THR 22 -15.279 -8.672 2.665 889 HG1 THR 22 HG1 THR 22 -13.845 -10.397 3.107 890 HG21 THR 22 HG21 THR 22 -16.560 -8.649 0.623 891 HG22 THR 22 HG22 THR 22 -16.917 -10.139 1.494 892 HG23 THR 22 HG23 THR 22 -15.836 -10.170 0.100 893 H ILE 23 H ILE 23 -13.493 -6.155 1.081 894 HA ILE 23 HA ILE 23 -12.016 -6.100 3.610 895 HB ILE 23 HB ILE 23 -10.346 -4.545 2.757 896 HG12 ILE 23 HG12 ILE 23 -11.854 -3.787 0.807 897 HG13 ILE 23 HG13 ILE 23 -10.120 -3.855 0.541 898 HG21 ILE 23 HG21 ILE 23 -10.479 -7.223 1.420 899 HG22 ILE 23 HG22 ILE 23 -9.594 -6.757 2.867 900 HG23 ILE 23 HG23 ILE 23 -9.073 -6.170 1.288 901 HD11 ILE 23 HD11 ILE 23 -10.285 -5.614 -0.919 902 HD12 ILE 23 HD12 ILE 23 -11.784 -4.751 -1.249 903 HD13 ILE 23 HD13 ILE 23 -11.801 -6.191 -0.237 904 H VAL 24 H VAL 24 -11.621 -3.700 4.216 905 HA VAL 24 HA VAL 24 -14.205 -2.419 4.194 906 HB VAL 24 HB VAL 24 -11.608 -1.536 5.469 907 HG11 VAL 24 HG11 VAL 24 -14.429 -0.546 5.875 908 HG12 VAL 24 HG12 VAL 24 -13.108 0.343 5.119 909 HG13 VAL 24 HG13 VAL 24 -13.029 -0.062 6.833 910 HG21 VAL 24 HG21 VAL 24 -12.465 -3.684 6.325 911 HG22 VAL 24 HG22 VAL 24 -13.999 -2.898 6.706 912 HG23 VAL 24 HG23 VAL 24 -12.524 -2.404 7.537 913 H GLY 25 H GLY 25 -14.821 -0.725 2.976 914 HA2 GLY 25 HA2 GLY 25 -12.759 0.858 1.597 915 HA3 GLY 25 HA3 GLY 25 -14.036 0.107 0.649 916 H ALA 26 H ALA 26 -13.973 1.839 3.747 917 HA ALA 26 HA ALA 26 -16.400 3.237 3.029 918 HB1 ALA 26 HB1 ALA 26 -14.705 3.421 5.515 919 HB2 ALA 26 HB2 ALA 26 -16.122 2.393 5.294 920 HB3 ALA 26 HB3 ALA 26 -16.297 4.149 5.294 921 H GLU 27 H GLU 27 -15.214 4.244 1.161 922 HA GLU 27 HA GLU 27 -14.447 6.927 1.951 923 HB2 GLU 27 HB2 GLU 27 -12.292 5.857 1.870 924 HB3 GLU 27 HB3 GLU 27 -12.647 5.123 0.315 925 HG2 GLU 27 HG2 GLU 27 -12.974 7.867 -0.072 926 HG3 GLU 27 HG3 GLU 27 -11.523 7.700 0.921 927 H SER 28 H SER 28 -14.234 5.058 -1.094 928 HA SER 28 HA SER 28 -16.581 6.344 -2.154 929 HB2 SER 28 HB2 SER 28 -13.824 6.965 -3.239 930 HB3 SER 28 HB3 SER 28 -15.303 7.240 -4.160 931 HG SER 28 HG SER 28 -15.217 8.265 -1.576 932 HA PRO 29 HA PRO 29 -16.820 2.197 -3.754 933 HB2 PRO 29 HB2 PRO 29 -18.635 2.906 -5.778 934 HB3 PRO 29 HB3 PRO 29 -19.032 2.304 -4.168 935 HG2 PRO 29 HG2 PRO 29 -18.989 5.088 -5.199 936 HG3 PRO 29 HG3 PRO 29 -20.037 4.360 -3.971 937 HD2 PRO 29 HD2 PRO 29 -18.031 6.023 -3.326 938 HD3 PRO 29 HD3 PRO 29 -18.468 4.647 -2.292 939 H ALA 30 H ALA 30 -16.572 4.897 -6.083 940 HA ALA 30 HA ALA 30 -15.547 3.201 -8.152 941 HB1 ALA 30 HB1 ALA 30 -15.236 5.233 -9.422 942 HB2 ALA 30 HB2 ALA 30 -15.477 6.205 -7.971 943 HB3 ALA 30 HB3 ALA 30 -16.811 5.257 -8.626 944 H HIS 31 H HIS 31 -14.152 5.326 -5.746 945 HA HIS 31 HA HIS 31 -11.508 5.345 -6.789 946 HB2 HIS 31 HB2 HIS 31 -12.729 6.849 -4.966 947 HB3 HIS 31 HB3 HIS 31 -12.004 5.684 -3.865 948 HD1 HIS 31 HD1 HIS 31 -10.182 7.034 -2.825 949 HD2 HIS 31 HD2 HIS 31 -10.227 7.336 -6.977 950 HE1 HIS 31 HE1 HIS 31 -8.137 8.367 -3.435 951 HE2 HIS 31 HE2 HIS 31 -8.356 8.767 -5.911 952 H ILE 32 H ILE 32 -13.124 3.410 -4.288 953 HA ILE 32 HA ILE 32 -10.787 1.891 -3.651 954 HB ILE 32 HB ILE 32 -12.220 0.478 -2.310 955 HG12 ILE 32 HG12 ILE 32 -14.555 1.971 -3.545 956 HG13 ILE 32 HG13 ILE 32 -14.117 0.304 -3.893 957 HG21 ILE 32 HG21 ILE 32 -11.558 2.737 -1.501 958 HG22 ILE 32 HG22 ILE 32 -13.034 2.119 -0.761 959 HG23 ILE 32 HG23 ILE 32 -13.130 3.340 -2.031 960 HD11 ILE 32 HD11 ILE 32 -14.474 -0.150 -1.430 961 HD12 ILE 32 HD12 ILE 32 -15.906 0.202 -2.396 962 HD13 ILE 32 HD13 ILE 32 -15.221 1.447 -1.354 963 H ARG 33 H ARG 33 -13.028 1.730 -6.211 964 HA ARG 33 HA ARG 33 -12.880 -1.094 -6.653 965 HB2 ARG 33 HB2 ARG 33 -14.519 0.872 -7.607 966 HB3 ARG 33 HB3 ARG 33 -13.477 0.588 -8.994 967 HG2 ARG 33 HG2 ARG 33 -15.306 -0.839 -9.295 968 HG3 ARG 33 HG3 ARG 33 -14.011 -1.878 -8.694 969 HD2 ARG 33 HD2 ARG 33 -15.091 -1.213 -6.362 970 HD3 ARG 33 HD3 ARG 33 -16.518 -0.996 -7.372 971 HE ARG 33 HE ARG 33 -14.999 -3.524 -7.242 972 HH11 ARG 33 HH11 ARG 33 -18.028 -1.783 -7.466 973 HH12 ARG 33 HH12 ARG 33 -18.998 -3.216 -7.398 974 HH21 ARG 33 HH21 ARG 33 -16.288 -5.409 -7.106 975 HH22 ARG 33 HH22 ARG 33 -18.015 -5.269 -7.171 976 H LEU 34 H LEU 34 -11.146 1.724 -7.889 977 HA LEU 34 HA LEU 34 -9.655 0.210 -9.800 978 HB2 LEU 34 HB2 LEU 34 -8.355 2.233 -10.138 979 HB3 LEU 34 HB3 LEU 34 -10.067 2.585 -10.141 980 HG LEU 34 HG LEU 34 -9.494 3.103 -7.551 981 HD11 LEU 34 HD11 LEU 34 -7.402 4.390 -7.487 982 HD12 LEU 34 HD12 LEU 34 -7.022 3.836 -9.117 983 HD13 LEU 34 HD13 LEU 34 -7.118 2.678 -7.792 984 HD21 LEU 34 HD21 LEU 34 -9.439 5.474 -8.228 985 HD22 LEU 34 HD22 LEU 34 -10.715 4.564 -9.039 986 HD23 LEU 34 HD23 LEU 34 -9.233 4.968 -9.904 987 H VAL 35 H VAL 35 -9.383 0.762 -6.446 988 HA VAL 35 HA VAL 35 -6.629 0.558 -6.030 989 HB VAL 35 HB VAL 35 -8.907 -0.404 -4.282 990 HG11 VAL 35 HG11 VAL 35 -7.349 -0.414 -2.443 991 HG12 VAL 35 HG12 VAL 35 -6.043 0.109 -3.509 992 HG13 VAL 35 HG13 VAL 35 -6.763 -1.487 -3.716 993 HG21 VAL 35 HG21 VAL 35 -9.009 1.968 -4.723 994 HG22 VAL 35 HG22 VAL 35 -7.307 2.154 -4.307 995 HG23 VAL 35 HG23 VAL 35 -8.474 1.705 -3.063 996 H ALA 36 H ALA 36 -9.108 -1.979 -6.197 997 HA ALA 36 HA ALA 36 -7.400 -4.159 -5.726 998 HB1 ALA 36 HB1 ALA 36 -9.877 -4.227 -5.603 999 HB2 ALA 36 HB2 ALA 36 -9.185 -5.542 -6.551 1000 HB3 ALA 36 HB3 ALA 36 -9.929 -4.168 -7.364 1001 H ALA 37 H ALA 37 -8.362 -2.533 -8.706 1002 HA ALA 37 HA ALA 37 -7.111 -4.357 -10.479 1003 HB1 ALA 37 HB1 ALA 37 -8.891 -2.844 -11.196 1004 HB2 ALA 37 HB2 ALA 37 -7.440 -2.645 -12.178 1005 HB3 ALA 37 HB3 ALA 37 -7.828 -1.463 -10.929 1006 H PHE 38 H PHE 38 -6.023 -1.504 -8.769 1007 HA PHE 38 HA PHE 38 -3.595 -1.142 -10.180 1008 HB2 PHE 38 HB2 PHE 38 -4.620 0.615 -8.783 1009 HB3 PHE 38 HB3 PHE 38 -4.330 -0.356 -7.346 1010 HD1 PHE 38 HD2 PHE 38 -2.097 0.417 -10.231 1011 HD2 PHE 38 HD1 PHE 38 -2.832 0.827 -6.061 1012 HE1 PHE 38 HE2 PHE 38 0.096 1.486 -9.957 1013 HE2 PHE 38 HE1 PHE 38 -0.634 1.903 -5.777 1014 HZ PHE 38 HZ PHE 38 0.835 2.233 -7.731 1015 H VAL 39 H VAL 39 -4.462 -2.931 -7.251 1016 HA VAL 39 HA VAL 39 -1.811 -3.809 -6.680 1017 HB VAL 39 HB VAL 39 -4.455 -4.977 -5.783 1018 HG11 VAL 39 HG11 VAL 39 -2.619 -6.576 -5.552 1019 HG12 VAL 39 HG12 VAL 39 -3.183 -6.014 -3.976 1020 HG13 VAL 39 HG13 VAL 39 -1.684 -5.379 -4.656 1021 HG21 VAL 39 HG21 VAL 39 -2.688 -2.815 -4.697 1022 HG22 VAL 39 HG22 VAL 39 -3.738 -3.748 -3.631 1023 HG23 VAL 39 HG23 VAL 39 -4.433 -2.806 -4.948 1024 H ASP 40 H ASP 40 -4.591 -5.255 -8.316 1025 HA ASP 40 HA ASP 40 -3.583 -7.806 -8.779 1026 HB2 ASP 40 HB2 ASP 40 -5.914 -7.232 -9.195 1027 HB3 ASP 40 HB3 ASP 40 -5.442 -6.150 -10.501 1028 H ASP 41 H ASP 41 -3.223 -4.855 -10.711 1029 HA ASP 41 HA ASP 41 -1.815 -6.021 -12.860 1030 HB2 ASP 41 HB2 ASP 41 -2.879 -3.776 -12.923 1031 HB3 ASP 41 HB3 ASP 41 -1.638 -3.181 -11.826 1032 H LYS 42 H LYS 42 -0.722 -4.416 -9.896 1033 HA LYS 42 HA LYS 42 2.037 -4.543 -10.426 1034 HB2 LYS 42 HB2 LYS 42 0.886 -3.128 -8.682 1035 HB3 LYS 42 HB3 LYS 42 0.756 -4.576 -7.693 1036 HG2 LYS 42 HG2 LYS 42 3.003 -4.649 -7.252 1037 HG3 LYS 42 HG3 LYS 42 3.432 -3.794 -8.734 1038 HD2 LYS 42 HD2 LYS 42 1.893 -2.405 -6.578 1039 HD3 LYS 42 HD3 LYS 42 3.643 -2.582 -6.445 1040 HE2 LYS 42 HE2 LYS 42 2.193 -1.326 -8.779 1041 HE3 LYS 42 HE3 LYS 42 2.965 -0.433 -7.468 1042 HZ1 LYS 42 HZ1 LYS 42 5.064 -1.647 -8.130 1043 HZ2 LYS 42 HZ2 LYS 42 4.511 -0.471 -9.211 1044 HZ3 LYS 42 HZ3 LYS 42 4.252 -2.113 -9.547 1045 H MET 43 H MET 43 -0.157 -6.862 -8.917 1046 HA MET 43 HA MET 43 1.813 -8.637 -7.946 1047 HB2 MET 43 HB2 MET 43 -1.013 -9.199 -8.863 1048 HB3 MET 43 HB3 MET 43 0.012 -10.360 -8.029 1049 HG2 MET 43 HG2 MET 43 -0.517 -7.704 -6.787 1050 HG3 MET 43 HG3 MET 43 -1.746 -8.963 -6.722 1051 HE1 MET 43 HE1 MET 43 -0.753 -11.445 -6.487 1052 HE2 MET 43 HE2 MET 43 -1.434 -11.219 -4.874 1053 HE3 MET 43 HE3 MET 43 0.190 -11.886 -5.066 1054 H HIS 44 H HIS 44 0.405 -8.163 -11.099 1055 HA HIS 44 HA HIS 44 1.482 -10.608 -12.175 1056 HB2 HIS 44 HB2 HIS 44 -0.654 -9.331 -12.922 1057 HB3 HIS 44 HB3 HIS 44 0.461 -8.332 -13.845 1058 HD1 HIS 44 HD1 HIS 44 -1.074 -11.728 -13.750 1059 HD2 HIS 44 HD2 HIS 44 1.660 -9.609 -16.055 1060 HE1 HIS 44 HE1 HIS 44 -0.742 -13.093 -15.829 1061 HE2 HIS 44 HE2 HIS 44 0.745 -11.684 -17.294 1062 H GLU 45 H GLU 45 2.788 -7.577 -11.479 1063 HA GLU 45 HA GLU 45 4.751 -7.745 -13.652 1064 HB2 GLU 45 HB2 GLU 45 5.258 -5.523 -13.300 1065 HB3 GLU 45 HB3 GLU 45 3.574 -5.554 -12.805 1066 HG2 GLU 45 HG2 GLU 45 4.210 -5.624 -10.474 1067 HG3 GLU 45 HG3 GLU 45 5.910 -5.749 -10.913 1068 H PHE 46 H PHE 46 4.390 -8.453 -10.303 1069 HA PHE 46 HA PHE 46 7.284 -8.712 -9.954 1070 HB2 PHE 46 HB2 PHE 46 4.984 -8.451 -8.076 1071 HB3 PHE 46 HB3 PHE 46 6.428 -9.293 -7.520 1072 HD1 PHE 46 HD1 PHE 46 8.594 -8.110 -7.461 1073 HD2 PHE 46 HD2 PHE 46 4.948 -6.099 -8.319 1074 HE1 PHE 46 HE1 PHE 46 9.673 -5.955 -6.967 1075 HE2 PHE 46 HE2 PHE 46 6.015 -3.939 -7.823 1076 HZ PHE 46 HZ PHE 46 8.384 -3.868 -7.147 1077 H SER 47 H SER 47 4.606 -10.590 -10.750 1078 HA SER 47 HA SER 47 5.228 -13.019 -9.466 1079 HB2 SER 47 HB2 SER 47 3.948 -13.913 -11.607 1080 HB3 SER 47 HB3 SER 47 3.091 -13.021 -10.346 1081 HG SER 47 HG SER 47 3.753 -12.263 -12.935 1082 H GLU 48 H GLU 48 6.526 -11.419 -12.238 1083 HA GLU 48 HA GLU 48 7.872 -13.742 -13.287 1084 HB2 GLU 48 HB2 GLU 48 8.867 -12.213 -14.904 1085 HB3 GLU 48 HB3 GLU 48 7.132 -11.954 -14.794 1086 HG2 GLU 48 HG2 GLU 48 7.635 -9.792 -14.635 1087 HG3 GLU 48 HG3 GLU 48 8.110 -10.156 -12.977 1088 H LYS 49 H LYS 49 8.442 -11.729 -10.693 1089 HA LYS 49 HA LYS 49 11.319 -11.639 -10.863 1090 HB2 LYS 49 HB2 LYS 49 9.458 -11.043 -8.556 1091 HB3 LYS 49 HB3 LYS 49 11.191 -10.755 -8.545 1092 HG2 LYS 49 HG2 LYS 49 9.363 -9.489 -10.566 1093 HG3 LYS 49 HG3 LYS 49 9.693 -8.760 -8.992 1094 HD2 LYS 49 HD2 LYS 49 12.097 -8.763 -9.521 1095 HD3 LYS 49 HD3 LYS 49 11.732 -9.440 -11.111 1096 HE2 LYS 49 HE2 LYS 49 10.805 -6.774 -10.042 1097 HE3 LYS 49 HE3 LYS 49 12.065 -7.032 -11.247 1098 HZ1 LYS 49 HZ1 LYS 49 10.245 -6.556 -12.540 1099 HZ2 LYS 49 HZ2 LYS 49 9.153 -7.339 -11.519 1100 HZ3 LYS 49 HZ3 LYS 49 10.181 -8.251 -12.516 1101 H GLN 50 H GLN 50 8.875 -13.467 -9.129 1102 HA GLN 50 HA GLN 50 8.938 -15.349 -7.854 1103 HB2 GLN 50 HB2 GLN 50 10.836 -15.948 -10.102 1104 HB3 GLN 50 HB3 GLN 50 10.461 -17.152 -8.878 1105 HG2 GLN 50 HG2 GLN 50 8.467 -17.596 -9.765 1106 HG3 GLN 50 HG3 GLN 50 8.088 -15.891 -9.996 1107 HE21 GLN 50 HE21 GLN 50 7.628 -18.169 -11.758 1108 HE22 GLN 50 HE22 GLN 50 8.433 -17.795 -13.242 1109 HA PRO 51 HA PRO 51 12.648 -14.061 -5.374 1110 HB2 PRO 51 HB2 PRO 51 11.267 -14.281 -2.982 1111 HB3 PRO 51 HB3 PRO 51 11.483 -12.788 -3.897 1112 HG2 PRO 51 HG2 PRO 51 9.123 -14.582 -3.734 1113 HG3 PRO 51 HG3 PRO 51 9.196 -12.828 -3.942 1114 HD2 PRO 51 HD2 PRO 51 8.645 -14.550 -5.978 1115 HD3 PRO 51 HD3 PRO 51 9.421 -12.973 -6.214 1116 H MET 52 H MET 52 10.275 -16.345 -3.971 1117 HA MET 52 HA MET 52 12.433 -18.350 -3.845 1118 HB2 MET 52 HB2 MET 52 10.270 -17.826 -1.800 1119 HB3 MET 52 HB3 MET 52 11.374 -19.193 -1.751 1120 HG2 MET 52 HG2 MET 52 13.262 -17.621 -1.589 1121 HG3 MET 52 HG3 MET 52 12.110 -16.284 -1.558 1122 HE1 MET 52 HE1 MET 52 13.446 -15.548 0.758 1123 HE2 MET 52 HE2 MET 52 14.432 -17.002 0.617 1124 HE3 MET 52 HE3 MET 52 13.604 -16.642 2.132 1125 H LEU 53 H LEU 53 9.909 -17.683 -5.561 1126 HA LEU 53 HA LEU 53 8.239 -18.735 -6.661 1127 HB2 LEU 53 HB2 LEU 53 10.281 -20.915 -6.344 1128 HB3 LEU 53 HB3 LEU 53 8.813 -21.145 -7.276 1129 HG LEU 53 HG LEU 53 9.698 -18.879 -8.415 1130 HD11 LEU 53 HD11 LEU 53 12.117 -19.025 -8.741 1131 HD12 LEU 53 HD12 LEU 53 12.189 -20.345 -7.575 1132 HD13 LEU 53 HD13 LEU 53 11.699 -18.735 -7.052 1133 HD21 LEU 53 HD21 LEU 53 10.521 -20.239 -10.225 1134 HD22 LEU 53 HD22 LEU 53 9.079 -20.983 -9.536 1135 HD23 LEU 53 HD23 LEU 53 10.675 -21.629 -9.154 1136 H ASP 54 H ASP 54 7.416 -18.475 -4.099 1137 HA ASP 54 HA ASP 54 6.206 -21.087 -3.515 1138 HB2 ASP 54 HB2 ASP 54 6.962 -18.854 -1.629 1139 HB3 ASP 54 HB3 ASP 54 5.788 -20.088 -1.173 1140 H VAL 55 H VAL 55 4.854 -18.301 -1.927 1141 HA VAL 55 HA VAL 55 2.915 -17.740 -3.920 1142 HB VAL 55 HB VAL 55 1.225 -18.516 -1.741 1143 HG11 VAL 55 HG11 VAL 55 1.426 -19.493 -4.586 1144 HG12 VAL 55 HG12 VAL 55 0.493 -18.109 -4.017 1145 HG13 VAL 55 HG13 VAL 55 0.053 -19.739 -3.509 1146 HG21 VAL 55 HG21 VAL 55 2.817 -20.810 -2.887 1147 HG22 VAL 55 HG22 VAL 55 1.404 -20.943 -1.839 1148 HG23 VAL 55 HG23 VAL 55 2.896 -20.237 -1.222 1149 HA PRO 56 HA PRO 56 1.741 -14.978 -0.176 1150 HB2 PRO 56 HB2 PRO 56 3.017 -15.352 2.204 1151 HB3 PRO 56 HB3 PRO 56 1.469 -16.106 1.804 1152 HG2 PRO 56 HG2 PRO 56 4.228 -17.254 1.658 1153 HG3 PRO 56 HG3 PRO 56 2.742 -17.993 2.284 1154 HD2 PRO 56 HD2 PRO 56 3.689 -18.585 -0.147 1155 HD3 PRO 56 HD3 PRO 56 1.948 -18.481 0.166 1156 H LYS 57 H LYS 57 4.995 -16.154 -0.465 1157 HA LYS 57 HA LYS 57 6.353 -13.836 0.386 1158 HB2 LYS 57 HB2 LYS 57 7.270 -16.052 -1.452 1159 HB3 LYS 57 HB3 LYS 57 8.319 -14.852 -0.704 1160 HG2 LYS 57 HG2 LYS 57 7.772 -15.671 1.494 1161 HG3 LYS 57 HG3 LYS 57 6.598 -16.799 0.814 1162 HD2 LYS 57 HD2 LYS 57 8.431 -17.927 -0.395 1163 HD3 LYS 57 HD3 LYS 57 9.582 -16.829 0.370 1164 HE2 LYS 57 HE2 LYS 57 9.037 -17.676 2.546 1165 HE3 LYS 57 HE3 LYS 57 7.719 -18.646 1.891 1166 HZ1 LYS 57 HZ1 LYS 57 9.388 -19.908 0.612 1167 HZ2 LYS 57 HZ2 LYS 57 9.601 -20.036 2.291 1168 HZ3 LYS 57 HZ3 LYS 57 10.617 -19.030 1.390 1169 H LEU 58 H LEU 58 4.495 -14.388 -2.351 1170 HA LEU 58 HA LEU 58 5.936 -12.444 -3.984 1171 HB2 LEU 58 HB2 LEU 58 5.113 -14.523 -5.055 1172 HB3 LEU 58 HB3 LEU 58 3.478 -14.111 -4.597 1173 HG LEU 58 HG LEU 58 4.219 -13.729 -7.045 1174 HD11 LEU 58 HD11 LEU 58 2.840 -11.541 -5.514 1175 HD12 LEU 58 HD12 LEU 58 2.090 -12.982 -6.201 1176 HD13 LEU 58 HD13 LEU 58 2.787 -11.760 -7.263 1177 HD21 LEU 58 HD21 LEU 58 6.318 -12.519 -6.399 1178 HD22 LEU 58 HD22 LEU 58 5.298 -11.167 -5.896 1179 HD23 LEU 58 HD23 LEU 58 5.305 -11.686 -7.579 1180 H ALA 59 H ALA 59 2.807 -13.001 -2.468 1181 HA ALA 59 HA ALA 59 1.614 -10.563 -3.229 1182 HB1 ALA 59 HB1 ALA 59 0.984 -12.479 -0.999 1183 HB2 ALA 59 HB2 ALA 59 0.240 -12.400 -2.596 1184 HB3 ALA 59 HB3 ALA 59 -0.024 -11.098 -1.433 1185 H VAL 60 H VAL 60 3.541 -11.484 -0.409 1186 HA VAL 60 HA VAL 60 3.025 -9.007 0.951 1187 HB VAL 60 HB VAL 60 3.676 -11.165 2.103 1188 HG11 VAL 60 HG11 VAL 60 6.471 -10.387 1.302 1189 HG12 VAL 60 HG12 VAL 60 5.551 -11.695 0.559 1190 HG13 VAL 60 HG13 VAL 60 5.978 -11.779 2.267 1191 HG21 VAL 60 HG21 VAL 60 3.651 -9.067 3.305 1192 HG22 VAL 60 HG22 VAL 60 5.272 -8.681 2.722 1193 HG23 VAL 60 HG23 VAL 60 5.031 -10.035 3.827 1194 H LEU 61 H LEU 61 5.161 -10.096 -1.480 1195 HA LEU 61 HA LEU 61 7.267 -8.224 -1.149 1196 HB2 LEU 61 HB2 LEU 61 7.414 -10.336 -2.462 1197 HB3 LEU 61 HB3 LEU 61 6.345 -9.634 -3.658 1198 HG LEU 61 HG LEU 61 8.114 -7.809 -3.947 1199 HD11 LEU 61 HD11 LEU 61 9.743 -9.857 -2.448 1200 HD12 LEU 61 HD12 LEU 61 9.395 -8.204 -1.938 1201 HD13 LEU 61 HD13 LEU 61 10.404 -8.496 -3.354 1202 HD21 LEU 61 HD21 LEU 61 9.459 -9.235 -5.441 1203 HD22 LEU 61 HD22 LEU 61 7.727 -9.519 -5.610 1204 HD23 LEU 61 HD23 LEU 61 8.724 -10.661 -4.709 1205 H THR 62 H THR 62 4.230 -8.250 -2.924 1206 HA THR 62 HA THR 62 4.702 -5.703 -4.168 1207 HB THR 62 HB THR 62 2.086 -6.026 -4.548 1208 HG1 THR 62 HG1 THR 62 1.705 -8.360 -4.631 1209 HG21 THR 62 HG21 THR 62 3.983 -7.882 -5.968 1210 HG22 THR 62 HG22 THR 62 4.013 -6.138 -6.218 1211 HG23 THR 62 HG23 THR 62 2.564 -7.056 -6.614 1212 H ALA 63 H ALA 63 2.808 -6.949 -1.468 1213 HA ALA 63 HA ALA 63 1.310 -4.735 -0.797 1214 HB1 ALA 63 HB1 ALA 63 1.195 -5.629 1.443 1215 HB2 ALA 63 HB2 ALA 63 2.613 -6.637 1.140 1216 HB3 ALA 63 HB3 ALA 63 1.107 -6.940 0.268 1217 H VAL 64 H VAL 64 4.643 -5.462 0.149 1218 HA VAL 64 HA VAL 64 4.887 -3.110 1.744 1219 HB VAL 64 HB VAL 64 6.219 -5.152 2.178 1220 HG11 VAL 64 HG11 VAL 64 7.584 -4.393 -0.390 1221 HG12 VAL 64 HG12 VAL 64 6.826 -5.927 0.031 1222 HG13 VAL 64 HG13 VAL 64 8.321 -5.441 0.823 1223 HG21 VAL 64 HG21 VAL 64 8.370 -3.972 2.611 1224 HG22 VAL 64 HG22 VAL 64 6.943 -3.117 3.188 1225 HG23 VAL 64 HG23 VAL 64 7.741 -2.596 1.705 1226 H GLN 65 H GLN 65 5.657 -3.903 -1.607 1227 HA GLN 65 HA GLN 65 7.189 -1.548 -2.070 1228 HB2 GLN 65 HB2 GLN 65 7.068 -3.753 -3.475 1229 HB3 GLN 65 HB3 GLN 65 5.719 -2.951 -4.273 1230 HG2 GLN 65 HG2 GLN 65 7.827 -1.070 -4.143 1231 HG3 GLN 65 HG3 GLN 65 8.524 -2.587 -4.708 1232 HE21 GLN 65 HE21 GLN 65 8.898 -1.654 -6.725 1233 HE22 GLN 65 HE22 GLN 65 7.624 -1.415 -7.869 1234 H ILE 66 H ILE 66 3.786 -2.365 -2.361 1235 HA ILE 66 HA ILE 66 2.929 -0.073 -3.753 1236 HB ILE 66 HB ILE 66 1.465 -1.824 -1.767 1237 HG12 ILE 66 HG12 ILE 66 1.051 -1.658 -4.744 1238 HG13 ILE 66 HG13 ILE 66 2.278 -2.709 -4.046 1239 HG21 ILE 66 HG21 ILE 66 -0.598 -0.806 -2.478 1240 HG22 ILE 66 HG22 ILE 66 0.267 0.246 -3.598 1241 HG23 ILE 66 HG23 ILE 66 0.481 0.444 -1.858 1242 HD11 ILE 66 HD11 ILE 66 0.282 -3.960 -4.499 1243 HD12 ILE 66 HD12 ILE 66 -0.686 -2.834 -3.552 1244 HD13 ILE 66 HD13 ILE 66 0.517 -3.848 -2.757 1245 H ALA 67 H ALA 67 3.466 -0.726 -0.343 1246 HA ALA 67 HA ALA 67 2.394 1.646 0.700 1247 HB1 ALA 67 HB1 ALA 67 3.840 1.160 2.672 1248 HB2 ALA 67 HB2 ALA 67 4.565 -0.159 1.751 1249 HB3 ALA 67 HB3 ALA 67 2.850 -0.202 2.150 1250 H SER 68 H SER 68 5.745 0.828 -0.231 1251 HA SER 68 HA SER 68 6.890 3.296 0.419 1252 HB2 SER 68 HB2 SER 68 8.430 2.430 -1.671 1253 HB3 SER 68 HB3 SER 68 8.604 1.886 -0.001 1254 HG SER 68 HG SER 68 6.997 0.642 -1.990 1255 H GLU 69 H GLU 69 5.060 2.290 -2.376 1256 HA GLU 69 HA GLU 69 5.808 4.406 -4.107 1257 HB2 GLU 69 HB2 GLU 69 3.591 2.411 -4.018 1258 HB3 GLU 69 HB3 GLU 69 3.407 3.805 -5.077 1259 HG2 GLU 69 HG2 GLU 69 5.892 2.147 -5.174 1260 HG3 GLU 69 HG3 GLU 69 4.427 1.625 -6.008 1261 H TYR 70 H TYR 70 3.637 4.200 -1.429 1262 HA TYR 70 HA TYR 70 2.433 6.781 -2.124 1263 HB2 TYR 70 HB2 TYR 70 1.553 4.461 -0.523 1264 HB3 TYR 70 HB3 TYR 70 1.073 6.048 0.080 1265 HD1 TYR 70 HD1 TYR 70 0.859 3.751 -2.811 1266 HD2 TYR 70 HD2 TYR 70 -0.598 7.334 -1.030 1267 HE1 TYR 70 HE1 TYR 70 -0.961 3.829 -4.462 1268 HE2 TYR 70 HE2 TYR 70 -2.422 7.412 -2.672 1269 HH TYR 70 HH TYR 70 -3.196 4.801 -4.694 1270 H LEU 71 H LEU 71 4.695 5.357 0.064 1271 HA LEU 71 HA LEU 71 4.507 7.250 2.154 1272 HB2 LEU 71 HB2 LEU 71 6.423 5.174 1.346 1273 HB3 LEU 71 HB3 LEU 71 7.158 6.523 2.170 1274 HG LEU 71 HG LEU 71 6.670 4.732 3.736 1275 HD11 LEU 71 HD11 LEU 71 6.301 7.245 4.311 1276 HD12 LEU 71 HD12 LEU 71 5.803 5.990 5.444 1277 HD13 LEU 71 HD13 LEU 71 4.605 6.771 4.418 1278 HD21 LEU 71 HD21 LEU 71 3.780 5.058 2.945 1279 HD22 LEU 71 HD22 LEU 71 4.395 4.032 4.241 1280 HD23 LEU 71 HD23 LEU 71 4.810 3.678 2.564 1281 H LYS 72 H LYS 72 6.497 7.138 -0.769 1282 HA LYS 72 HA LYS 72 7.838 9.582 -0.272 1283 HB2 LYS 72 HB2 LYS 72 8.189 9.519 -2.839 1284 HB3 LYS 72 HB3 LYS 72 8.933 8.270 -1.851 1285 HG2 LYS 72 HG2 LYS 72 7.451 6.638 -2.572 1286 HG3 LYS 72 HG3 LYS 72 6.256 7.822 -3.110 1287 HD2 LYS 72 HD2 LYS 72 7.535 8.371 -5.022 1288 HD3 LYS 72 HD3 LYS 72 8.965 7.540 -4.393 1289 HE2 LYS 72 HE2 LYS 72 7.942 5.408 -4.676 1290 HE3 LYS 72 HE3 LYS 72 6.376 6.136 -5.028 1291 HZ1 LYS 72 HZ1 LYS 72 8.800 6.311 -6.733 1292 HZ2 LYS 72 HZ2 LYS 72 7.311 7.036 -7.071 1293 HZ3 LYS 72 HZ3 LYS 72 7.439 5.347 -7.027 1294 H LEU 73 H LEU 73 4.687 8.846 -1.403 1295 HA LEU 73 HA LEU 73 4.222 11.302 -2.797 1296 HB2 LEU 73 HB2 LEU 73 2.931 9.274 -3.294 1297 HB3 LEU 73 HB3 LEU 73 2.273 9.287 -1.669 1298 HG LEU 73 HG LEU 73 1.267 11.553 -2.234 1299 HD11 LEU 73 HD11 LEU 73 1.976 10.671 -5.027 1300 HD12 LEU 73 HD12 LEU 73 2.625 12.075 -4.177 1301 HD13 LEU 73 HD13 LEU 73 0.917 12.017 -4.609 1302 HD21 LEU 73 HD21 LEU 73 0.365 9.095 -3.721 1303 HD22 LEU 73 HD22 LEU 73 -0.612 10.541 -3.472 1304 HD23 LEU 73 HD23 LEU 73 -0.097 9.575 -2.088 1305 H LYS 74 H LYS 74 3.345 10.045 0.422 1306 HA LYS 74 HA LYS 74 2.089 12.464 1.247 1307 HB2 LYS 74 HB2 LYS 74 2.235 11.507 3.542 1308 HB3 LYS 74 HB3 LYS 74 1.497 10.418 2.377 1309 HG2 LYS 74 HG2 LYS 74 2.993 8.851 2.795 1310 HG3 LYS 74 HG3 LYS 74 4.330 9.966 2.511 1311 HD2 LYS 74 HD2 LYS 74 4.565 9.187 4.738 1312 HD3 LYS 74 HD3 LYS 74 3.946 10.835 4.849 1313 HE2 LYS 74 HE2 LYS 74 1.717 10.022 5.267 1314 HE3 LYS 74 HE3 LYS 74 2.230 8.359 4.984 1315 HZ1 LYS 74 HZ1 LYS 74 2.070 8.777 7.323 1316 HZ2 LYS 74 HZ2 LYS 74 3.097 10.112 7.214 1317 HZ3 LYS 74 HZ3 LYS 74 3.696 8.559 6.922 1318 H GLU 75 H GLU 75 5.347 11.401 1.046 1319 HA GLU 75 HA GLU 75 6.468 13.200 2.943 1320 HB2 GLU 75 HB2 GLU 75 7.549 11.099 1.944 1321 HB3 GLU 75 HB3 GLU 75 7.897 12.085 0.530 1322 HG2 GLU 75 HG2 GLU 75 9.846 12.067 1.865 1323 HG3 GLU 75 HG3 GLU 75 9.118 13.663 2.039 1324 H GLU 76 H GLU 76 5.871 13.314 -0.544 1325 HA GLU 76 HA GLU 76 7.087 15.884 -0.867 1326 HB2 GLU 76 HB2 GLU 76 6.579 15.720 -3.109 1327 HB3 GLU 76 HB3 GLU 76 6.664 14.028 -2.650 1328 HG2 GLU 76 HG2 GLU 76 4.264 13.867 -2.602 1329 HG3 GLU 76 HG3 GLU 76 4.099 15.602 -2.880 1330 H TYR 77 H TYR 77 4.029 14.746 0.136 1331 HA TYR 77 HA TYR 77 2.354 16.873 -0.528 1332 HB2 TYR 77 HB2 TYR 77 1.423 14.821 0.308 1333 HB3 TYR 77 HB3 TYR 77 2.319 14.961 1.814 1334 HD1 TYR 77 HD1 TYR 77 0.373 17.647 0.128 1335 HD2 TYR 77 HD2 TYR 77 0.572 14.918 3.382 1336 HE1 TYR 77 HE1 TYR 77 -1.569 18.748 1.159 1337 HE2 TYR 77 HE2 TYR 77 -1.376 16.006 4.421 1338 HH TYR 77 HH TYR 77 -3.482 17.808 2.976 1339 H GLN 78 H GLN 78 4.341 16.365 2.374 1340 HA GLN 78 HA GLN 78 3.625 18.876 3.545 1341 HB2 GLN 78 HB2 GLN 78 5.283 18.364 5.230 1342 HB3 GLN 78 HB3 GLN 78 4.369 16.904 4.873 1343 HG2 GLN 78 HG2 GLN 78 6.169 16.028 3.554 1344 HG3 GLN 78 HG3 GLN 78 7.063 17.539 3.696 1345 HE21 GLN 78 HE21 GLN 78 6.086 14.630 5.282 1346 HE22 GLN 78 HE22 GLN 78 7.139 14.771 6.646 1347 H ARG 79 H ARG 79 6.091 17.753 1.380 1348 HA ARG 79 HA ARG 79 8.028 19.725 1.702 1349 HB2 ARG 79 HB2 ARG 79 7.245 17.980 -0.604 1350 HB3 ARG 79 HB3 ARG 79 8.512 19.183 -0.784 1351 HG2 ARG 79 HG2 ARG 79 8.497 16.949 1.230 1352 HG3 ARG 79 HG3 ARG 79 9.415 16.979 -0.275 1353 HD2 ARG 79 HD2 ARG 79 10.409 19.164 0.605 1354 HD3 ARG 79 HD3 ARG 79 9.761 18.680 2.168 1355 HE ARG 79 HE ARG 79 11.335 16.989 2.289 1356 HH11 ARG 79 HH11 ARG 79 11.446 18.529 -0.854 1357 HH12 ARG 79 HH12 ARG 79 13.011 17.896 -1.249 1358 HH21 ARG 79 HH21 ARG 79 13.404 16.149 1.766 1359 HH22 ARG 79 HH22 ARG 79 14.121 16.536 0.231 1360 H LEU 80 H LEU 80 5.407 19.650 -0.742 1361 HA LEU 80 HA LEU 80 6.039 22.222 -1.737 1362 HB2 LEU 80 HB2 LEU 80 4.076 22.093 -3.042 1363 HB3 LEU 80 HB3 LEU 80 4.730 20.470 -2.957 1364 HG LEU 80 HG LEU 80 2.825 20.834 -0.832 1365 HD11 LEU 80 HD11 LEU 80 0.795 21.127 -2.155 1366 HD12 LEU 80 HD12 LEU 80 1.765 21.423 -3.597 1367 HD13 LEU 80 HD13 LEU 80 1.824 22.557 -2.245 1368 HD21 LEU 80 HD21 LEU 80 2.758 19.106 -3.299 1369 HD22 LEU 80 HD22 LEU 80 1.784 18.894 -1.844 1370 HD23 LEU 80 HD23 LEU 80 3.532 18.690 -1.770 1371 H ARG 81 H ARG 81 4.093 21.148 0.933 1372 HA ARG 81 HA ARG 81 2.604 23.553 1.253 1373 HB2 ARG 81 HB2 ARG 81 3.138 21.195 3.035 1374 HB3 ARG 81 HB3 ARG 81 2.253 22.599 3.617 1375 HG2 ARG 81 HG2 ARG 81 0.602 22.285 1.825 1376 HG3 ARG 81 HG3 ARG 81 1.489 20.862 1.280 1377 HD2 ARG 81 HD2 ARG 81 -0.539 20.470 2.767 1378 HD3 ARG 81 HD3 ARG 81 0.950 19.643 3.210 1379 HE ARG 81 HE ARG 81 1.205 21.698 4.775 1380 HH11 ARG 81 HH11 ARG 81 -1.777 19.993 4.042 1381 HH12 ARG 81 HH12 ARG 81 -2.544 20.456 5.524 1382 HH21 ARG 81 HH21 ARG 81 0.175 22.306 6.718 1383 HH22 ARG 81 HH22 ARG 81 -1.437 21.756 7.045 1384 H GLU 82 H GLU 82 5.530 22.272 2.833 1385 HA GLU 82 HA GLU 82 5.844 24.605 4.460 1386 HB2 GLU 82 HB2 GLU 82 8.019 23.658 5.082 1387 HB3 GLU 82 HB3 GLU 82 6.736 22.465 5.206 1388 HG2 GLU 82 HG2 GLU 82 7.811 21.096 3.848 1389 HG3 GLU 82 HG3 GLU 82 7.919 22.337 2.604 1390 H GLN 83 H GLN 83 6.830 23.670 1.282 1391 HA GLN 83 HA GLN 83 8.947 25.517 0.914 1392 HB2 GLN 83 HB2 GLN 83 8.600 23.566 -0.541 1393 HB3 GLN 83 HB3 GLN 83 7.086 24.253 -1.111 1394 HG2 GLN 83 HG2 GLN 83 8.370 26.169 -2.021 1395 HG3 GLN 83 HG3 GLN 83 9.854 25.329 -1.570 1396 HE21 GLN 83 HE21 GLN 83 10.518 25.226 -3.717 1397 HE22 GLN 83 HE22 GLN 83 9.803 24.133 -4.848 1398 H LEU 84 H LEU 84 5.477 25.664 0.558 1399 HA LEU 84 HA LEU 84 5.313 28.141 -0.783 1400 HB2 LEU 84 HB2 LEU 84 3.455 26.553 -0.681 1401 HB3 LEU 84 HB3 LEU 84 3.350 26.768 1.057 1402 HG LEU 84 HG LEU 84 2.750 29.170 0.669 1403 HD11 LEU 84 HD11 LEU 84 1.991 29.848 -1.547 1404 HD12 LEU 84 HD12 LEU 84 2.541 28.312 -2.213 1405 HD13 LEU 84 HD13 LEU 84 3.709 29.455 -1.546 1406 HD21 LEU 84 HD21 LEU 84 0.990 27.588 1.142 1407 HD22 LEU 84 HD22 LEU 84 0.932 27.096 -0.554 1408 HD23 LEU 84 HD23 LEU 84 0.445 28.728 -0.089 1409 H LYS 85 H LYS 85 5.926 27.245 2.473 1410 HA LYS 85 HA LYS 85 5.398 29.915 3.524 1411 HB2 LYS 85 HB2 LYS 85 6.322 27.369 4.862 1412 HB3 LYS 85 HB3 LYS 85 6.040 28.885 5.700 1413 HG2 LYS 85 HG2 LYS 85 3.695 28.810 5.132 1414 HG3 LYS 85 HG3 LYS 85 3.949 27.353 4.172 1415 HD2 LYS 85 HD2 LYS 85 3.069 26.641 6.253 1416 HD3 LYS 85 HD3 LYS 85 4.788 26.249 6.284 1417 HE2 LYS 85 HE2 LYS 85 4.009 27.225 8.408 1418 HE3 LYS 85 HE3 LYS 85 5.237 28.218 7.633 1419 HZ1 LYS 85 HZ1 LYS 85 3.489 29.605 8.460 1420 HZ2 LYS 85 HZ2 LYS 85 2.311 28.712 7.642 1421 HZ3 LYS 85 HZ3 LYS 85 3.433 29.635 6.771 1422 H LYS 86 H LYS 86 7.733 28.885 1.701 1423 HA LYS 86 HA LYS 86 9.759 30.472 3.070 1424 HB2 LYS 86 HB2 LYS 86 10.047 27.968 3.554 1425 HB3 LYS 86 HB3 LYS 86 10.467 27.805 1.857 1426 HG2 LYS 86 HG2 LYS 86 12.423 29.087 2.107 1427 HG3 LYS 86 HG3 LYS 86 11.913 29.700 3.682 1428 HD2 LYS 86 HD2 LYS 86 12.283 26.761 3.272 1429 HD3 LYS 86 HD3 LYS 86 13.688 27.797 3.538 1430 HE2 LYS 86 HE2 LYS 86 13.002 28.391 5.675 1431 HE3 LYS 86 HE3 LYS 86 11.324 27.950 5.364 1432 HZ1 LYS 86 HZ1 LYS 86 13.479 25.925 5.409 1433 HZ2 LYS 86 HZ2 LYS 86 11.811 25.688 5.562 1434 HZ3 LYS 86 HZ3 LYS 86 12.682 26.405 6.820 Start of MODEL 14 1 H1 GLY 1 H1 GLY 1 35.726 -3.279 -18.005 2 H2 GLY 1 H2 GLY 1 36.855 -2.164 -18.577 3 H3 GLY 1 H3 GLY 1 36.337 -3.426 -19.574 4 HA2 GLY 1 HA3 GLY 1 35.278 -1.387 -20.244 5 HA3 GLY 1 HA2 GLY 1 34.101 -2.528 -19.607 6 H SER 2 H SER 2 35.969 0.362 -18.867 7 HA SER 2 HA SER 2 34.156 0.927 -16.627 8 HB2 SER 2 HB2 SER 2 36.590 2.578 -17.182 9 HB3 SER 2 HB3 SER 2 35.844 2.161 -15.638 10 HG SER 2 HG SER 2 37.824 0.901 -16.998 11 H HIS 3 H HIS 3 32.443 2.082 -17.267 12 HA HIS 3 HA HIS 3 32.917 4.313 -19.132 13 HB2 HIS 3 HB2 HIS 3 30.618 2.389 -18.954 14 HB3 HIS 3 HB3 HIS 3 30.349 4.015 -19.574 15 HD1 HIS 3 HD1 HIS 3 30.850 4.370 -21.997 16 HD2 HIS 3 HD2 HIS 3 32.630 0.919 -20.513 17 HE1 HIS 3 HE1 HIS 3 31.868 3.230 -23.984 18 HE2 HIS 3 HE2 HIS 3 33.120 1.266 -23.030 19 H MET 4 H MET 4 31.022 5.989 -18.889 20 HA MET 4 HA MET 4 31.186 6.960 -16.199 21 HB2 MET 4 HB2 MET 4 29.599 7.987 -18.559 22 HB3 MET 4 HB3 MET 4 29.835 8.847 -17.045 23 HG2 MET 4 HG2 MET 4 32.062 9.269 -17.481 24 HG3 MET 4 HG3 MET 4 32.190 7.943 -18.633 25 HE1 MET 4 HE1 MET 4 33.278 9.120 -20.647 26 HE2 MET 4 HE2 MET 4 33.590 10.401 -19.475 27 HE3 MET 4 HE3 MET 4 32.941 10.799 -21.063 28 H THR 5 H THR 5 30.122 5.449 -14.912 29 HA THR 5 HA THR 5 27.419 4.642 -15.424 30 HB THR 5 HB THR 5 27.765 3.878 -12.891 31 HG1 THR 5 HG1 THR 5 29.717 4.480 -12.272 32 HG21 THR 5 HG21 THR 5 28.811 1.814 -13.757 33 HG22 THR 5 HG22 THR 5 29.125 2.641 -15.281 34 HG23 THR 5 HG23 THR 5 27.464 2.357 -14.758 35 H GLU 6 H GLU 6 25.652 4.999 -13.953 36 HA GLU 6 HA GLU 6 25.755 7.632 -12.637 37 HB2 GLU 6 HB2 GLU 6 23.760 6.377 -14.432 38 HB3 GLU 6 HB3 GLU 6 23.113 7.268 -13.062 39 HG2 GLU 6 HG2 GLU 6 25.036 8.373 -15.094 40 HG3 GLU 6 HG3 GLU 6 23.290 8.625 -15.101 41 H GLN 7 H GLN 7 23.745 7.746 -11.040 42 HA GLN 7 HA GLN 7 23.799 5.273 -9.438 43 HB2 GLN 7 HB2 GLN 7 23.387 8.044 -8.314 44 HB3 GLN 7 HB3 GLN 7 23.703 6.559 -7.432 45 HG2 GLN 7 HG2 GLN 7 25.623 8.070 -9.179 46 HG3 GLN 7 HG3 GLN 7 25.667 7.926 -7.427 47 HE21 GLN 7 HE21 GLN 7 27.663 7.239 -9.441 48 HE22 GLN 7 HE22 GLN 7 28.032 5.567 -9.201 49 HA PRO 8 HA PRO 8 19.403 6.042 -10.532 50 HB2 PRO 8 HB2 PRO 8 18.790 3.541 -11.287 51 HB3 PRO 8 HB3 PRO 8 19.662 4.638 -12.361 52 HG2 PRO 8 HG2 PRO 8 20.711 2.411 -10.669 53 HG3 PRO 8 HG3 PRO 8 21.155 2.864 -12.323 54 HD2 PRO 8 HD2 PRO 8 22.596 3.546 -10.077 55 HD3 PRO 8 HD3 PRO 8 22.652 4.431 -11.612 56 H LYS 9 H LYS 9 17.448 4.451 -9.826 57 HA LYS 9 HA LYS 9 17.306 4.512 -7.063 58 HB2 LYS 9 HB2 LYS 9 15.773 2.733 -8.970 59 HB3 LYS 9 HB3 LYS 9 15.323 3.055 -7.301 60 HG2 LYS 9 HG2 LYS 9 14.317 4.956 -7.848 61 HG3 LYS 9 HG3 LYS 9 15.719 5.509 -8.764 62 HD2 LYS 9 HD2 LYS 9 13.920 5.397 -10.299 63 HD3 LYS 9 HD3 LYS 9 14.939 3.999 -10.634 64 HE2 LYS 9 HE2 LYS 9 13.432 2.551 -9.443 65 HE3 LYS 9 HE3 LYS 9 12.462 3.927 -8.917 66 HZ1 LYS 9 HZ1 LYS 9 11.831 4.342 -11.188 67 HZ2 LYS 9 HZ2 LYS 9 11.475 2.733 -10.798 68 HZ3 LYS 9 HZ3 LYS 9 12.829 3.094 -11.742 69 H THR 10 H THR 10 18.079 3.250 -5.489 70 HA THR 10 HA THR 10 19.535 0.848 -6.244 71 HB THR 10 HB THR 10 20.495 2.696 -4.737 72 HG1 THR 10 HG1 THR 10 21.854 1.184 -4.180 73 HG21 THR 10 HG21 THR 10 20.017 2.525 -2.356 74 HG22 THR 10 HG22 THR 10 18.820 1.269 -2.669 75 HG23 THR 10 HG23 THR 10 18.544 2.910 -3.249 76 H ARG 11 H ARG 11 19.408 -0.975 -4.557 77 HA ARG 11 HA ARG 11 16.578 -1.439 -3.893 78 HB2 ARG 11 HB2 ARG 11 18.678 -3.402 -4.829 79 HB3 ARG 11 HB3 ARG 11 17.105 -3.877 -4.203 80 HG2 ARG 11 HG2 ARG 11 16.015 -2.666 -6.028 81 HG3 ARG 11 HG3 ARG 11 17.595 -2.200 -6.655 82 HD2 ARG 11 HD2 ARG 11 16.719 -5.057 -6.283 83 HD3 ARG 11 HD3 ARG 11 16.530 -4.168 -7.794 84 HE ARG 11 HE ARG 11 19.138 -3.858 -7.366 85 HH11 ARG 11 HH11 ARG 11 17.144 -6.730 -7.111 86 HH12 ARG 11 HH12 ARG 11 18.429 -7.810 -7.546 87 HH21 ARG 11 HH21 ARG 11 20.828 -5.282 -7.935 88 HH22 ARG 11 HH22 ARG 11 20.525 -6.989 -8.019 89 H VAL 12 H VAL 12 16.127 -2.478 -1.932 90 HA VAL 12 HA VAL 12 18.414 -2.725 -0.091 91 HB VAL 12 HB VAL 12 17.126 -0.616 0.291 92 HG11 VAL 12 HG11 VAL 12 14.905 -1.204 -0.248 93 HG12 VAL 12 HG12 VAL 12 14.923 -0.889 1.490 94 HG13 VAL 12 HG13 VAL 12 14.904 -2.550 0.893 95 HG21 VAL 12 HG21 VAL 12 16.947 -0.875 2.716 96 HG22 VAL 12 HG22 VAL 12 18.417 -1.618 2.084 97 HG23 VAL 12 HG23 VAL 12 17.043 -2.625 2.533 98 H SER 13 H SER 13 18.297 -4.318 1.453 99 HA SER 13 HA SER 13 16.317 -6.396 0.938 100 HB2 SER 13 HB2 SER 13 18.132 -7.492 2.680 101 HB3 SER 13 HB3 SER 13 18.247 -7.586 0.921 102 HG SER 13 HG SER 13 19.806 -6.218 2.703 103 H VAL 14 H VAL 14 14.640 -6.592 2.296 104 HA VAL 14 HA VAL 14 15.010 -5.753 5.100 105 HB VAL 14 HB VAL 14 12.585 -5.090 5.109 106 HG11 VAL 14 HG11 VAL 14 14.288 -3.382 5.076 107 HG12 VAL 14 HG12 VAL 14 12.972 -2.897 4.008 108 HG13 VAL 14 HG13 VAL 14 14.462 -3.544 3.331 109 HG21 VAL 14 HG21 VAL 14 12.855 -5.085 2.111 110 HG22 VAL 14 HG22 VAL 14 11.431 -4.661 3.060 111 HG23 VAL 14 HG23 VAL 14 12.001 -6.330 3.023 112 H ARG 15 H ARG 15 13.329 -6.744 6.563 113 HA ARG 15 HA ARG 15 12.695 -9.466 5.649 114 HB2 ARG 15 HB2 ARG 15 14.534 -9.507 7.244 115 HB3 ARG 15 HB3 ARG 15 13.587 -8.573 8.392 116 HG2 ARG 15 HG2 ARG 15 12.116 -10.374 8.799 117 HG3 ARG 15 HG3 ARG 15 12.718 -11.276 7.407 118 HD2 ARG 15 HD2 ARG 15 13.538 -12.075 9.647 119 HD3 ARG 15 HD3 ARG 15 14.791 -11.708 8.464 120 HE ARG 15 HE ARG 15 14.036 -9.839 10.624 121 HH11 ARG 15 HH11 ARG 15 16.462 -11.520 8.733 122 HH12 ARG 15 HH12 ARG 15 17.791 -10.672 9.453 123 HH21 ARG 15 HH21 ARG 15 15.786 -8.736 11.585 124 HH22 ARG 15 HH22 ARG 15 17.407 -9.102 11.091 125 H ILE 16 H ILE 16 10.598 -9.959 5.665 126 HA ILE 16 HA ILE 16 8.822 -8.606 7.581 127 HB ILE 16 HB ILE 16 7.907 -9.089 4.756 128 HG12 ILE 16 HG12 ILE 16 8.890 -6.404 5.688 129 HG13 ILE 16 HG13 ILE 16 9.981 -7.547 4.911 130 HG21 ILE 16 HG21 ILE 16 6.207 -7.495 5.299 131 HG22 ILE 16 HG22 ILE 16 7.002 -7.094 6.821 132 HG23 ILE 16 HG23 ILE 16 6.281 -8.688 6.595 133 HD11 ILE 16 HD11 ILE 16 8.480 -7.577 2.953 134 HD12 ILE 16 HD12 ILE 16 9.162 -5.988 3.291 135 HD13 ILE 16 HD13 ILE 16 7.491 -6.343 3.732 136 H TYR 17 H TYR 17 7.481 -9.963 8.575 137 HA TYR 17 HA TYR 17 6.425 -11.852 9.223 138 HB2 TYR 17 HB2 TYR 17 5.569 -11.428 6.691 139 HB3 TYR 17 HB3 TYR 17 6.257 -13.039 6.520 140 HD1 TYR 17 HD1 TYR 17 4.139 -11.230 9.040 141 HD2 TYR 17 HD2 TYR 17 4.729 -14.761 6.727 142 HE1 TYR 17 HE1 TYR 17 2.093 -12.201 9.999 143 HE2 TYR 17 HE2 TYR 17 2.686 -15.734 7.685 144 HH TYR 17 HH TYR 17 0.409 -13.934 9.409 145 H GLY 18 H GLY 18 9.353 -11.837 8.966 146 HA2 GLY 18 HA2 GLY 18 10.770 -13.536 9.833 147 HA3 GLY 18 HA3 GLY 18 9.696 -14.741 9.145 148 H GLN 19 H GLN 19 9.600 -13.620 6.491 149 HA GLN 19 HA GLN 19 12.175 -14.621 5.588 150 HB2 GLN 19 HB2 GLN 19 9.619 -13.989 4.133 151 HB3 GLN 19 HB3 GLN 19 11.095 -14.463 3.306 152 HG2 GLN 19 HG2 GLN 19 10.384 -16.549 3.520 153 HG3 GLN 19 HG3 GLN 19 10.804 -16.407 5.225 154 HE21 GLN 19 HE21 GLN 19 8.160 -14.715 3.638 155 HE22 GLN 19 HE22 GLN 19 6.892 -15.544 4.480 156 H ASP 20 H ASP 20 13.465 -13.543 4.027 157 HA ASP 20 HA ASP 20 13.347 -10.629 4.304 158 HB2 ASP 20 HB2 ASP 20 15.679 -10.563 3.863 159 HB3 ASP 20 HB3 ASP 20 15.444 -11.915 4.964 160 H TYR 21 H TYR 21 13.482 -9.276 2.514 161 HA TYR 21 HA TYR 21 13.213 -10.523 -0.128 162 HB2 TYR 21 HB2 TYR 21 11.353 -8.344 0.852 163 HB3 TYR 21 HB3 TYR 21 11.289 -9.172 -0.699 164 HD1 TYR 21 HD2 TYR 21 10.822 -11.701 -0.659 165 HD2 TYR 21 HD1 TYR 21 10.123 -9.135 2.661 166 HE1 TYR 21 HE2 TYR 21 9.299 -13.374 0.302 167 HE2 TYR 21 HE1 TYR 21 8.598 -10.807 3.633 168 HH TYR 21 HH TYR 21 7.251 -12.673 2.968 169 H THR 22 H THR 22 13.451 -8.955 -1.889 170 HA THR 22 HA THR 22 15.161 -6.692 -1.114 171 HB THR 22 HB THR 22 15.354 -8.008 -3.805 172 HG1 THR 22 HG1 THR 22 16.425 -8.922 -1.339 173 HG21 THR 22 HG21 THR 22 17.638 -7.179 -3.713 174 HG22 THR 22 HG22 THR 22 17.389 -6.623 -2.057 175 HG23 THR 22 HG23 THR 22 16.506 -5.866 -3.383 176 H ILE 23 H ILE 23 14.168 -4.824 -1.462 177 HA ILE 23 HA ILE 23 12.373 -4.598 -3.788 178 HB ILE 23 HB ILE 23 11.103 -2.872 -2.456 179 HG12 ILE 23 HG12 ILE 23 12.502 -4.177 -0.107 180 HG13 ILE 23 HG13 ILE 23 12.867 -2.563 -0.711 181 HG21 ILE 23 HG21 ILE 23 10.296 -5.162 -2.894 182 HG22 ILE 23 HG22 ILE 23 9.701 -4.503 -1.371 183 HG23 ILE 23 HG23 ILE 23 11.014 -5.681 -1.367 184 HD11 ILE 23 HD11 ILE 23 10.351 -2.115 -0.294 185 HD12 ILE 23 HD12 ILE 23 11.470 -2.142 1.068 186 HD13 ILE 23 HD13 ILE 23 10.454 -3.545 0.736 187 H VAL 24 H VAL 24 11.950 -2.123 -4.190 188 HA VAL 24 HA VAL 24 14.571 -1.012 -4.672 189 HB VAL 24 HB VAL 24 12.775 -1.016 -6.424 190 HG11 VAL 24 HG11 VAL 24 10.835 -0.433 -5.140 191 HG12 VAL 24 HG12 VAL 24 11.107 0.815 -6.356 192 HG13 VAL 24 HG13 VAL 24 11.553 1.111 -4.677 193 HG21 VAL 24 HG21 VAL 24 14.738 0.413 -6.598 194 HG22 VAL 24 HG22 VAL 24 13.902 1.680 -5.697 195 HG23 VAL 24 HG23 VAL 24 13.315 1.195 -7.288 196 H GLY 25 H GLY 25 15.475 0.679 -3.659 197 HA2 GLY 25 HA2 GLY 25 14.025 1.777 -1.358 198 HA3 GLY 25 HA3 GLY 25 15.766 1.829 -1.605 199 H ALA 26 H ALA 26 12.851 2.903 -3.329 200 HA ALA 26 HA ALA 26 14.261 5.251 -4.272 201 HB1 ALA 26 HB1 ALA 26 11.444 4.294 -4.737 202 HB2 ALA 26 HB2 ALA 26 12.815 4.136 -5.836 203 HB3 ALA 26 HB3 ALA 26 12.151 5.729 -5.477 204 H GLU 27 H GLU 27 14.516 5.781 -1.901 205 HA GLU 27 HA GLU 27 13.096 8.091 -1.265 206 HB2 GLU 27 HB2 GLU 27 11.678 5.766 -0.505 207 HB3 GLU 27 HB3 GLU 27 12.382 6.402 0.974 208 HG2 GLU 27 HG2 GLU 27 10.650 7.946 -0.948 209 HG3 GLU 27 HG3 GLU 27 10.112 7.236 0.571 210 H SER 28 H SER 28 13.471 8.235 1.474 211 HA SER 28 HA SER 28 16.310 8.362 1.644 212 HB2 SER 28 HB2 SER 28 14.583 8.491 4.080 213 HB3 SER 28 HB3 SER 28 15.972 9.481 3.643 214 HG SER 28 HG SER 28 13.342 9.606 2.551 215 HA PRO 29 HA PRO 29 17.368 4.218 2.745 216 HB2 PRO 29 HB2 PRO 29 19.413 4.894 4.543 217 HB3 PRO 29 HB3 PRO 29 19.587 4.613 2.812 218 HG2 PRO 29 HG2 PRO 29 19.356 7.178 4.304 219 HG3 PRO 29 HG3 PRO 29 20.278 6.807 2.837 220 HD2 PRO 29 HD2 PRO 29 17.993 8.207 2.743 221 HD3 PRO 29 HD3 PRO 29 18.428 7.057 1.461 222 H ALA 30 H ALA 30 16.868 6.562 5.364 223 HA ALA 30 HA ALA 30 16.505 4.426 7.299 224 HB1 ALA 30 HB1 ALA 30 16.172 6.183 8.929 225 HB2 ALA 30 HB2 ALA 30 16.100 7.396 7.650 226 HB3 ALA 30 HB3 ALA 30 17.606 6.526 7.957 227 H HIS 31 H HIS 31 14.589 6.321 5.191 228 HA HIS 31 HA HIS 31 12.104 6.101 6.609 229 HB2 HIS 31 HB2 HIS 31 12.960 7.686 4.587 230 HB3 HIS 31 HB3 HIS 31 12.068 6.483 3.671 231 HD1 HIS 31 HD1 HIS 31 9.697 6.104 5.697 232 HD2 HIS 31 HD2 HIS 31 11.205 9.758 4.411 233 HE1 HIS 31 HE1 HIS 31 7.838 7.764 6.041 234 HE2 HIS 31 HE2 HIS 31 8.790 9.985 5.316 235 H ILE 32 H ILE 32 13.736 4.297 4.093 236 HA ILE 32 HA ILE 32 11.516 2.583 3.511 237 HB ILE 32 HB ILE 32 13.015 1.333 2.099 238 HG12 ILE 32 HG12 ILE 32 15.244 2.960 3.370 239 HG13 ILE 32 HG13 ILE 32 14.992 1.229 3.536 240 HG21 ILE 32 HG21 ILE 32 13.576 3.040 0.542 241 HG22 ILE 32 HG22 ILE 32 13.710 4.250 1.818 242 HG23 ILE 32 HG23 ILE 32 12.135 3.574 1.405 243 HD11 ILE 32 HD11 ILE 32 16.733 1.461 2.005 244 HD12 ILE 32 HD12 ILE 32 15.923 2.761 1.137 245 HD13 ILE 32 HD13 ILE 32 15.316 1.112 1.019 246 H ARG 33 H ARG 33 13.289 2.752 6.215 247 HA ARG 33 HA ARG 33 13.660 -0.099 6.630 248 HB2 ARG 33 HB2 ARG 33 14.063 2.202 8.551 249 HB3 ARG 33 HB3 ARG 33 14.580 0.539 8.803 250 HG2 ARG 33 HG2 ARG 33 15.554 2.229 6.520 251 HG3 ARG 33 HG3 ARG 33 16.362 2.161 8.087 252 HD2 ARG 33 HD2 ARG 33 15.817 -0.491 7.129 253 HD3 ARG 33 HD3 ARG 33 16.688 0.432 5.905 254 HE ARG 33 HE ARG 33 17.692 -0.480 8.447 255 HH11 ARG 33 HH11 ARG 33 18.080 1.888 5.889 256 HH12 ARG 33 HH12 ARG 33 19.753 2.178 6.242 257 HH21 ARG 33 HH21 ARG 33 19.873 -0.078 8.927 258 HH22 ARG 33 HH22 ARG 33 20.775 1.054 7.968 259 H LEU 34 H LEU 34 11.509 2.486 7.619 260 HA LEU 34 HA LEU 34 10.127 0.858 9.550 261 HB2 LEU 34 HB2 LEU 34 8.737 2.752 9.942 262 HB3 LEU 34 HB3 LEU 34 10.385 3.322 9.775 263 HG LEU 34 HG LEU 34 9.361 3.544 7.207 264 HD11 LEU 34 HD11 LEU 34 7.102 3.180 7.922 265 HD12 LEU 34 HD12 LEU 34 7.303 4.898 7.567 266 HD13 LEU 34 HD13 LEU 34 7.280 4.343 9.237 267 HD21 LEU 34 HD21 LEU 34 10.868 5.088 8.418 268 HD22 LEU 34 HD22 LEU 34 9.486 5.670 9.341 269 HD23 LEU 34 HD23 LEU 34 9.547 5.918 7.598 270 H VAL 35 H VAL 35 9.962 1.283 6.185 271 HA VAL 35 HA VAL 35 7.229 0.931 5.665 272 HB VAL 35 HB VAL 35 9.495 -0.157 3.980 273 HG11 VAL 35 HG11 VAL 35 6.721 0.763 3.231 274 HG12 VAL 35 HG12 VAL 35 7.266 -0.909 3.322 275 HG13 VAL 35 HG13 VAL 35 7.954 0.176 2.118 276 HG21 VAL 35 HG21 VAL 35 8.269 2.589 3.831 277 HG22 VAL 35 HG22 VAL 35 9.593 1.964 2.857 278 HG23 VAL 35 HG23 VAL 35 9.820 2.234 4.586 279 H ALA 36 H ALA 36 9.847 -1.425 5.993 280 HA ALA 36 HA ALA 36 8.369 -3.751 5.508 281 HB1 ALA 36 HB1 ALA 36 10.821 -3.655 5.541 282 HB2 ALA 36 HB2 ALA 36 10.195 -4.946 6.566 283 HB3 ALA 36 HB3 ALA 36 10.782 -3.447 7.292 284 H ALA 37 H ALA 37 9.103 -2.133 8.588 285 HA ALA 37 HA ALA 37 7.828 -4.024 10.245 286 HB1 ALA 37 HB1 ALA 37 8.309 -1.103 10.815 287 HB2 ALA 37 HB2 ALA 37 9.492 -2.388 11.043 288 HB3 ALA 37 HB3 ALA 37 8.011 -2.372 12.000 289 H PHE 38 H PHE 38 6.651 -1.210 8.530 290 HA PHE 38 HA PHE 38 4.179 -0.923 9.838 291 HB2 PHE 38 HB2 PHE 38 4.893 0.880 8.494 292 HB3 PHE 38 HB3 PHE 38 5.181 -0.156 7.103 293 HD1 PHE 38 HD2 PHE 38 2.295 0.665 9.339 294 HD2 PHE 38 HD1 PHE 38 3.738 0.139 5.368 295 HE1 PHE 38 HE2 PHE 38 0.063 1.215 8.457 296 HE2 PHE 38 HE1 PHE 38 1.512 0.685 4.481 297 HZ PHE 38 HZ PHE 38 -0.329 1.227 6.026 298 H VAL 39 H VAL 39 5.098 -2.795 6.970 299 HA VAL 39 HA VAL 39 2.444 -3.789 6.527 300 HB VAL 39 HB VAL 39 5.068 -4.802 5.410 301 HG11 VAL 39 HG11 VAL 39 3.193 -6.395 5.226 302 HG12 VAL 39 HG12 VAL 39 3.725 -5.796 3.656 303 HG13 VAL 39 HG13 VAL 39 2.250 -5.160 4.390 304 HG21 VAL 39 HG21 VAL 39 5.138 -2.917 4.232 305 HG22 VAL 39 HG22 VAL 39 3.616 -2.377 4.937 306 HG23 VAL 39 HG23 VAL 39 3.606 -3.369 3.481 307 H ASP 40 H ASP 40 5.368 -4.978 8.080 308 HA ASP 40 HA ASP 40 4.646 -7.639 8.485 309 HB2 ASP 40 HB2 ASP 40 6.906 -6.645 8.933 310 HB3 ASP 40 HB3 ASP 40 6.246 -5.913 10.391 311 H ASP 41 H ASP 41 4.108 -4.811 10.542 312 HA ASP 41 HA ASP 41 2.813 -6.137 12.646 313 HB2 ASP 41 HB2 ASP 41 3.738 -3.849 12.799 314 HB3 ASP 41 HB3 ASP 41 2.456 -3.271 11.742 315 H LYS 42 H LYS 42 1.499 -4.508 9.780 316 HA LYS 42 HA LYS 42 -1.209 -4.758 10.433 317 HB2 LYS 42 HB2 LYS 42 -0.250 -3.334 8.606 318 HB3 LYS 42 HB3 LYS 42 -0.039 -4.794 7.649 319 HG2 LYS 42 HG2 LYS 42 -2.379 -5.151 7.518 320 HG3 LYS 42 HG3 LYS 42 -2.699 -3.903 8.724 321 HD2 LYS 42 HD2 LYS 42 -1.298 -3.256 6.153 322 HD3 LYS 42 HD3 LYS 42 -3.058 -3.332 6.239 323 HE2 LYS 42 HE2 LYS 42 -1.645 -1.732 8.301 324 HE3 LYS 42 HE3 LYS 42 -1.708 -1.082 6.665 325 HZ1 LYS 42 HZ1 LYS 42 -3.931 -0.642 6.908 326 HZ2 LYS 42 HZ2 LYS 42 -3.658 -0.864 8.564 327 HZ3 LYS 42 HZ3 LYS 42 -4.246 -2.067 7.525 328 H MET 43 H MET 43 0.983 -7.008 8.814 329 HA MET 43 HA MET 43 -1.039 -8.868 8.100 330 HB2 MET 43 HB2 MET 43 1.935 -8.937 8.259 331 HB3 MET 43 HB3 MET 43 1.074 -10.468 8.187 332 HG2 MET 43 HG2 MET 43 -0.055 -9.673 6.127 333 HG3 MET 43 HG3 MET 43 0.965 -8.235 6.174 334 HE1 MET 43 HE1 MET 43 3.726 -9.714 7.335 335 HE2 MET 43 HE2 MET 43 3.592 -8.360 6.212 336 HE3 MET 43 HE3 MET 43 4.535 -9.783 5.770 337 H HIS 44 H HIS 44 0.827 -8.316 10.991 338 HA HIS 44 HA HIS 44 0.313 -10.792 12.267 339 HB2 HIS 44 HB2 HIS 44 1.239 -8.099 13.184 340 HB3 HIS 44 HB3 HIS 44 0.714 -9.267 14.389 341 HD1 HIS 44 HD1 HIS 44 2.034 -11.666 14.212 342 HD2 HIS 44 HD2 HIS 44 3.832 -8.359 12.452 343 HE1 HIS 44 HE1 HIS 44 4.452 -12.291 13.922 344 HE2 HIS 44 HE2 HIS 44 5.539 -10.237 12.934 345 H GLU 45 H GLU 45 -1.296 -7.611 12.482 346 HA GLU 45 HA GLU 45 -3.222 -8.429 14.367 347 HB2 GLU 45 HB2 GLU 45 -4.395 -6.400 13.886 348 HB3 GLU 45 HB3 GLU 45 -2.675 -6.058 13.844 349 HG2 GLU 45 HG2 GLU 45 -2.710 -6.102 11.404 350 HG3 GLU 45 HG3 GLU 45 -4.431 -6.478 11.431 351 H PHE 46 H PHE 46 -3.137 -8.679 10.876 352 HA PHE 46 HA PHE 46 -5.887 -9.414 10.618 353 HB2 PHE 46 HB2 PHE 46 -3.532 -9.281 8.810 354 HB3 PHE 46 HB3 PHE 46 -4.852 -10.348 8.338 355 HD1 PHE 46 HD1 PHE 46 -7.202 -9.345 8.287 356 HD2 PHE 46 HD2 PHE 46 -3.652 -7.014 8.362 357 HE1 PHE 46 HE1 PHE 46 -8.453 -7.427 7.388 358 HE2 PHE 46 HE2 PHE 46 -4.891 -5.089 7.463 359 HZ PHE 46 HZ PHE 46 -7.291 -5.293 6.975 360 H SER 47 H SER 47 -2.905 -11.144 11.199 361 HA SER 47 HA SER 47 -3.826 -13.738 10.518 362 HB2 SER 47 HB2 SER 47 -1.645 -12.929 12.463 363 HB3 SER 47 HB3 SER 47 -1.874 -14.545 11.794 364 HG SER 47 HG SER 47 -1.339 -12.190 10.280 365 H GLU 48 H GLU 48 -4.476 -11.685 13.144 366 HA GLU 48 HA GLU 48 -5.155 -13.746 15.043 367 HB2 GLU 48 HB2 GLU 48 -4.301 -11.503 15.702 368 HB3 GLU 48 HB3 GLU 48 -5.781 -10.791 15.084 369 HG2 GLU 48 HG2 GLU 48 -6.848 -12.564 16.767 370 HG3 GLU 48 HG3 GLU 48 -5.301 -12.303 17.569 371 H LYS 49 H LYS 49 -6.703 -12.306 12.378 372 HA LYS 49 HA LYS 49 -9.356 -12.895 13.475 373 HB2 LYS 49 HB2 LYS 49 -8.655 -11.381 10.958 374 HB3 LYS 49 HB3 LYS 49 -10.258 -11.546 11.662 375 HG2 LYS 49 HG2 LYS 49 -8.174 -10.434 13.427 376 HG3 LYS 49 HG3 LYS 49 -8.658 -9.431 12.063 377 HD2 LYS 49 HD2 LYS 49 -9.976 -8.900 14.037 378 HD3 LYS 49 HD3 LYS 49 -10.992 -9.588 12.774 379 HE2 LYS 49 HE2 LYS 49 -11.625 -10.519 14.899 380 HE3 LYS 49 HE3 LYS 49 -10.875 -11.775 13.918 381 HZ1 LYS 49 HZ1 LYS 49 -9.232 -10.252 15.836 382 HZ2 LYS 49 HZ2 LYS 49 -9.018 -11.827 15.261 383 HZ3 LYS 49 HZ3 LYS 49 -10.226 -11.503 16.397 384 H GLN 50 H GLN 50 -7.087 -14.023 11.130 385 HA GLN 50 HA GLN 50 -7.119 -15.692 9.575 386 HB2 GLN 50 HB2 GLN 50 -9.153 -16.814 11.509 387 HB3 GLN 50 HB3 GLN 50 -8.352 -17.736 10.247 388 HG2 GLN 50 HG2 GLN 50 -6.214 -17.415 11.300 389 HG3 GLN 50 HG3 GLN 50 -6.935 -16.359 12.515 390 HE21 GLN 50 HE21 GLN 50 -5.441 -18.811 12.908 391 HE22 GLN 50 HE22 GLN 50 -6.492 -19.903 13.735 392 HA PRO 51 HA PRO 51 -11.094 -14.086 7.676 393 HB2 PRO 51 HB2 PRO 51 -9.351 -13.104 5.541 394 HB3 PRO 51 HB3 PRO 51 -10.538 -12.225 6.507 395 HG2 PRO 51 HG2 PRO 51 -7.884 -11.835 6.794 396 HG3 PRO 51 HG3 PRO 51 -9.015 -11.706 8.155 397 HD2 PRO 51 HD2 PRO 51 -7.195 -13.970 7.407 398 HD3 PRO 51 HD3 PRO 51 -7.546 -13.289 9.012 399 H MET 52 H MET 52 -8.302 -15.155 5.731 400 HA MET 52 HA MET 52 -10.128 -16.919 4.249 401 HB2 MET 52 HB2 MET 52 -7.375 -16.065 3.362 402 HB3 MET 52 HB3 MET 52 -8.646 -16.788 2.390 403 HG2 MET 52 HG2 MET 52 -8.626 -14.022 3.569 404 HG3 MET 52 HG3 MET 52 -8.464 -14.455 1.869 405 HE1 MET 52 HE1 MET 52 -10.390 -12.610 1.433 406 HE2 MET 52 HE2 MET 52 -10.546 -12.338 3.171 407 HE3 MET 52 HE3 MET 52 -11.981 -12.676 2.196 408 H LEU 53 H LEU 53 -7.931 -17.037 6.686 409 HA LEU 53 HA LEU 53 -6.617 -18.610 7.648 410 HB2 LEU 53 HB2 LEU 53 -8.790 -20.173 6.329 411 HB3 LEU 53 HB3 LEU 53 -7.461 -21.042 7.069 412 HG LEU 53 HG LEU 53 -9.025 -18.985 8.606 413 HD11 LEU 53 HD11 LEU 53 -10.643 -20.582 7.761 414 HD12 LEU 53 HD12 LEU 53 -10.385 -20.814 9.491 415 HD13 LEU 53 HD13 LEU 53 -9.647 -21.922 8.331 416 HD21 LEU 53 HD21 LEU 53 -8.259 -20.355 10.518 417 HD22 LEU 53 HD22 LEU 53 -6.928 -19.658 9.595 418 HD23 LEU 53 HD23 LEU 53 -7.341 -21.360 9.398 419 H ASP 54 H ASP 54 -5.359 -17.571 5.523 420 HA ASP 54 HA ASP 54 -3.602 -19.701 4.757 421 HB2 ASP 54 HB2 ASP 54 -5.600 -19.646 3.073 422 HB3 ASP 54 HB3 ASP 54 -4.811 -18.202 2.453 423 H VAL 55 H VAL 55 -1.580 -18.902 4.594 424 HA VAL 55 HA VAL 55 -0.968 -16.294 5.311 425 HB VAL 55 HB VAL 55 0.811 -18.217 3.815 426 HG11 VAL 55 HG11 VAL 55 1.723 -15.985 3.715 427 HG12 VAL 55 HG12 VAL 55 2.653 -16.937 4.871 428 HG13 VAL 55 HG13 VAL 55 1.468 -15.765 5.448 429 HG21 VAL 55 HG21 VAL 55 0.529 -17.736 6.779 430 HG22 VAL 55 HG22 VAL 55 1.616 -18.883 5.998 431 HG23 VAL 55 HG23 VAL 55 -0.128 -19.121 5.908 432 HA PRO 56 HA PRO 56 0.161 -15.322 0.619 433 HB2 PRO 56 HB2 PRO 56 -1.593 -16.677 -1.083 434 HB3 PRO 56 HB3 PRO 56 0.127 -17.010 -0.879 435 HG2 PRO 56 HG2 PRO 56 -2.226 -18.373 0.321 436 HG3 PRO 56 HG3 PRO 56 -0.673 -19.051 -0.193 437 HD2 PRO 56 HD2 PRO 56 -1.258 -18.669 2.397 438 HD3 PRO 56 HD3 PRO 56 0.386 -18.434 1.766 439 H LYS 57 H LYS 57 -3.164 -16.335 1.340 440 HA LYS 57 HA LYS 57 -4.380 -14.165 -0.037 441 HB2 LYS 57 HB2 LYS 57 -5.332 -16.238 1.902 442 HB3 LYS 57 HB3 LYS 57 -6.362 -14.862 1.539 443 HG2 LYS 57 HG2 LYS 57 -7.053 -16.584 0.097 444 HG3 LYS 57 HG3 LYS 57 -6.105 -15.481 -0.901 445 HD2 LYS 57 HD2 LYS 57 -4.329 -16.954 -1.070 446 HD3 LYS 57 HD3 LYS 57 -4.777 -17.827 0.396 447 HE2 LYS 57 HE2 LYS 57 -6.887 -18.500 -0.937 448 HE3 LYS 57 HE3 LYS 57 -5.955 -18.011 -2.350 449 HZ1 LYS 57 HZ1 LYS 57 -5.892 -20.463 -1.452 450 HZ2 LYS 57 HZ2 LYS 57 -4.689 -19.833 -0.436 451 HZ3 LYS 57 HZ3 LYS 57 -4.517 -19.738 -2.118 452 H LEU 58 H LEU 58 -3.144 -14.646 3.171 453 HA LEU 58 HA LEU 58 -4.425 -12.418 4.397 454 HB2 LEU 58 HB2 LEU 58 -3.556 -14.294 5.688 455 HB3 LEU 58 HB3 LEU 58 -1.928 -13.943 5.144 456 HG LEU 58 HG LEU 58 -2.869 -11.579 6.351 457 HD11 LEU 58 HD11 LEU 58 -4.635 -12.880 7.393 458 HD12 LEU 58 HD12 LEU 58 -3.454 -12.352 8.592 459 HD13 LEU 58 HD13 LEU 58 -3.446 -14.022 8.017 460 HD21 LEU 58 HD21 LEU 58 -1.005 -13.691 7.427 461 HD22 LEU 58 HD22 LEU 58 -1.070 -11.997 7.914 462 HD23 LEU 58 HD23 LEU 58 -0.560 -12.428 6.282 463 H ALA 59 H ALA 59 -1.239 -12.942 2.961 464 HA ALA 59 HA ALA 59 -0.088 -10.476 3.558 465 HB1 ALA 59 HB1 ALA 59 1.440 -10.948 1.675 466 HB2 ALA 59 HB2 ALA 59 0.394 -12.288 1.198 467 HB3 ALA 59 HB3 ALA 59 1.226 -12.330 2.753 468 H VAL 60 H VAL 60 -1.737 -11.451 0.535 469 HA VAL 60 HA VAL 60 -1.582 -8.878 -0.639 470 HB VAL 60 HB VAL 60 -1.900 -10.903 -1.993 471 HG11 VAL 60 HG11 VAL 60 -4.491 -11.037 -0.513 472 HG12 VAL 60 HG12 VAL 60 -3.314 -12.312 -0.829 473 HG13 VAL 60 HG13 VAL 60 -4.346 -11.724 -2.130 474 HG21 VAL 60 HG21 VAL 60 -2.498 -8.819 -3.022 475 HG22 VAL 60 HG22 VAL 60 -4.087 -8.847 -2.259 476 HG23 VAL 60 HG23 VAL 60 -3.681 -10.036 -3.495 477 H LEU 61 H LEU 61 -3.778 -10.279 1.644 478 HA LEU 61 HA LEU 61 -6.016 -8.615 1.234 479 HB2 LEU 61 HB2 LEU 61 -6.030 -10.687 2.591 480 HB3 LEU 61 HB3 LEU 61 -5.057 -9.876 3.802 481 HG LEU 61 HG LEU 61 -6.962 -8.206 4.031 482 HD11 LEU 61 HD11 LEU 61 -8.158 -8.620 2.001 483 HD12 LEU 61 HD12 LEU 61 -9.187 -9.096 3.351 484 HD13 LEU 61 HD13 LEU 61 -8.350 -10.325 2.404 485 HD21 LEU 61 HD21 LEU 61 -8.256 -9.710 5.471 486 HD22 LEU 61 HD22 LEU 61 -6.520 -9.912 5.693 487 HD23 LEU 61 HD23 LEU 61 -7.431 -11.092 4.753 488 H THR 62 H THR 62 -3.020 -8.178 3.008 489 HA THR 62 HA THR 62 -3.898 -5.775 4.302 490 HB THR 62 HB THR 62 -1.624 -5.501 5.071 491 HG1 THR 62 HG1 THR 62 -0.964 -7.652 3.303 492 HG21 THR 62 HG21 THR 62 -1.313 -7.587 6.268 493 HG22 THR 62 HG22 THR 62 -2.361 -8.427 5.125 494 HG23 THR 62 HG23 THR 62 -3.032 -7.191 6.188 495 H ALA 63 H ALA 63 -2.230 -6.611 1.352 496 HA ALA 63 HA ALA 63 -1.155 -4.120 0.665 497 HB1 ALA 63 HB1 ALA 63 -0.564 -6.207 -0.471 498 HB2 ALA 63 HB2 ALA 63 -1.075 -4.970 -1.618 499 HB3 ALA 63 HB3 ALA 63 -2.175 -6.278 -1.182 500 H VAL 64 H VAL 64 -4.298 -5.556 -0.140 501 HA VAL 64 HA VAL 64 -5.192 -3.358 -1.677 502 HB VAL 64 HB VAL 64 -6.161 -5.655 -1.811 503 HG11 VAL 64 HG11 VAL 64 -7.937 -6.271 -0.222 504 HG12 VAL 64 HG12 VAL 64 -7.500 -4.881 0.773 505 HG13 VAL 64 HG13 VAL 64 -6.343 -6.192 0.529 506 HG21 VAL 64 HG21 VAL 64 -7.311 -3.815 -2.855 507 HG22 VAL 64 HG22 VAL 64 -8.089 -3.386 -1.333 508 HG23 VAL 64 HG23 VAL 64 -8.494 -4.904 -2.134 509 H GLN 65 H GLN 65 -5.187 -3.993 1.737 510 HA GLN 65 HA GLN 65 -7.078 -1.925 2.357 511 HB2 GLN 65 HB2 GLN 65 -6.423 -4.014 3.770 512 HB3 GLN 65 HB3 GLN 65 -5.085 -3.008 4.319 513 HG2 GLN 65 HG2 GLN 65 -6.950 -1.264 4.827 514 HG3 GLN 65 HG3 GLN 65 -8.019 -2.668 4.780 515 HE21 GLN 65 HE21 GLN 65 -8.466 -2.353 6.994 516 HE22 GLN 65 HE22 GLN 65 -7.336 -2.826 8.215 517 H ILE 66 H ILE 66 -3.555 -2.296 2.569 518 HA ILE 66 HA ILE 66 -2.873 0.211 3.565 519 HB ILE 66 HB ILE 66 -1.395 -1.636 1.688 520 HG12 ILE 66 HG12 ILE 66 -0.804 -0.954 4.569 521 HG13 ILE 66 HG13 ILE 66 -1.861 -2.283 4.104 522 HG21 ILE 66 HG21 ILE 66 -0.636 0.665 1.301 523 HG22 ILE 66 HG22 ILE 66 0.616 -0.326 2.048 524 HG23 ILE 66 HG23 ILE 66 -0.288 0.832 3.024 525 HD11 ILE 66 HD11 ILE 66 0.253 -3.226 4.525 526 HD12 ILE 66 HD12 ILE 66 1.081 -1.989 3.585 527 HD13 ILE 66 HD13 ILE 66 0.081 -3.190 2.771 528 H ALA 67 H ALA 67 -3.286 -0.849 0.208 529 HA ALA 67 HA ALA 67 -2.599 1.557 -1.038 530 HB1 ALA 67 HB1 ALA 67 -4.582 -0.487 -2.021 531 HB2 ALA 67 HB2 ALA 67 -2.836 -0.608 -2.202 532 HB3 ALA 67 HB3 ALA 67 -3.715 0.698 -2.998 533 H SER 68 H SER 68 -5.777 0.348 -0.004 534 HA SER 68 HA SER 68 -7.296 2.507 -0.927 535 HB2 SER 68 HB2 SER 68 -7.841 0.720 1.452 536 HB3 SER 68 HB3 SER 68 -9.029 1.717 0.615 537 HG SER 68 HG SER 68 -7.740 -0.632 -0.239 538 H GLU 69 H GLU 69 -5.753 1.978 2.221 539 HA GLU 69 HA GLU 69 -6.760 4.238 3.524 540 HB2 GLU 69 HB2 GLU 69 -4.160 2.753 3.915 541 HB3 GLU 69 HB3 GLU 69 -4.766 3.980 5.021 542 HG2 GLU 69 HG2 GLU 69 -6.724 2.614 5.489 543 HG3 GLU 69 HG3 GLU 69 -6.164 1.399 4.340 544 H TYR 70 H TYR 70 -3.815 3.829 1.584 545 HA TYR 70 HA TYR 70 -2.996 6.554 1.998 546 HB2 TYR 70 HB2 TYR 70 -1.970 4.266 0.367 547 HB3 TYR 70 HB3 TYR 70 -1.379 5.895 0.057 548 HD1 TYR 70 HD1 TYR 70 -0.503 7.196 2.149 549 HD2 TYR 70 HD2 TYR 70 -0.922 2.970 1.973 550 HE1 TYR 70 HE1 TYR 70 1.113 6.965 3.988 551 HE2 TYR 70 HE2 TYR 70 0.692 2.726 3.811 552 HH TYR 70 HH TYR 70 2.452 3.929 4.878 553 H LEU 71 H LEU 71 -4.804 4.837 -0.466 554 HA LEU 71 HA LEU 71 -4.564 6.697 -2.541 555 HB2 LEU 71 HB2 LEU 71 -6.523 4.573 -1.848 556 HB3 LEU 71 HB3 LEU 71 -6.988 5.738 -3.075 557 HG LEU 71 HG LEU 71 -4.391 4.216 -3.272 558 HD11 LEU 71 HD11 LEU 71 -7.093 3.342 -4.280 559 HD12 LEU 71 HD12 LEU 71 -6.070 2.499 -3.113 560 HD13 LEU 71 HD13 LEU 71 -5.555 2.649 -4.790 561 HD21 LEU 71 HD21 LEU 71 -4.437 4.800 -5.550 562 HD22 LEU 71 HD22 LEU 71 -4.883 6.270 -4.685 563 HD23 LEU 71 HD23 LEU 71 -6.126 5.301 -5.474 564 H LYS 72 H LYS 72 -6.878 6.553 0.143 565 HA LYS 72 HA LYS 72 -8.317 8.856 -0.819 566 HB2 LYS 72 HB2 LYS 72 -9.707 8.635 1.097 567 HB3 LYS 72 HB3 LYS 72 -9.361 7.007 0.537 568 HG2 LYS 72 HG2 LYS 72 -8.632 6.467 2.551 569 HG3 LYS 72 HG3 LYS 72 -7.382 7.708 2.442 570 HD2 LYS 72 HD2 LYS 72 -8.686 8.129 4.414 571 HD3 LYS 72 HD3 LYS 72 -9.056 9.379 3.226 572 HE2 LYS 72 HE2 LYS 72 -11.127 8.730 4.152 573 HE3 LYS 72 HE3 LYS 72 -11.057 7.980 2.559 574 HZ1 LYS 72 HZ1 LYS 72 -10.716 6.691 5.202 575 HZ2 LYS 72 HZ2 LYS 72 -10.203 5.947 3.774 576 HZ3 LYS 72 HZ3 LYS 72 -11.838 6.323 3.986 577 H LEU 73 H LEU 73 -5.433 8.402 0.850 578 HA LEU 73 HA LEU 73 -5.581 10.917 2.304 579 HB2 LEU 73 HB2 LEU 73 -4.520 8.965 3.362 580 HB3 LEU 73 HB3 LEU 73 -3.334 8.911 2.074 581 HG LEU 73 HG LEU 73 -2.510 11.146 2.785 582 HD11 LEU 73 HD11 LEU 73 -4.466 10.745 5.045 583 HD12 LEU 73 HD12 LEU 73 -4.448 12.057 3.863 584 HD13 LEU 73 HD13 LEU 73 -3.158 11.927 5.055 585 HD21 LEU 73 HD21 LEU 73 -2.506 9.041 4.942 586 HD22 LEU 73 HD22 LEU 73 -1.344 10.358 4.767 587 HD23 LEU 73 HD23 LEU 73 -1.427 9.088 3.546 588 H LYS 74 H LYS 74 -4.128 9.549 -0.571 589 HA LYS 74 HA LYS 74 -2.488 11.884 -1.033 590 HB2 LYS 74 HB2 LYS 74 -1.517 10.730 -2.777 591 HB3 LYS 74 HB3 LYS 74 -2.019 9.409 -1.735 592 HG2 LYS 74 HG2 LYS 74 -3.677 8.718 -3.161 593 HG3 LYS 74 HG3 LYS 74 -3.877 10.317 -3.877 594 HD2 LYS 74 HD2 LYS 74 -1.649 10.038 -4.968 595 HD3 LYS 74 HD3 LYS 74 -1.606 8.383 -4.357 596 HE2 LYS 74 HE2 LYS 74 -3.762 7.979 -5.574 597 HE3 LYS 74 HE3 LYS 74 -3.579 9.573 -6.303 598 HZ1 LYS 74 HZ1 LYS 74 -1.453 8.826 -7.229 599 HZ2 LYS 74 HZ2 LYS 74 -2.744 7.884 -7.779 600 HZ3 LYS 74 HZ3 LYS 74 -1.706 7.287 -6.586 601 H GLU 75 H GLU 75 -5.683 10.889 -1.762 602 HA GLU 75 HA GLU 75 -5.948 12.554 -4.093 603 HB2 GLU 75 HB2 GLU 75 -7.804 11.365 -4.492 604 HB3 GLU 75 HB3 GLU 75 -7.352 10.376 -3.114 605 HG2 GLU 75 HG2 GLU 75 -9.077 11.088 -1.907 606 HG3 GLU 75 HG3 GLU 75 -8.816 12.773 -2.360 607 H GLU 76 H GLU 76 -6.612 12.857 -0.653 608 HA GLU 76 HA GLU 76 -8.224 15.173 -0.819 609 HB2 GLU 76 HB2 GLU 76 -7.835 15.454 1.534 610 HB3 GLU 76 HB3 GLU 76 -8.003 13.733 1.218 611 HG2 GLU 76 HG2 GLU 76 -5.792 13.297 1.641 612 HG3 GLU 76 HG3 GLU 76 -5.282 14.940 1.258 613 H TYR 77 H TYR 77 -4.817 14.600 -0.919 614 HA TYR 77 HA TYR 77 -3.767 17.100 -0.362 615 HB2 TYR 77 HB2 TYR 77 -2.241 15.315 -0.578 616 HB3 TYR 77 HB3 TYR 77 -2.869 14.850 -2.151 617 HD1 TYR 77 HD2 TYR 77 -1.717 18.184 -0.915 618 HD2 TYR 77 HD1 TYR 77 -1.070 14.951 -3.597 619 HE1 TYR 77 HE2 TYR 77 0.083 19.449 -1.991 620 HE2 TYR 77 HE1 TYR 77 0.745 16.207 -4.680 621 HH TYR 77 HH TYR 77 2.270 18.718 -3.399 622 H GLN 78 H GLN 78 -4.882 15.790 -3.472 623 HA GLN 78 HA GLN 78 -4.312 18.214 -4.876 624 HB2 GLN 78 HB2 GLN 78 -5.766 15.686 -5.587 625 HB3 GLN 78 HB3 GLN 78 -5.786 17.075 -6.664 626 HG2 GLN 78 HG2 GLN 78 -3.336 15.611 -5.706 627 HG3 GLN 78 HG3 GLN 78 -4.057 15.502 -7.311 628 HE21 GLN 78 HE21 GLN 78 -2.220 17.467 -5.119 629 HE22 GLN 78 HE22 GLN 78 -1.667 18.617 -6.284 630 H ARG 79 H ARG 79 -7.084 16.920 -3.205 631 HA ARG 79 HA ARG 79 -9.108 18.449 -4.374 632 HB2 ARG 79 HB2 ARG 79 -8.794 16.976 -1.827 633 HB3 ARG 79 HB3 ARG 79 -10.059 18.195 -1.873 634 HG2 ARG 79 HG2 ARG 79 -10.554 15.714 -2.548 635 HG3 ARG 79 HG3 ARG 79 -11.307 17.055 -3.412 636 HD2 ARG 79 HD2 ARG 79 -9.898 16.819 -5.251 637 HD3 ARG 79 HD3 ARG 79 -8.703 15.903 -4.342 638 HE ARG 79 HE ARG 79 -10.575 14.133 -4.278 639 HH11 ARG 79 HH11 ARG 79 -10.025 16.372 -6.938 640 HH12 ARG 79 HH12 ARG 79 -10.573 15.249 -8.145 641 HH21 ARG 79 HH21 ARG 79 -11.282 12.675 -5.855 642 HH22 ARG 79 HH22 ARG 79 -11.293 13.139 -7.530 643 H LEU 80 H LEU 80 -7.094 19.229 -1.530 644 HA LEU 80 HA LEU 80 -8.383 21.778 -1.210 645 HB2 LEU 80 HB2 LEU 80 -6.827 22.196 0.555 646 HB3 LEU 80 HB3 LEU 80 -7.393 20.545 0.687 647 HG LEU 80 HG LEU 80 -5.025 20.463 -0.866 648 HD11 LEU 80 HD11 LEU 80 -3.385 21.434 0.649 649 HD12 LEU 80 HD12 LEU 80 -4.681 22.084 1.653 650 HD13 LEU 80 HD13 LEU 80 -4.463 22.668 0.002 651 HD21 LEU 80 HD21 LEU 80 -5.824 18.684 0.578 652 HD22 LEU 80 HD22 LEU 80 -5.538 19.688 2.002 653 HD23 LEU 80 HD23 LEU 80 -4.181 19.152 1.016 654 H ARG 81 H ARG 81 -5.722 20.584 -3.040 655 HA ARG 81 HA ARG 81 -4.458 23.141 -3.373 656 HB2 ARG 81 HB2 ARG 81 -4.062 20.484 -4.740 657 HB3 ARG 81 HB3 ARG 81 -3.140 21.922 -5.158 658 HG2 ARG 81 HG2 ARG 81 -3.046 21.544 -2.325 659 HG3 ARG 81 HG3 ARG 81 -2.615 20.038 -3.135 660 HD2 ARG 81 HD2 ARG 81 -0.642 21.407 -2.743 661 HD3 ARG 81 HD3 ARG 81 -0.950 21.216 -4.463 662 HE ARG 81 HE ARG 81 -1.889 23.640 -3.113 663 HH11 ARG 81 HH11 ARG 81 0.242 22.089 -5.423 664 HH12 ARG 81 HH12 ARG 81 0.794 23.581 -6.111 665 HH21 ARG 81 HH21 ARG 81 -1.182 25.617 -4.047 666 HH22 ARG 81 HH22 ARG 81 -0.027 25.588 -5.342 667 H GLU 82 H GLU 82 -6.502 21.045 -5.391 668 HA GLU 82 HA GLU 82 -6.513 22.725 -7.659 669 HB2 GLU 82 HB2 GLU 82 -8.440 21.426 -8.411 670 HB3 GLU 82 HB3 GLU 82 -7.199 20.368 -7.758 671 HG2 GLU 82 HG2 GLU 82 -8.432 20.036 -5.746 672 HG3 GLU 82 HG3 GLU 82 -9.597 21.280 -6.188 673 H GLN 83 H GLN 83 -8.340 22.756 -4.711 674 HA GLN 83 HA GLN 83 -10.457 24.432 -5.571 675 HB2 GLN 83 HB2 GLN 83 -10.242 22.950 -3.446 676 HB3 GLN 83 HB3 GLN 83 -9.444 24.352 -2.745 677 HG2 GLN 83 HG2 GLN 83 -11.417 25.705 -3.142 678 HG3 GLN 83 HG3 GLN 83 -12.219 24.333 -3.907 679 HE21 GLN 83 HE21 GLN 83 -13.886 24.199 -2.463 680 HE22 GLN 83 HE22 GLN 83 -13.674 23.719 -0.812 681 H LEU 84 H LEU 84 -7.241 25.037 -4.343 682 HA LEU 84 HA LEU 84 -7.674 27.852 -3.954 683 HB2 LEU 84 HB2 LEU 84 -6.076 26.598 -2.592 684 HB3 LEU 84 HB3 LEU 84 -5.132 26.230 -4.023 685 HG LEU 84 HG LEU 84 -4.543 28.585 -4.294 686 HD11 LEU 84 HD11 LEU 84 -6.305 29.029 -1.889 687 HD12 LEU 84 HD12 LEU 84 -6.489 29.715 -3.503 688 HD13 LEU 84 HD13 LEU 84 -5.138 30.207 -2.483 689 HD21 LEU 84 HD21 LEU 84 -4.087 27.639 -1.464 690 HD22 LEU 84 HD22 LEU 84 -3.169 28.887 -2.300 691 HD23 LEU 84 HD23 LEU 84 -3.106 27.223 -2.868 692 H LYS 85 H LYS 85 -6.541 25.789 -6.503 693 HA LYS 85 HA LYS 85 -5.165 27.662 -8.072 694 HB2 LYS 85 HB2 LYS 85 -6.703 25.197 -8.897 695 HB3 LYS 85 HB3 LYS 85 -5.638 26.108 -9.964 696 HG2 LYS 85 HG2 LYS 85 -3.734 25.595 -8.561 697 HG3 LYS 85 HG3 LYS 85 -4.778 24.761 -7.408 698 HD2 LYS 85 HD2 LYS 85 -4.301 22.900 -8.553 699 HD3 LYS 85 HD3 LYS 85 -5.368 23.527 -9.807 700 HE2 LYS 85 HE2 LYS 85 -3.435 23.050 -10.987 701 HE3 LYS 85 HE3 LYS 85 -3.251 24.768 -10.640 702 HZ1 LYS 85 HZ1 LYS 85 -1.873 24.128 -8.705 703 HZ2 LYS 85 HZ2 LYS 85 -1.202 23.668 -10.186 704 HZ3 LYS 85 HZ3 LYS 85 -1.956 22.517 -9.207 705 H LYS 86 H LYS 86 -8.412 26.365 -8.852 706 HA LYS 86 HA LYS 86 -9.608 28.912 -9.140 707 HB2 LYS 86 HB2 LYS 86 -9.787 29.124 -11.508 708 HB3 LYS 86 HB3 LYS 86 -8.084 28.874 -11.157 709 HG2 LYS 86 HG2 LYS 86 -8.028 26.837 -12.165 710 HG3 LYS 86 HG3 LYS 86 -9.710 26.477 -11.775 711 HD2 LYS 86 HD2 LYS 86 -9.140 28.685 -13.695 712 HD3 LYS 86 HD3 LYS 86 -8.955 27.022 -14.250 713 HE2 LYS 86 HE2 LYS 86 -11.177 27.777 -14.768 714 HE3 LYS 86 HE3 LYS 86 -11.271 26.560 -13.496 715 HZ1 LYS 86 HZ1 LYS 86 -11.244 29.458 -12.903 716 HZ2 LYS 86 HZ2 LYS 86 -11.724 28.188 -11.887 717 HZ3 LYS 86 HZ3 LYS 86 -12.679 28.622 -13.217 718 H1 GLY 1 H1 GLY 1 -36.208 -6.150 17.575 719 H2 GLY 1 H2 GLY 1 -35.099 -7.207 18.288 720 H3 GLY 1 H3 GLY 1 -34.618 -6.215 17.009 721 HA2 GLY 1 HA3 GLY 1 -35.526 -5.208 19.639 722 HA3 GLY 1 HA2 GLY 1 -33.838 -5.433 19.201 723 H SER 2 H SER 2 -36.252 -3.198 19.404 724 HA SER 2 HA SER 2 -35.516 -1.666 17.056 725 HB2 SER 2 HB2 SER 2 -37.317 -0.798 19.313 726 HB3 SER 2 HB3 SER 2 -37.273 -0.171 17.665 727 HG SER 2 HG SER 2 -37.679 -2.842 17.667 728 H HIS 3 H HIS 3 -33.418 -1.034 17.307 729 HA HIS 3 HA HIS 3 -32.899 0.860 19.498 730 HB2 HIS 3 HB2 HIS 3 -31.295 -1.454 18.573 731 HB3 HIS 3 HB3 HIS 3 -30.399 0.017 18.927 732 HD1 HIS 3 HD1 HIS 3 -29.707 0.281 21.292 733 HD2 HIS 3 HD2 HIS 3 -32.986 -2.246 20.899 734 HE1 HIS 3 HE1 HIS 3 -30.171 -0.596 23.603 735 HE2 HIS 3 HE2 HIS 3 -32.036 -2.257 23.301 736 H MET 4 H MET 4 -31.083 2.383 18.932 737 HA MET 4 HA MET 4 -31.671 3.586 16.405 738 HB2 MET 4 HB2 MET 4 -29.523 4.260 18.433 739 HB3 MET 4 HB3 MET 4 -29.979 5.266 17.065 740 HG2 MET 4 HG2 MET 4 -32.210 5.543 18.002 741 HG3 MET 4 HG3 MET 4 -31.770 4.510 19.360 742 HE1 MET 4 HE1 MET 4 -32.298 6.197 21.299 743 HE2 MET 4 HE2 MET 4 -33.046 7.154 20.025 744 HE3 MET 4 HE3 MET 4 -31.951 7.921 21.176 745 H THR 5 H THR 5 -30.299 3.833 14.624 746 HA THR 5 HA THR 5 -27.854 2.226 14.620 747 HB THR 5 HB THR 5 -29.629 0.809 13.670 748 HG1 THR 5 HG1 THR 5 -27.432 0.765 12.811 749 HG21 THR 5 HG21 THR 5 -30.638 1.426 11.491 750 HG22 THR 5 HG22 THR 5 -29.925 3.031 11.649 751 HG23 THR 5 HG23 THR 5 -31.136 2.485 12.809 752 H GLU 6 H GLU 6 -26.267 2.922 13.195 753 HA GLU 6 HA GLU 6 -26.788 5.491 11.854 754 HB2 GLU 6 HB2 GLU 6 -24.498 6.179 12.413 755 HB3 GLU 6 HB3 GLU 6 -25.431 5.858 13.867 756 HG2 GLU 6 HG2 GLU 6 -23.616 3.799 12.661 757 HG3 GLU 6 HG3 GLU 6 -23.024 5.023 13.781 758 H GLN 7 H GLN 7 -24.412 5.793 10.522 759 HA GLN 7 HA GLN 7 -24.275 3.374 8.844 760 HB2 GLN 7 HB2 GLN 7 -24.259 6.282 8.056 761 HB3 GLN 7 HB3 GLN 7 -23.623 5.033 6.992 762 HG2 GLN 7 HG2 GLN 7 -26.431 5.148 8.070 763 HG3 GLN 7 HG3 GLN 7 -25.932 5.622 6.448 764 HE21 GLN 7 HE21 GLN 7 -26.446 2.976 8.632 765 HE22 GLN 7 HE22 GLN 7 -26.431 1.725 7.437 766 HA PRO 8 HA PRO 8 -20.024 4.010 10.298 767 HB2 PRO 8 HB2 PRO 8 -19.483 1.457 10.870 768 HB3 PRO 8 HB3 PRO 8 -20.513 2.426 11.928 769 HG2 PRO 8 HG2 PRO 8 -21.266 0.348 9.930 770 HG3 PRO 8 HG3 PRO 8 -21.974 0.686 11.518 771 HD2 PRO 8 HD2 PRO 8 -22.985 1.549 9.056 772 HD3 PRO 8 HD3 PRO 8 -23.427 2.204 10.644 773 H LYS 9 H LYS 9 -17.993 2.514 9.678 774 HA LYS 9 HA LYS 9 -17.622 2.770 6.903 775 HB2 LYS 9 HB2 LYS 9 -16.046 1.122 8.884 776 HB3 LYS 9 HB3 LYS 9 -15.518 1.538 7.265 777 HG2 LYS 9 HG2 LYS 9 -15.400 3.865 7.827 778 HG3 LYS 9 HG3 LYS 9 -16.100 3.563 9.418 779 HD2 LYS 9 HD2 LYS 9 -13.542 2.265 8.515 780 HD3 LYS 9 HD3 LYS 9 -13.573 3.845 9.301 781 HE2 LYS 9 HE2 LYS 9 -15.140 1.857 10.733 782 HE3 LYS 9 HE3 LYS 9 -13.449 1.387 10.566 783 HZ1 LYS 9 HZ1 LYS 9 -13.724 2.638 12.562 784 HZ2 LYS 9 HZ2 LYS 9 -14.494 3.900 11.745 785 HZ3 LYS 9 HZ3 LYS 9 -12.857 3.593 11.468 786 H THR 10 H THR 10 -18.835 1.605 5.516 787 HA THR 10 HA THR 10 -19.707 -1.048 6.071 788 HB THR 10 HB THR 10 -20.949 0.615 4.642 789 HG1 THR 10 HG1 THR 10 -21.491 -1.109 3.046 790 HG21 THR 10 HG21 THR 10 -20.333 0.590 2.202 791 HG22 THR 10 HG22 THR 10 -18.793 -0.134 2.668 792 HG23 THR 10 HG23 THR 10 -19.219 1.480 3.237 793 H ARG 11 H ARG 11 -19.214 -2.932 4.801 794 HA ARG 11 HA ARG 11 -16.391 -2.989 4.023 795 HB2 ARG 11 HB2 ARG 11 -16.390 -5.327 4.505 796 HB3 ARG 11 HB3 ARG 11 -17.188 -4.516 5.847 797 HG2 ARG 11 HG2 ARG 11 -19.378 -5.110 4.785 798 HG3 ARG 11 HG3 ARG 11 -18.473 -6.094 3.632 799 HD2 ARG 11 HD2 ARG 11 -17.494 -7.320 5.573 800 HD3 ARG 11 HD3 ARG 11 -18.583 -6.419 6.624 801 HE ARG 11 HE ARG 11 -19.895 -7.833 4.480 802 HH11 ARG 11 HH11 ARG 11 -18.719 -7.988 7.774 803 HH12 ARG 11 HH12 ARG 11 -19.757 -9.305 8.221 804 HH21 ARG 11 HH21 ARG 11 -21.270 -9.566 5.066 805 HH22 ARG 11 HH22 ARG 11 -21.212 -10.202 6.677 806 H VAL 12 H VAL 12 -15.772 -4.332 2.206 807 HA VAL 12 HA VAL 12 -17.864 -4.735 0.189 808 HB VAL 12 HB VAL 12 -16.787 -2.472 -0.128 809 HG11 VAL 12 HG11 VAL 12 -14.435 -3.020 -1.410 810 HG12 VAL 12 HG12 VAL 12 -14.394 -4.141 -0.053 811 HG13 VAL 12 HG13 VAL 12 -14.583 -2.414 0.239 812 HG21 VAL 12 HG21 VAL 12 -17.864 -3.692 -1.979 813 HG22 VAL 12 HG22 VAL 12 -16.312 -4.432 -2.374 814 HG23 VAL 12 HG23 VAL 12 -16.522 -2.688 -2.526 815 H SER 13 H SER 13 -17.302 -6.294 -1.410 816 HA SER 13 HA SER 13 -14.917 -7.883 -0.752 817 HB2 SER 13 HB2 SER 13 -17.491 -8.954 -1.928 818 HB3 SER 13 HB3 SER 13 -16.126 -9.887 -1.317 819 HG SER 13 HG SER 13 -17.961 -8.302 0.146 820 H VAL 14 H VAL 14 -13.429 -7.713 -2.301 821 HA VAL 14 HA VAL 14 -14.341 -7.405 -5.091 822 HB VAL 14 HB VAL 14 -12.170 -6.272 -5.547 823 HG11 VAL 14 HG11 VAL 14 -14.124 -4.912 -5.289 824 HG12 VAL 14 HG12 VAL 14 -12.779 -4.113 -4.473 825 HG13 VAL 14 HG13 VAL 14 -13.994 -4.979 -3.531 826 HG21 VAL 14 HG21 VAL 14 -11.887 -6.007 -2.561 827 HG22 VAL 14 HG22 VAL 14 -10.749 -5.500 -3.812 828 HG23 VAL 14 HG23 VAL 14 -11.023 -7.215 -3.509 829 H ARG 15 H ARG 15 -12.614 -8.176 -6.692 830 HA ARG 15 HA ARG 15 -11.487 -10.687 -5.651 831 HB2 ARG 15 HB2 ARG 15 -13.310 -11.130 -7.173 832 HB3 ARG 15 HB3 ARG 15 -12.606 -10.073 -8.384 833 HG2 ARG 15 HG2 ARG 15 -10.885 -11.580 -8.870 834 HG3 ARG 15 HG3 ARG 15 -11.162 -12.502 -7.390 835 HD2 ARG 15 HD2 ARG 15 -11.986 -13.645 -9.423 836 HD3 ARG 15 HD3 ARG 15 -13.253 -13.331 -8.239 837 HE ARG 15 HE ARG 15 -13.054 -11.262 -10.205 838 HH11 ARG 15 HH11 ARG 15 -14.353 -14.433 -9.560 839 HH12 ARG 15 HH12 ARG 15 -15.625 -14.296 -10.728 840 HH21 ARG 15 HH21 ARG 15 -14.753 -11.056 -11.738 841 HH22 ARG 15 HH22 ARG 15 -15.856 -12.376 -11.965 842 H ILE 16 H ILE 16 -9.364 -10.926 -5.752 843 HA ILE 16 HA ILE 16 -7.828 -9.393 -7.739 844 HB ILE 16 HB ILE 16 -6.987 -9.769 -4.855 845 HG12 ILE 16 HG12 ILE 16 -7.693 -7.158 -6.183 846 HG13 ILE 16 HG13 ILE 16 -8.887 -8.113 -5.310 847 HG21 ILE 16 HG21 ILE 16 -5.183 -9.714 -6.594 848 HG22 ILE 16 HG22 ILE 16 -5.082 -8.439 -5.379 849 HG23 ILE 16 HG23 ILE 16 -5.706 -8.074 -6.989 850 HD11 ILE 16 HD11 ILE 16 -8.035 -6.398 -3.877 851 HD12 ILE 16 HD12 ILE 16 -6.374 -6.903 -4.187 852 HD13 ILE 16 HD13 ILE 16 -7.465 -7.962 -3.294 853 H TYR 17 H TYR 17 -6.629 -10.697 -8.926 854 HA TYR 17 HA TYR 17 -5.475 -12.486 -9.687 855 HB2 TYR 17 HB2 TYR 17 -4.585 -12.117 -6.977 856 HB3 TYR 17 HB3 TYR 17 -4.554 -13.829 -7.395 857 HD1 TYR 17 HD1 TYR 17 -3.840 -10.724 -9.346 858 HD2 TYR 17 HD2 TYR 17 -2.392 -14.464 -7.924 859 HE1 TYR 17 HE1 TYR 17 -1.750 -10.382 -10.586 860 HE2 TYR 17 HE2 TYR 17 -0.292 -14.125 -9.164 861 HH TYR 17 HH TYR 17 0.507 -12.850 -11.112 862 H GLY 18 H GLY 18 -8.303 -12.782 -9.001 863 HA2 GLY 18 HA2 GLY 18 -9.656 -14.629 -9.579 864 HA3 GLY 18 HA3 GLY 18 -8.355 -15.704 -9.098 865 H GLN 19 H GLN 19 -8.066 -14.172 -6.506 866 HA GLN 19 HA GLN 19 -10.175 -15.647 -5.125 867 HB2 GLN 19 HB2 GLN 19 -7.722 -14.266 -4.023 868 HB3 GLN 19 HB3 GLN 19 -8.858 -15.218 -3.080 869 HG2 GLN 19 HG2 GLN 19 -7.257 -16.781 -3.417 870 HG3 GLN 19 HG3 GLN 19 -8.239 -17.072 -4.849 871 HE21 GLN 19 HE21 GLN 19 -6.090 -14.323 -4.395 872 HE22 GLN 19 HE22 GLN 19 -4.983 -14.760 -5.650 873 H ASP 20 H ASP 20 -11.513 -14.699 -3.555 874 HA ASP 20 HA ASP 20 -11.996 -11.853 -4.032 875 HB2 ASP 20 HB2 ASP 20 -14.193 -12.268 -2.918 876 HB3 ASP 20 HB3 ASP 20 -13.949 -13.214 -4.382 877 H TYR 21 H TYR 21 -11.891 -10.347 -2.465 878 HA TYR 21 HA TYR 21 -11.205 -11.241 0.247 879 HB2 TYR 21 HB2 TYR 21 -9.842 -8.998 -1.267 880 HB3 TYR 21 HB3 TYR 21 -9.504 -9.478 0.395 881 HD1 TYR 21 HD2 TYR 21 -8.535 -11.777 0.811 882 HD2 TYR 21 HD1 TYR 21 -8.815 -10.089 -3.086 883 HE1 TYR 21 HE2 TYR 21 -6.880 -13.399 -0.004 884 HE2 TYR 21 HE1 TYR 21 -7.164 -11.712 -3.912 885 HH TYR 21 HH TYR 21 -5.209 -13.108 -2.765 886 H THR 22 H THR 22 -12.220 -10.171 1.850 887 HA THR 22 HA THR 22 -13.962 -7.934 1.078 888 HB THR 22 HB THR 22 -14.291 -9.832 3.409 889 HG1 THR 22 HG1 THR 22 -16.039 -9.834 1.208 890 HG21 THR 22 HG21 THR 22 -15.314 -7.566 3.662 891 HG22 THR 22 HG22 THR 22 -16.483 -8.888 3.666 892 HG23 THR 22 HG23 THR 22 -16.278 -7.897 2.222 893 H ILE 23 H ILE 23 -13.334 -6.013 1.795 894 HA ILE 23 HA ILE 23 -12.071 -5.812 4.434 895 HB ILE 23 HB ILE 23 -10.433 -4.224 3.745 896 HG12 ILE 23 HG12 ILE 23 -11.978 -3.341 1.832 897 HG13 ILE 23 HG13 ILE 23 -10.237 -3.184 1.690 898 HG21 ILE 23 HG21 ILE 23 -10.393 -6.668 2.001 899 HG22 ILE 23 HG22 ILE 23 -9.666 -6.453 3.589 900 HG23 ILE 23 HG23 ILE 23 -9.020 -5.580 2.204 901 HD11 ILE 23 HD11 ILE 23 -10.130 -4.959 0.127 902 HD12 ILE 23 HD12 ILE 23 -11.434 -3.890 -0.377 903 HD13 ILE 23 HD13 ILE 23 -11.804 -5.412 0.422 904 H VAL 24 H VAL 24 -11.776 -3.161 4.682 905 HA VAL 24 HA VAL 24 -14.535 -2.249 4.702 906 HB VAL 24 HB VAL 24 -12.070 -0.964 5.894 907 HG11 VAL 24 HG11 VAL 24 -13.680 0.335 7.223 908 HG12 VAL 24 HG12 VAL 24 -14.999 -0.390 6.306 909 HG13 VAL 24 HG13 VAL 24 -13.831 0.654 5.495 910 HG21 VAL 24 HG21 VAL 24 -12.439 -3.083 6.951 911 HG22 VAL 24 HG22 VAL 24 -14.164 -2.751 7.117 912 HG23 VAL 24 HG23 VAL 24 -12.994 -1.815 8.043 913 H GLY 25 H GLY 25 -15.331 -0.840 3.259 914 HA2 GLY 25 HA2 GLY 25 -13.401 0.562 1.521 915 HA3 GLY 25 HA3 GLY 25 -15.012 0.064 1.019 916 H ALA 26 H ALA 26 -13.524 1.998 3.606 917 HA ALA 26 HA ALA 26 -15.819 3.756 3.679 918 HB1 ALA 26 HB1 ALA 26 -13.245 3.830 5.242 919 HB2 ALA 26 HB2 ALA 26 -14.769 3.119 5.773 920 HB3 ALA 26 HB3 ALA 26 -14.644 4.863 5.528 921 H GLU 27 H GLU 27 -15.670 4.587 1.559 922 HA GLU 27 HA GLU 27 -14.369 7.082 1.396 923 HB2 GLU 27 HB2 GLU 27 -12.359 5.901 0.866 924 HB3 GLU 27 HB3 GLU 27 -13.193 4.828 -0.247 925 HG2 GLU 27 HG2 GLU 27 -11.859 6.456 -1.443 926 HG3 GLU 27 HG3 GLU 27 -13.575 6.690 -1.768 927 H SER 28 H SER 28 -15.174 4.617 -1.039 928 HA SER 28 HA SER 28 -17.725 5.657 -1.669 929 HB2 SER 28 HB2 SER 28 -15.403 6.513 -3.388 930 HB3 SER 28 HB3 SER 28 -17.017 6.342 -4.074 931 HG SER 28 HG SER 28 -16.731 7.824 -1.718 932 HA PRO 29 HA PRO 29 -18.042 1.486 -3.065 933 HB2 PRO 29 HB2 PRO 29 -20.030 1.893 -4.972 934 HB3 PRO 29 HB3 PRO 29 -20.293 1.607 -3.251 935 HG2 PRO 29 HG2 PRO 29 -20.246 4.179 -4.764 936 HG3 PRO 29 HG3 PRO 29 -21.289 3.683 -3.418 937 HD2 PRO 29 HD2 PRO 29 -19.237 5.362 -3.054 938 HD3 PRO 29 HD3 PRO 29 -19.662 4.145 -1.830 939 H ALA 30 H ALA 30 -17.533 4.034 -5.434 940 HA ALA 30 HA ALA 30 -16.632 2.039 -7.385 941 HB1 ALA 30 HB1 ALA 30 -16.672 3.857 -9.012 942 HB2 ALA 30 HB2 ALA 30 -17.109 4.995 -7.739 943 HB3 ALA 30 HB3 ALA 30 -18.223 3.704 -8.187 944 H HIS 31 H HIS 31 -15.390 4.251 -5.112 945 HA HIS 31 HA HIS 31 -12.914 4.797 -6.486 946 HB2 HIS 31 HB2 HIS 31 -14.176 6.246 -4.726 947 HB3 HIS 31 HB3 HIS 31 -13.330 5.248 -3.551 948 HD1 HIS 31 HD1 HIS 31 -10.553 5.123 -4.969 949 HD2 HIS 31 HD2 HIS 31 -12.822 8.572 -4.464 950 HE1 HIS 31 HE1 HIS 31 -8.916 7.033 -5.047 951 HE2 HIS 31 HE2 HIS 31 -10.304 9.113 -4.658 952 H ILE 32 H ILE 32 -14.060 2.406 -4.242 953 HA ILE 32 HA ILE 32 -11.314 1.536 -3.735 954 HB ILE 32 HB ILE 32 -11.986 0.275 -1.943 955 HG12 ILE 32 HG12 ILE 32 -13.704 -1.064 -3.101 956 HG13 ILE 32 HG13 ILE 32 -14.183 -0.593 -1.480 957 HG21 ILE 32 HG21 ILE 32 -12.265 2.465 -1.236 958 HG22 ILE 32 HG22 ILE 32 -13.719 1.641 -0.673 959 HG23 ILE 32 HG23 ILE 32 -13.783 2.665 -2.107 960 HD11 ILE 32 HD11 ILE 32 -16.086 -0.415 -2.852 961 HD12 ILE 32 HD12 ILE 32 -15.205 0.479 -4.087 962 HD13 ILE 32 HD13 ILE 32 -15.552 1.233 -2.531 963 H ARG 33 H ARG 33 -13.510 1.109 -6.063 964 HA ARG 33 HA ARG 33 -13.263 -1.737 -6.445 965 HB2 ARG 33 HB2 ARG 33 -14.931 0.285 -7.474 966 HB3 ARG 33 HB3 ARG 33 -14.008 -0.308 -8.845 967 HG2 ARG 33 HG2 ARG 33 -15.940 -1.612 -8.803 968 HG3 ARG 33 HG3 ARG 33 -14.687 -2.637 -8.103 969 HD2 ARG 33 HD2 ARG 33 -15.490 -2.261 -5.902 970 HD3 ARG 33 HD3 ARG 33 -16.556 -0.965 -6.444 971 HE ARG 33 HE ARG 33 -16.951 -3.774 -7.251 972 HH11 ARG 33 HH11 ARG 33 -18.204 -0.725 -6.045 973 HH12 ARG 33 HH12 ARG 33 -19.853 -1.274 -6.028 974 HH21 ARG 33 HH21 ARG 33 -19.125 -4.477 -7.233 975 HH22 ARG 33 HH22 ARG 33 -20.372 -3.402 -6.681 976 H LEU 34 H LEU 34 -11.801 1.196 -7.695 977 HA LEU 34 HA LEU 34 -10.227 -0.021 -9.709 978 HB2 LEU 34 HB2 LEU 34 -9.043 2.085 -9.810 979 HB3 LEU 34 HB3 LEU 34 -10.764 2.377 -9.679 980 HG LEU 34 HG LEU 34 -9.996 2.487 -7.054 981 HD11 LEU 34 HD11 LEU 34 -8.014 3.892 -6.939 982 HD12 LEU 34 HD12 LEU 34 -7.791 3.744 -8.682 983 HD13 LEU 34 HD13 LEU 34 -7.631 2.324 -7.648 984 HD21 LEU 34 HD21 LEU 34 -10.246 4.902 -7.293 985 HD22 LEU 34 HD22 LEU 34 -11.473 4.033 -8.212 986 HD23 LEU 34 HD23 LEU 34 -10.094 4.748 -9.044 987 H VAL 35 H VAL 35 -9.896 0.233 -6.298 988 HA VAL 35 HA VAL 35 -7.106 0.040 -6.009 989 HB VAL 35 HB VAL 35 -9.177 -1.134 -4.148 990 HG11 VAL 35 HG11 VAL 35 -6.890 -1.839 -3.682 991 HG12 VAL 35 HG12 VAL 35 -7.483 -0.756 -2.422 992 HG13 VAL 35 HG13 VAL 35 -6.369 -0.154 -3.651 993 HG21 VAL 35 HG21 VAL 35 -9.607 1.249 -4.728 994 HG22 VAL 35 HG22 VAL 35 -8.017 1.642 -4.078 995 HG23 VAL 35 HG23 VAL 35 -9.260 0.976 -3.020 996 H ALA 36 H ALA 36 -9.631 -2.425 -6.228 997 HA ALA 36 HA ALA 36 -8.077 -4.695 -5.796 998 HB1 ALA 36 HB1 ALA 36 -10.570 -4.597 -5.928 999 HB2 ALA 36 HB2 ALA 36 -9.844 -5.944 -6.802 1000 HB3 ALA 36 HB3 ALA 36 -10.418 -4.528 -7.682 1001 H ALA 37 H ALA 37 -8.836 -3.049 -8.848 1002 HA ALA 37 HA ALA 37 -7.414 -4.844 -10.511 1003 HB1 ALA 37 HB1 ALA 37 -9.158 -3.409 -11.396 1004 HB2 ALA 37 HB2 ALA 37 -7.635 -3.096 -12.230 1005 HB3 ALA 37 HB3 ALA 37 -8.210 -1.977 -10.993 1006 H PHE 38 H PHE 38 -6.520 -1.922 -8.800 1007 HA PHE 38 HA PHE 38 -4.037 -1.470 -10.051 1008 HB2 PHE 38 HB2 PHE 38 -5.093 0.264 -8.733 1009 HB3 PHE 38 HB3 PHE 38 -5.033 -0.742 -7.289 1010 HD1 PHE 38 HD1 PHE 38 -2.712 0.674 -9.854 1011 HD2 PHE 38 HD2 PHE 38 -3.372 -0.322 -5.769 1012 HE1 PHE 38 HE1 PHE 38 -0.535 1.657 -9.260 1013 HE2 PHE 38 HE2 PHE 38 -1.198 0.658 -5.173 1014 HZ PHE 38 HZ PHE 38 0.223 1.650 -6.918 1015 H VAL 39 H VAL 39 -4.924 -3.304 -7.145 1016 HA VAL 39 HA VAL 39 -2.240 -4.066 -6.528 1017 HB VAL 39 HB VAL 39 -4.846 -5.298 -5.615 1018 HG11 VAL 39 HG11 VAL 39 -3.595 -6.344 -3.843 1019 HG12 VAL 39 HG12 VAL 39 -2.104 -5.568 -4.378 1020 HG13 VAL 39 HG13 VAL 39 -2.869 -6.796 -5.385 1021 HG21 VAL 39 HG21 VAL 39 -3.053 -3.300 -4.240 1022 HG22 VAL 39 HG22 VAL 39 -4.540 -3.995 -3.601 1023 HG23 VAL 39 HG23 VAL 39 -4.600 -2.934 -5.004 1024 H ASP 40 H ASP 40 -4.920 -5.541 -8.267 1025 HA ASP 40 HA ASP 40 -3.900 -8.105 -8.664 1026 HB2 ASP 40 HB2 ASP 40 -6.208 -7.136 -9.276 1027 HB3 ASP 40 HB3 ASP 40 -5.451 -6.597 -10.769 1028 H ASP 41 H ASP 41 -3.540 -5.189 -10.649 1029 HA ASP 41 HA ASP 41 -1.815 -6.406 -12.559 1030 HB2 ASP 41 HB2 ASP 41 -3.288 -4.299 -12.812 1031 HB3 ASP 41 HB3 ASP 41 -1.940 -3.449 -12.064 1032 H LYS 42 H LYS 42 -1.292 -4.708 -9.547 1033 HA LYS 42 HA LYS 42 1.429 -4.076 -9.864 1034 HB2 LYS 42 HB2 LYS 42 -0.250 -3.394 -7.995 1035 HB3 LYS 42 HB3 LYS 42 0.272 -4.878 -7.212 1036 HG2 LYS 42 HG2 LYS 42 1.795 -3.537 -6.258 1037 HG3 LYS 42 HG3 LYS 42 2.665 -3.775 -7.772 1038 HD2 LYS 42 HD2 LYS 42 0.688 -1.588 -7.778 1039 HD3 LYS 42 HD3 LYS 42 2.078 -1.353 -6.717 1040 HE2 LYS 42 HE2 LYS 42 2.358 -2.165 -9.599 1041 HE3 LYS 42 HE3 LYS 42 2.287 -0.478 -9.093 1042 HZ1 LYS 42 HZ1 LYS 42 4.211 -2.218 -7.740 1043 HZ2 LYS 42 HZ2 LYS 42 4.339 -0.574 -8.144 1044 HZ3 LYS 42 HZ3 LYS 42 4.556 -1.772 -9.339 1045 H MET 43 H MET 43 -0.183 -7.036 -8.878 1046 HA MET 43 HA MET 43 2.243 -8.372 -8.107 1047 HB2 MET 43 HB2 MET 43 -0.617 -9.051 -8.238 1048 HB3 MET 43 HB3 MET 43 0.466 -10.394 -8.565 1049 HG2 MET 43 HG2 MET 43 1.600 -9.999 -6.442 1050 HG3 MET 43 HG3 MET 43 0.511 -8.654 -6.111 1051 HE1 MET 43 HE1 MET 43 -2.027 -8.865 -5.712 1052 HE2 MET 43 HE2 MET 43 -2.925 -10.382 -5.646 1053 HE3 MET 43 HE3 MET 43 -2.310 -9.787 -7.188 1054 H HIS 44 H HIS 44 0.561 -7.843 -11.046 1055 HA HIS 44 HA HIS 44 1.367 -10.087 -12.535 1056 HB2 HIS 44 HB2 HIS 44 0.754 -7.268 -13.436 1057 HB3 HIS 44 HB3 HIS 44 1.035 -8.604 -14.542 1058 HD1 HIS 44 HD1 HIS 44 -1.629 -6.971 -14.388 1059 HD2 HIS 44 HD2 HIS 44 -0.951 -10.645 -12.554 1060 HE1 HIS 44 HE1 HIS 44 -3.900 -8.008 -14.082 1061 HE2 HIS 44 HE2 HIS 44 -3.476 -10.084 -12.727 1062 H GLU 45 H GLU 45 2.932 -6.932 -12.062 1063 HA GLU 45 HA GLU 45 5.063 -7.466 -13.852 1064 HB2 GLU 45 HB2 GLU 45 6.114 -5.483 -12.989 1065 HB3 GLU 45 HB3 GLU 45 4.395 -5.184 -13.196 1066 HG2 GLU 45 HG2 GLU 45 4.002 -5.195 -10.876 1067 HG3 GLU 45 HG3 GLU 45 5.555 -5.961 -10.534 1068 H PHE 46 H PHE 46 4.621 -8.068 -10.420 1069 HA PHE 46 HA PHE 46 7.383 -8.750 -10.018 1070 HB2 PHE 46 HB2 PHE 46 4.972 -8.580 -8.327 1071 HB3 PHE 46 HB3 PHE 46 6.168 -9.774 -7.831 1072 HD1 PHE 46 HD1 PHE 46 8.701 -8.714 -8.197 1073 HD2 PHE 46 HD2 PHE 46 5.149 -6.612 -7.175 1074 HE1 PHE 46 HE1 PHE 46 10.054 -6.951 -7.145 1075 HE2 PHE 46 HE2 PHE 46 6.490 -4.845 -6.119 1076 HZ PHE 46 HZ PHE 46 8.950 -5.014 -6.102 1077 H SER 47 H SER 47 4.451 -10.468 -10.813 1078 HA SER 47 HA SER 47 5.343 -13.075 -10.186 1079 HB2 SER 47 HB2 SER 47 2.962 -12.117 -10.895 1080 HB3 SER 47 HB3 SER 47 3.495 -12.634 -12.495 1081 HG SER 47 HG SER 47 3.921 -14.721 -11.508 1082 H GLU 48 H GLU 48 6.011 -10.917 -12.786 1083 HA GLU 48 HA GLU 48 7.021 -12.908 -14.596 1084 HB2 GLU 48 HB2 GLU 48 6.032 -10.707 -15.290 1085 HB3 GLU 48 HB3 GLU 48 7.456 -9.916 -14.637 1086 HG2 GLU 48 HG2 GLU 48 8.845 -11.220 -16.227 1087 HG3 GLU 48 HG3 GLU 48 7.362 -11.864 -16.928 1088 H LYS 49 H LYS 49 8.231 -11.203 -11.893 1089 HA LYS 49 HA LYS 49 11.014 -11.422 -12.689 1090 HB2 LYS 49 HB2 LYS 49 9.898 -10.544 -10.023 1091 HB3 LYS 49 HB3 LYS 49 11.528 -10.285 -10.624 1092 HG2 LYS 49 HG2 LYS 49 9.049 -9.092 -11.852 1093 HG3 LYS 49 HG3 LYS 49 10.103 -8.267 -10.704 1094 HD2 LYS 49 HD2 LYS 49 11.969 -8.450 -12.255 1095 HD3 LYS 49 HD3 LYS 49 10.957 -9.333 -13.396 1096 HE2 LYS 49 HE2 LYS 49 11.068 -7.078 -14.141 1097 HE3 LYS 49 HE3 LYS 49 9.453 -7.342 -13.482 1098 HZ1 LYS 49 HZ1 LYS 49 10.208 -6.297 -11.410 1099 HZ2 LYS 49 HZ2 LYS 49 10.306 -5.246 -12.729 1100 HZ3 LYS 49 HZ3 LYS 49 11.708 -5.973 -12.118 1101 H GLN 50 H GLN 50 8.819 -12.811 -10.290 1102 HA GLN 50 HA GLN 50 8.891 -14.702 -9.032 1103 HB2 GLN 50 HB2 GLN 50 10.759 -15.537 -11.249 1104 HB3 GLN 50 HB3 GLN 50 10.245 -16.622 -9.965 1105 HG2 GLN 50 HG2 GLN 50 8.030 -16.623 -10.692 1106 HG3 GLN 50 HG3 GLN 50 8.261 -15.181 -11.683 1107 HE21 GLN 50 HE21 GLN 50 7.248 -17.864 -12.355 1108 HE22 GLN 50 HE22 GLN 50 8.229 -18.405 -13.672 1109 HA PRO 51 HA PRO 51 12.824 -13.356 -6.994 1110 HB2 PRO 51 HB2 PRO 51 11.228 -12.856 -4.631 1111 HB3 PRO 51 HB3 PRO 51 12.169 -11.714 -5.586 1112 HG2 PRO 51 HG2 PRO 51 9.435 -11.726 -5.473 1113 HG3 PRO 51 HG3 PRO 51 10.368 -11.087 -6.838 1114 HD2 PRO 51 HD2 PRO 51 8.943 -13.699 -6.566 1115 HD3 PRO 51 HD3 PRO 51 9.114 -12.645 -7.986 1116 H MET 52 H MET 52 10.245 -14.773 -4.972 1117 HA MET 52 HA MET 52 12.203 -16.757 -4.042 1118 HB2 MET 52 HB2 MET 52 9.615 -15.939 -2.709 1119 HB3 MET 52 HB3 MET 52 10.858 -16.983 -2.035 1120 HG2 MET 52 HG2 MET 52 11.172 -14.059 -2.685 1121 HG3 MET 52 HG3 MET 52 10.942 -14.746 -1.077 1122 HE1 MET 52 HE1 MET 52 13.105 -13.271 -0.423 1123 HE2 MET 52 HE2 MET 52 13.390 -12.780 -2.090 1124 HE3 MET 52 HE3 MET 52 14.694 -13.499 -1.149 1125 H LEU 53 H LEU 53 9.858 -16.521 -6.258 1126 HA LEU 53 HA LEU 53 8.448 -17.938 -7.345 1127 HB2 LEU 53 HB2 LEU 53 10.521 -19.824 -6.259 1128 HB3 LEU 53 HB3 LEU 53 9.207 -20.391 -7.272 1129 HG LEU 53 HG LEU 53 10.974 -18.167 -8.228 1130 HD11 LEU 53 HD11 LEU 53 12.455 -19.783 -9.259 1131 HD12 LEU 53 HD12 LEU 53 11.565 -21.106 -8.509 1132 HD13 LEU 53 HD13 LEU 53 12.473 -19.976 -7.507 1133 HD21 LEU 53 HD21 LEU 53 10.364 -19.095 -10.408 1134 HD22 LEU 53 HD22 LEU 53 8.937 -18.668 -9.466 1135 HD23 LEU 53 HD23 LEU 53 9.428 -20.355 -9.607 1136 H ASP 54 H ASP 54 7.181 -17.154 -5.191 1137 HA ASP 54 HA ASP 54 5.586 -19.436 -4.466 1138 HB2 ASP 54 HB2 ASP 54 7.513 -19.339 -2.794 1139 HB3 ASP 54 HB3 ASP 54 6.801 -17.834 -2.223 1140 H VAL 55 H VAL 55 3.533 -18.853 -3.799 1141 HA VAL 55 HA VAL 55 2.556 -16.409 -4.759 1142 HB VAL 55 HB VAL 55 1.130 -18.272 -2.860 1143 HG11 VAL 55 HG11 VAL 55 0.058 -16.305 -4.880 1144 HG12 VAL 55 HG12 VAL 55 0.043 -16.100 -3.129 1145 HG13 VAL 55 HG13 VAL 55 -0.902 -17.388 -3.874 1146 HG21 VAL 55 HG21 VAL 55 2.023 -19.461 -4.821 1147 HG22 VAL 55 HG22 VAL 55 1.186 -18.321 -5.878 1148 HG23 VAL 55 HG23 VAL 55 0.260 -19.396 -4.826 1149 HA PRO 56 HA PRO 56 1.822 -15.007 -0.153 1150 HB2 PRO 56 HB2 PRO 56 3.566 -16.096 1.679 1151 HB3 PRO 56 HB3 PRO 56 1.902 -16.640 1.434 1152 HG2 PRO 56 HG2 PRO 56 4.450 -17.786 0.375 1153 HG3 PRO 56 HG3 PRO 56 3.016 -18.624 0.997 1154 HD2 PRO 56 HD2 PRO 56 3.497 -18.414 -1.637 1155 HD3 PRO 56 HD3 PRO 56 1.848 -18.355 -0.985 1156 H LYS 57 H LYS 57 5.027 -15.940 -1.236 1157 HA LYS 57 HA LYS 57 6.354 -13.744 0.010 1158 HB2 LYS 57 HB2 LYS 57 7.138 -15.820 -1.992 1159 HB3 LYS 57 HB3 LYS 57 8.182 -14.432 -1.728 1160 HG2 LYS 57 HG2 LYS 57 8.988 -16.198 -0.361 1161 HG3 LYS 57 HG3 LYS 57 8.212 -15.028 0.705 1162 HD2 LYS 57 HD2 LYS 57 6.305 -16.405 0.975 1163 HD3 LYS 57 HD3 LYS 57 6.788 -17.457 -0.352 1164 HE2 LYS 57 HE2 LYS 57 8.829 -18.038 1.022 1165 HE3 LYS 57 HE3 LYS 57 8.046 -17.206 2.366 1166 HZ1 LYS 57 HZ1 LYS 57 6.658 -19.359 0.882 1167 HZ2 LYS 57 HZ2 LYS 57 6.355 -18.779 2.449 1168 HZ3 LYS 57 HZ3 LYS 57 7.729 -19.714 2.151 1169 H LEU 58 H LEU 58 4.531 -14.133 -2.849 1170 HA LEU 58 HA LEU 58 5.686 -11.806 -4.164 1171 HB2 LEU 58 HB2 LEU 58 4.792 -14.006 -5.269 1172 HB3 LEU 58 HB3 LEU 58 3.223 -13.244 -5.092 1173 HG LEU 58 HG LEU 58 4.470 -11.234 -6.304 1174 HD11 LEU 58 HD11 LEU 58 6.007 -12.090 -8.011 1175 HD12 LEU 58 HD12 LEU 58 5.941 -13.684 -7.261 1176 HD13 LEU 58 HD13 LEU 58 6.635 -12.323 -6.381 1177 HD21 LEU 58 HD21 LEU 58 3.563 -12.052 -8.413 1178 HD22 LEU 58 HD22 LEU 58 2.445 -12.360 -7.089 1179 HD23 LEU 58 HD23 LEU 58 3.421 -13.675 -7.739 1180 H ALA 59 H ALA 59 2.753 -12.818 -2.521 1181 HA ALA 59 HA ALA 59 1.212 -10.511 -3.021 1182 HB1 ALA 59 HB1 ALA 59 1.052 -12.634 -0.899 1183 HB2 ALA 59 HB2 ALA 59 0.078 -12.474 -2.363 1184 HB3 ALA 59 HB3 ALA 59 -0.122 -11.323 -1.040 1185 H VAL 60 H VAL 60 3.448 -11.348 -0.411 1186 HA VAL 60 HA VAL 60 2.850 -8.967 1.086 1187 HB VAL 60 HB VAL 60 3.675 -11.032 2.190 1188 HG11 VAL 60 HG11 VAL 60 6.199 -11.363 2.137 1189 HG12 VAL 60 HG12 VAL 60 6.180 -10.392 0.666 1190 HG13 VAL 60 HG13 VAL 60 5.288 -11.910 0.734 1191 HG21 VAL 60 HG21 VAL 60 5.361 -8.562 2.554 1192 HG22 VAL 60 HG22 VAL 60 5.296 -9.907 3.689 1193 HG23 VAL 60 HG23 VAL 60 3.848 -8.949 3.376 1194 H LEU 61 H LEU 61 5.018 -9.853 -1.448 1195 HA LEU 61 HA LEU 61 6.936 -7.799 -1.081 1196 HB2 LEU 61 HB2 LEU 61 7.134 -9.958 -2.441 1197 HB3 LEU 61 HB3 LEU 61 6.257 -9.113 -3.700 1198 HG LEU 61 HG LEU 61 8.067 -7.399 -3.745 1199 HD11 LEU 61 HD11 LEU 61 9.238 -9.250 -1.696 1200 HD12 LEU 61 HD12 LEU 61 9.098 -7.491 -1.654 1201 HD13 LEU 61 HD13 LEU 61 10.266 -8.255 -2.729 1202 HD21 LEU 61 HD21 LEU 61 9.684 -8.831 -4.903 1203 HD22 LEU 61 HD22 LEU 61 8.025 -9.220 -5.352 1204 HD23 LEU 61 HD23 LEU 61 8.897 -10.255 -4.225 1205 H THR 62 H THR 62 3.887 -8.017 -2.789 1206 HA THR 62 HA THR 62 4.213 -5.536 -4.179 1207 HB THR 62 HB THR 62 1.526 -5.935 -4.185 1208 HG1 THR 62 HG1 THR 62 2.550 -8.574 -4.223 1209 HG21 THR 62 HG21 THR 62 1.793 -6.960 -6.330 1210 HG22 THR 62 HG22 THR 62 3.427 -7.485 -5.928 1211 HG23 THR 62 HG23 THR 62 3.076 -5.766 -6.134 1212 H ALA 63 H ALA 63 2.671 -6.607 -1.209 1213 HA ALA 63 HA ALA 63 1.255 -4.301 -0.540 1214 HB1 ALA 63 HB1 ALA 63 1.160 -5.167 1.680 1215 HB2 ALA 63 HB2 ALA 63 2.606 -6.144 1.424 1216 HB3 ALA 63 HB3 ALA 63 1.111 -6.546 0.580 1217 H VAL 64 H VAL 64 4.582 -5.251 0.292 1218 HA VAL 64 HA VAL 64 5.110 -2.869 1.754 1219 HB VAL 64 HB VAL 64 6.303 -5.048 2.070 1220 HG11 VAL 64 HG11 VAL 64 7.757 -4.218 -0.432 1221 HG12 VAL 64 HG12 VAL 64 6.740 -5.642 -0.222 1222 HG13 VAL 64 HG13 VAL 64 8.260 -5.507 0.661 1223 HG21 VAL 64 HG21 VAL 64 8.505 -4.005 2.509 1224 HG22 VAL 64 HG22 VAL 64 7.143 -3.077 3.131 1225 HG23 VAL 64 HG23 VAL 64 7.954 -2.567 1.651 1226 H GLN 65 H GLN 65 5.385 -3.737 -1.610 1227 HA GLN 65 HA GLN 65 7.113 -1.597 -2.350 1228 HB2 GLN 65 HB2 GLN 65 6.727 -3.669 -3.723 1229 HB3 GLN 65 HB3 GLN 65 5.133 -3.039 -4.121 1230 HG2 GLN 65 HG2 GLN 65 6.452 -0.936 -4.915 1231 HG3 GLN 65 HG3 GLN 65 7.819 -2.050 -4.977 1232 HE21 GLN 65 HE21 GLN 65 7.951 -1.854 -7.225 1233 HE22 GLN 65 HE22 GLN 65 6.802 -2.600 -8.277 1234 H ILE 66 H ILE 66 3.603 -2.079 -2.525 1235 HA ILE 66 HA ILE 66 2.923 0.397 -3.635 1236 HB ILE 66 HB ILE 66 1.354 -1.385 -1.764 1237 HG12 ILE 66 HG12 ILE 66 1.051 -0.940 -4.739 1238 HG13 ILE 66 HG13 ILE 66 2.019 -2.239 -4.051 1239 HG21 ILE 66 HG21 ILE 66 0.241 0.862 -3.432 1240 HG22 ILE 66 HG22 ILE 66 0.623 1.021 -1.719 1241 HG23 ILE 66 HG23 ILE 66 -0.608 -0.125 -2.242 1242 HD11 ILE 66 HD11 ILE 66 -0.954 -1.851 -3.811 1243 HD12 ILE 66 HD12 ILE 66 -0.038 -3.056 -2.905 1244 HD13 ILE 66 HD13 ILE 66 -0.097 -3.134 -4.667 1245 H ALA 67 H ALA 67 3.432 -0.582 -0.286 1246 HA ALA 67 HA ALA 67 2.591 1.760 0.983 1247 HB1 ALA 67 HB1 ALA 67 3.977 1.034 2.867 1248 HB2 ALA 67 HB2 ALA 67 4.773 -0.147 1.828 1249 HB3 ALA 67 HB3 ALA 67 3.055 -0.308 2.193 1250 H SER 68 H SER 68 5.756 0.844 -0.327 1251 HA SER 68 HA SER 68 7.083 3.224 0.480 1252 HB2 SER 68 HB2 SER 68 8.219 1.056 -0.069 1253 HB3 SER 68 HB3 SER 68 7.846 1.343 -1.771 1254 HG SER 68 HG SER 68 9.933 2.208 -0.433 1255 H GLU 69 H GLU 69 5.258 2.301 -2.361 1256 HA GLU 69 HA GLU 69 6.065 4.445 -4.030 1257 HB2 GLU 69 HB2 GLU 69 3.718 2.564 -4.055 1258 HB3 GLU 69 HB3 GLU 69 3.830 3.884 -5.210 1259 HG2 GLU 69 HG2 GLU 69 6.060 2.966 -5.896 1260 HG3 GLU 69 HG3 GLU 69 5.716 1.566 -4.884 1261 H TYR 70 H TYR 70 3.480 4.079 -1.656 1262 HA TYR 70 HA TYR 70 2.457 6.726 -2.344 1263 HB2 TYR 70 HB2 TYR 70 1.395 4.465 -0.678 1264 HB3 TYR 70 HB3 TYR 70 0.696 6.078 -0.571 1265 HD1 TYR 70 HD2 TYR 70 1.359 3.262 -2.876 1266 HD2 TYR 70 HD1 TYR 70 -0.777 6.885 -2.240 1267 HE1 TYR 70 HE2 TYR 70 -0.011 2.794 -4.860 1268 HE2 TYR 70 HE1 TYR 70 -2.155 6.425 -4.224 1269 HH TYR 70 HH TYR 70 -2.273 3.421 -5.727 1270 H LEU 71 H LEU 71 4.338 5.201 0.158 1271 HA LEU 71 HA LEU 71 3.842 6.987 2.259 1272 HB2 LEU 71 HB2 LEU 71 5.083 4.817 2.419 1273 HB3 LEU 71 HB3 LEU 71 6.450 5.606 1.657 1274 HG LEU 71 HG LEU 71 6.597 7.176 3.573 1275 HD11 LEU 71 HD11 LEU 71 5.378 6.486 5.672 1276 HD12 LEU 71 HD12 LEU 71 4.327 5.516 4.643 1277 HD13 LEU 71 HD13 LEU 71 4.403 7.268 4.434 1278 HD21 LEU 71 HD21 LEU 71 7.542 5.628 5.157 1279 HD22 LEU 71 HD22 LEU 71 7.944 5.107 3.525 1280 HD23 LEU 71 HD23 LEU 71 6.668 4.286 4.426 1281 H LYS 72 H LYS 72 6.047 7.190 -0.467 1282 HA LYS 72 HA LYS 72 7.462 9.473 0.429 1283 HB2 LYS 72 HB2 LYS 72 8.143 9.714 -1.964 1284 HB3 LYS 72 HB3 LYS 72 8.437 8.117 -1.289 1285 HG2 LYS 72 HG2 LYS 72 6.695 7.149 -2.506 1286 HG3 LYS 72 HG3 LYS 72 5.953 8.710 -2.857 1287 HD2 LYS 72 HD2 LYS 72 7.087 7.723 -4.813 1288 HD3 LYS 72 HD3 LYS 72 7.782 9.277 -4.340 1289 HE2 LYS 72 HE2 LYS 72 9.507 7.609 -4.888 1290 HE3 LYS 72 HE3 LYS 72 9.606 8.161 -3.220 1291 HZ1 LYS 72 HZ1 LYS 72 8.571 5.562 -4.204 1292 HZ2 LYS 72 HZ2 LYS 72 8.311 6.101 -2.624 1293 HZ3 LYS 72 HZ3 LYS 72 9.892 5.839 -3.176 1294 H LEU 73 H LEU 73 4.367 9.058 -1.045 1295 HA LEU 73 HA LEU 73 4.110 11.708 -2.071 1296 HB2 LEU 73 HB2 LEU 73 2.798 9.541 -2.695 1297 HB3 LEU 73 HB3 LEU 73 1.791 9.945 -1.322 1298 HG LEU 73 HG LEU 73 0.845 10.643 -3.510 1299 HD11 LEU 73 HD11 LEU 73 0.151 12.855 -2.847 1300 HD12 LEU 73 HD12 LEU 73 1.475 12.955 -1.690 1301 HD13 LEU 73 HD13 LEU 73 0.180 11.782 -1.447 1302 HD21 LEU 73 HD21 LEU 73 2.878 12.833 -3.616 1303 HD22 LEU 73 HD22 LEU 73 1.778 12.265 -4.870 1304 HD23 LEU 73 HD23 LEU 73 3.170 11.286 -4.408 1305 H LYS 74 H LYS 74 2.938 10.053 0.863 1306 HA LYS 74 HA LYS 74 1.662 12.363 1.901 1307 HB2 LYS 74 HB2 LYS 74 1.392 11.141 3.954 1308 HB3 LYS 74 HB3 LYS 74 1.105 10.045 2.613 1309 HG2 LYS 74 HG2 LYS 74 2.517 8.640 3.582 1310 HG3 LYS 74 HG3 LYS 74 3.813 9.764 3.170 1311 HD2 LYS 74 HD2 LYS 74 4.047 9.395 5.478 1312 HD3 LYS 74 HD3 LYS 74 3.241 10.958 5.356 1313 HE2 LYS 74 HE2 LYS 74 1.101 9.944 5.838 1314 HE3 LYS 74 HE3 LYS 74 1.824 8.336 5.819 1315 HZ1 LYS 74 HZ1 LYS 74 2.652 10.445 7.726 1316 HZ2 LYS 74 HZ2 LYS 74 3.018 8.796 7.785 1317 HZ3 LYS 74 HZ3 LYS 74 1.436 9.323 8.067 1318 H GLU 75 H GLU 75 4.918 11.321 1.794 1319 HA GLU 75 HA GLU 75 5.928 12.759 4.020 1320 HB2 GLU 75 HB2 GLU 75 7.097 10.869 2.875 1321 HB3 GLU 75 HB3 GLU 75 7.388 11.932 1.504 1322 HG2 GLU 75 HG2 GLU 75 9.342 11.735 2.957 1323 HG3 GLU 75 HG3 GLU 75 8.739 13.388 2.873 1324 H GLU 76 H GLU 76 6.032 13.441 0.510 1325 HA GLU 76 HA GLU 76 7.082 16.046 0.826 1326 HB2 GLU 76 HB2 GLU 76 6.688 16.347 -1.503 1327 HB3 GLU 76 HB3 GLU 76 7.177 14.676 -1.277 1328 HG2 GLU 76 HG2 GLU 76 5.006 13.873 -1.663 1329 HG3 GLU 76 HG3 GLU 76 4.291 15.471 -1.452 1330 H TYR 77 H TYR 77 3.858 14.737 0.805 1331 HA TYR 77 HA TYR 77 2.317 17.005 0.402 1332 HB2 TYR 77 HB2 TYR 77 1.265 14.851 0.490 1333 HB3 TYR 77 HB3 TYR 77 1.842 14.573 2.130 1334 HD1 TYR 77 HD2 TYR 77 -0.096 17.269 0.399 1335 HD2 TYR 77 HD1 TYR 77 0.180 14.617 3.707 1336 HE1 TYR 77 HE2 TYR 77 -2.198 18.185 1.287 1337 HE2 TYR 77 HE1 TYR 77 -1.922 15.516 4.616 1338 HH TYR 77 HH TYR 77 -4.089 16.765 3.390 1339 H GLN 78 H GLN 78 3.822 15.798 3.353 1340 HA GLN 78 HA GLN 78 2.705 17.831 5.026 1341 HB2 GLN 78 HB2 GLN 78 4.874 15.779 5.372 1342 HB3 GLN 78 HB3 GLN 78 4.571 16.996 6.605 1343 HG2 GLN 78 HG2 GLN 78 2.466 15.117 5.567 1344 HG3 GLN 78 HG3 GLN 78 3.463 14.786 6.983 1345 HE21 GLN 78 HE21 GLN 78 0.830 16.575 5.695 1346 HE22 GLN 78 HE22 GLN 78 0.306 17.297 7.176 1347 H ARG 79 H ARG 79 5.818 17.348 3.425 1348 HA ARG 79 HA ARG 79 7.153 19.513 4.628 1349 HB2 ARG 79 HB2 ARG 79 7.744 18.350 1.913 1350 HB3 ARG 79 HB3 ARG 79 8.847 19.256 2.933 1351 HG2 ARG 79 HG2 ARG 79 7.806 16.466 3.339 1352 HG3 ARG 79 HG3 ARG 79 9.469 16.994 3.121 1353 HD2 ARG 79 HD2 ARG 79 9.706 17.594 5.291 1354 HD3 ARG 79 HD3 ARG 79 8.034 18.123 5.441 1355 HE ARG 79 HE ARG 79 8.675 15.250 5.312 1356 HH11 ARG 79 HH11 ARG 79 7.381 17.997 7.094 1357 HH12 ARG 79 HH12 ARG 79 6.568 16.993 8.257 1358 HH21 ARG 79 HH21 ARG 79 7.625 13.961 6.823 1359 HH22 ARG 79 HH22 ARG 79 6.716 14.691 8.116 1360 H LEU 80 H LEU 80 5.521 19.357 1.441 1361 HA LEU 80 HA LEU 80 6.156 22.089 0.881 1362 HB2 LEU 80 HB2 LEU 80 5.452 21.663 -1.190 1363 HB3 LEU 80 HB3 LEU 80 5.402 19.993 -0.664 1364 HG LEU 80 HG LEU 80 2.946 21.625 -0.249 1365 HD11 LEU 80 HD11 LEU 80 3.552 22.280 -2.503 1366 HD12 LEU 80 HD12 LEU 80 2.198 21.152 -2.551 1367 HD13 LEU 80 HD13 LEU 80 3.822 20.594 -2.947 1368 HD21 LEU 80 HD21 LEU 80 3.287 18.827 -1.292 1369 HD22 LEU 80 HD22 LEU 80 1.851 19.560 -0.572 1370 HD23 LEU 80 HD23 LEU 80 3.261 19.216 0.428 1371 H ARG 81 H ARG 81 3.821 20.753 2.915 1372 HA ARG 81 HA ARG 81 2.041 23.052 2.531 1373 HB2 ARG 81 HB2 ARG 81 1.672 20.464 4.029 1374 HB3 ARG 81 HB3 ARG 81 0.552 21.811 4.172 1375 HG2 ARG 81 HG2 ARG 81 1.255 20.603 1.520 1376 HG3 ARG 81 HG3 ARG 81 -0.043 19.967 2.529 1377 HD2 ARG 81 HD2 ARG 81 -0.941 21.493 0.874 1378 HD3 ARG 81 HD3 ARG 81 -1.133 22.168 2.488 1379 HE ARG 81 HE ARG 81 1.114 22.999 0.784 1380 HH11 ARG 81 HH11 ARG 81 -1.772 23.779 2.606 1381 HH12 ARG 81 HH12 ARG 81 -1.577 25.492 2.419 1382 HH21 ARG 81 HH21 ARG 81 1.375 25.259 0.554 1383 HH22 ARG 81 HH22 ARG 81 0.214 26.335 1.262 1384 H GLU 82 H GLU 82 4.015 21.458 5.002 1385 HA GLU 82 HA GLU 82 3.367 23.309 7.060 1386 HB2 GLU 82 HB2 GLU 82 5.045 22.252 8.351 1387 HB3 GLU 82 HB3 GLU 82 4.323 20.982 7.373 1388 HG2 GLU 82 HG2 GLU 82 6.195 21.074 5.835 1389 HG3 GLU 82 HG3 GLU 82 6.905 22.399 6.749 1390 H GLN 83 H GLN 83 5.453 23.397 4.378 1391 HA GLN 83 HA GLN 83 7.381 25.257 5.322 1392 HB2 GLN 83 HB2 GLN 83 7.273 23.687 3.162 1393 HB3 GLN 83 HB3 GLN 83 6.653 25.162 2.432 1394 HG2 GLN 83 HG2 GLN 83 8.644 26.337 2.899 1395 HG3 GLN 83 HG3 GLN 83 9.237 25.057 3.963 1396 HE21 GLN 83 HE21 GLN 83 10.057 23.168 3.060 1397 HE22 GLN 83 HE22 GLN 83 10.502 23.060 1.393 1398 H LEU 84 H LEU 84 4.123 25.528 4.396 1399 HA LEU 84 HA LEU 84 4.345 28.390 3.823 1400 HB2 LEU 84 HB2 LEU 84 2.637 26.277 2.916 1401 HB3 LEU 84 HB3 LEU 84 1.653 27.494 3.700 1402 HG LEU 84 HG LEU 84 1.752 27.885 1.304 1403 HD11 LEU 84 HD11 LEU 84 2.368 30.204 1.290 1404 HD12 LEU 84 HD12 LEU 84 3.365 29.995 2.726 1405 HD13 LEU 84 HD13 LEU 84 1.614 29.826 2.839 1406 HD21 LEU 84 HD21 LEU 84 3.869 26.868 0.756 1407 HD22 LEU 84 HD22 LEU 84 4.736 28.088 1.688 1408 HD23 LEU 84 HD23 LEU 84 3.872 28.549 0.223 1409 H LYS 85 H LYS 85 4.328 26.727 6.495 1410 HA LYS 85 HA LYS 85 2.174 28.194 7.836 1411 HB2 LYS 85 HB2 LYS 85 3.739 25.736 8.494 1412 HB3 LYS 85 HB3 LYS 85 3.048 26.677 9.812 1413 HG2 LYS 85 HG2 LYS 85 0.829 26.412 8.887 1414 HG3 LYS 85 HG3 LYS 85 1.485 25.564 7.487 1415 HD2 LYS 85 HD2 LYS 85 2.058 23.676 8.758 1416 HD3 LYS 85 HD3 LYS 85 1.945 24.555 10.281 1417 HE2 LYS 85 HE2 LYS 85 0.061 22.999 9.901 1418 HE3 LYS 85 HE3 LYS 85 -0.447 24.676 10.089 1419 HZ1 LYS 85 HZ1 LYS 85 -0.569 24.821 7.642 1420 HZ2 LYS 85 HZ2 LYS 85 -1.643 23.691 8.294 1421 HZ3 LYS 85 HZ3 LYS 85 -0.225 23.165 7.543 1422 H LYS 86 H LYS 86 5.203 27.143 9.299 1423 HA LYS 86 HA LYS 86 6.404 29.708 9.405 1424 HB2 LYS 86 HB2 LYS 86 6.144 30.103 11.837 1425 HB3 LYS 86 HB3 LYS 86 4.616 30.218 10.978 1426 HG2 LYS 86 HG2 LYS 86 3.773 28.327 11.938 1427 HG3 LYS 86 HG3 LYS 86 5.365 27.608 12.188 1428 HD2 LYS 86 HD2 LYS 86 4.637 30.092 13.674 1429 HD3 LYS 86 HD3 LYS 86 3.966 28.549 14.204 1430 HE2 LYS 86 HE2 LYS 86 5.974 28.961 15.438 1431 HE3 LYS 86 HE3 LYS 86 6.275 27.641 14.312 1432 HZ1 LYS 86 HZ1 LYS 86 8.049 29.394 14.496 1433 HZ2 LYS 86 HZ2 LYS 86 6.994 30.442 13.691 1434 HZ3 LYS 86 HZ3 LYS 86 7.533 29.031 12.921 Start of MODEL 15 1 H1 GLY 1 H1 GLY 1 27.483 -5.533 -6.887 2 H2 GLY 1 H2 GLY 1 28.928 -6.399 -7.026 3 H3 GLY 1 H3 GLY 1 27.661 -6.691 -8.104 4 HA2 GLY 1 HA3 GLY 1 29.065 -4.095 -7.887 5 HA3 GLY 1 HA2 GLY 1 29.493 -5.339 -9.053 6 H SER 2 H SER 2 27.967 -2.520 -8.843 7 HA SER 2 HA SER 2 25.608 -3.202 -10.386 8 HB2 SER 2 HB2 SER 2 26.635 -0.446 -9.685 9 HB3 SER 2 HB3 SER 2 24.997 -0.889 -10.166 10 HG SER 2 HG SER 2 25.892 -2.302 -8.001 11 H HIS 3 H HIS 3 28.772 -1.752 -10.860 12 HA HIS 3 HA HIS 3 29.930 -1.094 -12.702 13 HB2 HIS 3 HB2 HIS 3 28.240 -3.323 -13.803 14 HB3 HIS 3 HB3 HIS 3 29.377 -2.453 -14.825 15 HD1 HIS 3 HD1 HIS 3 31.932 -2.698 -14.209 16 HD2 HIS 3 HD2 HIS 3 29.345 -5.221 -12.146 17 HE1 HIS 3 HE1 HIS 3 33.394 -4.458 -13.155 18 HE2 HIS 3 HE2 HIS 3 31.792 -6.058 -12.050 19 H MET 4 H MET 4 27.999 0.674 -12.094 20 HA MET 4 HA MET 4 27.214 1.681 -14.725 21 HB2 MET 4 HB2 MET 4 25.296 0.427 -13.658 22 HB3 MET 4 HB3 MET 4 25.313 1.624 -12.375 23 HG2 MET 4 HG2 MET 4 24.687 3.360 -13.896 24 HG3 MET 4 HG3 MET 4 24.882 2.283 -15.280 25 HE1 MET 4 HE1 MET 4 22.093 4.018 -14.632 26 HE2 MET 4 HE2 MET 4 21.016 2.773 -15.258 27 HE3 MET 4 HE3 MET 4 22.541 3.109 -16.077 28 H THR 5 H THR 5 27.650 3.808 -14.929 29 HA THR 5 HA THR 5 28.871 5.219 -12.762 30 HB THR 5 HB THR 5 27.963 6.532 -15.306 31 HG1 THR 5 HG1 THR 5 29.605 5.599 -16.409 32 HG21 THR 5 HG21 THR 5 30.016 7.819 -15.022 33 HG22 THR 5 HG22 THR 5 30.439 6.853 -13.608 34 HG23 THR 5 HG23 THR 5 29.026 7.908 -13.565 35 H GLU 6 H GLU 6 25.792 5.416 -14.476 36 HA GLU 6 HA GLU 6 24.830 7.675 -13.037 37 HB2 GLU 6 HB2 GLU 6 23.995 7.025 -15.273 38 HB3 GLU 6 HB3 GLU 6 23.298 5.571 -14.575 39 HG2 GLU 6 HG2 GLU 6 21.588 7.232 -14.903 40 HG3 GLU 6 HG3 GLU 6 21.831 6.955 -13.181 41 H GLN 7 H GLN 7 23.340 7.749 -11.344 42 HA GLN 7 HA GLN 7 23.159 5.255 -9.796 43 HB2 GLN 7 HB2 GLN 7 24.392 7.206 -8.769 44 HB3 GLN 7 HB3 GLN 7 22.857 8.065 -8.729 45 HG2 GLN 7 HG2 GLN 7 21.917 6.343 -7.291 46 HG3 GLN 7 HG3 GLN 7 23.439 5.455 -7.346 47 HE21 GLN 7 HE21 GLN 7 23.782 5.553 -5.164 48 HE22 GLN 7 HE22 GLN 7 24.197 7.020 -4.346 49 HA PRO 8 HA PRO 8 18.805 5.955 -10.863 50 HB2 PRO 8 HB2 PRO 8 18.439 3.124 -10.913 51 HB3 PRO 8 HB3 PRO 8 18.553 4.218 -12.294 52 HG2 PRO 8 HG2 PRO 8 20.413 2.265 -11.632 53 HG3 PRO 8 HG3 PRO 8 20.718 3.652 -12.687 54 HD2 PRO 8 HD2 PRO 8 21.408 3.272 -9.806 55 HD3 PRO 8 HD3 PRO 8 22.325 4.088 -11.094 56 H LYS 9 H LYS 9 16.863 4.343 -9.959 57 HA LYS 9 HA LYS 9 16.642 4.918 -7.237 58 HB2 LYS 9 HB2 LYS 9 14.636 3.524 -7.270 59 HB3 LYS 9 HB3 LYS 9 14.708 4.537 -8.704 60 HG2 LYS 9 HG2 LYS 9 15.767 2.464 -9.831 61 HG3 LYS 9 HG3 LYS 9 15.108 1.581 -8.457 62 HD2 LYS 9 HD2 LYS 9 12.864 2.499 -9.013 63 HD3 LYS 9 HD3 LYS 9 13.568 3.248 -10.449 64 HE2 LYS 9 HE2 LYS 9 14.304 0.960 -11.170 65 HE3 LYS 9 HE3 LYS 9 13.373 0.300 -9.824 66 HZ1 LYS 9 HZ1 LYS 9 12.199 0.307 -11.991 67 HZ2 LYS 9 HZ2 LYS 9 12.210 1.995 -11.961 68 HZ3 LYS 9 HZ3 LYS 9 11.373 1.134 -10.772 69 H THR 10 H THR 10 17.537 3.982 -5.507 70 HA THR 10 HA THR 10 19.074 1.572 -5.832 71 HB THR 10 HB THR 10 19.831 3.527 -4.427 72 HG1 THR 10 HG1 THR 10 21.006 2.159 -3.275 73 HG21 THR 10 HG21 THR 10 19.009 3.644 -2.108 74 HG22 THR 10 HG22 THR 10 17.769 2.452 -2.500 75 HG23 THR 10 HG23 THR 10 17.750 4.036 -3.278 76 H ARG 11 H ARG 11 18.867 -0.280 -4.423 77 HA ARG 11 HA ARG 11 16.073 -0.788 -3.653 78 HB2 ARG 11 HB2 ARG 11 18.091 -2.675 -4.872 79 HB3 ARG 11 HB3 ARG 11 16.582 -3.210 -4.146 80 HG2 ARG 11 HG2 ARG 11 15.315 -1.939 -5.767 81 HG3 ARG 11 HG3 ARG 11 16.809 -1.316 -6.473 82 HD2 ARG 11 HD2 ARG 11 16.087 -4.237 -6.324 83 HD3 ARG 11 HD3 ARG 11 15.786 -3.213 -7.727 84 HE ARG 11 HE ARG 11 18.482 -2.964 -7.094 85 HH11 ARG 11 HH11 ARG 11 16.296 -5.511 -8.099 86 HH12 ARG 11 HH12 ARG 11 17.508 -6.364 -9.005 87 HH21 ARG 11 HH21 ARG 11 20.084 -4.099 -8.260 88 HH22 ARG 11 HH22 ARG 11 19.664 -5.565 -9.088 89 H VAL 12 H VAL 12 15.711 -2.029 -1.798 90 HA VAL 12 HA VAL 12 18.059 -2.420 -0.066 91 HB VAL 12 HB VAL 12 16.829 -0.345 0.543 92 HG11 VAL 12 HG11 VAL 12 14.594 -0.782 -0.010 93 HG12 VAL 12 HG12 VAL 12 14.617 -0.704 1.751 94 HG13 VAL 12 HG13 VAL 12 14.556 -2.268 0.937 95 HG21 VAL 12 HG21 VAL 12 18.103 -1.487 2.244 96 HG22 VAL 12 HG22 VAL 12 16.749 -2.563 2.584 97 HG23 VAL 12 HG23 VAL 12 16.621 -0.843 2.952 98 H SER 13 H SER 13 17.934 -4.149 1.382 99 HA SER 13 HA SER 13 15.854 -6.114 0.744 100 HB2 SER 13 HB2 SER 13 18.480 -6.594 2.172 101 HB3 SER 13 HB3 SER 13 17.396 -7.805 1.486 102 HG SER 13 HG SER 13 18.116 -5.967 -0.370 103 H VAL 14 H VAL 14 14.213 -6.126 2.161 104 HA VAL 14 HA VAL 14 14.837 -5.646 5.003 105 HB VAL 14 HB VAL 14 12.496 -4.859 5.269 106 HG11 VAL 14 HG11 VAL 14 14.355 -3.285 5.035 107 HG12 VAL 14 HG12 VAL 14 12.856 -2.645 4.360 108 HG13 VAL 14 HG13 VAL 14 14.109 -3.269 3.289 109 HG21 VAL 14 HG21 VAL 14 11.113 -4.339 3.414 110 HG22 VAL 14 HG22 VAL 14 11.668 -5.995 3.174 111 HG23 VAL 14 HG23 VAL 14 12.407 -4.675 2.268 112 H ARG 15 H ARG 15 13.370 -6.705 6.533 113 HA ARG 15 HA ARG 15 12.580 -9.345 5.513 114 HB2 ARG 15 HB2 ARG 15 14.419 -9.278 7.201 115 HB3 ARG 15 HB3 ARG 15 13.283 -8.585 8.350 116 HG2 ARG 15 HG2 ARG 15 12.061 -10.556 8.521 117 HG3 ARG 15 HG3 ARG 15 12.715 -11.203 7.016 118 HD2 ARG 15 HD2 ARG 15 14.173 -10.838 9.626 119 HD3 ARG 15 HD3 ARG 15 13.707 -12.365 8.875 120 HE ARG 15 HE ARG 15 15.876 -10.581 8.038 121 HH11 ARG 15 HH11 ARG 15 14.085 -13.561 7.532 122 HH12 ARG 15 HH12 ARG 15 15.309 -14.257 6.513 123 HH21 ARG 15 HH21 ARG 15 17.475 -11.507 6.711 124 HH22 ARG 15 HH22 ARG 15 17.231 -13.096 6.054 125 H ILE 16 H ILE 16 10.493 -9.861 5.512 126 HA ILE 16 HA ILE 16 8.688 -8.525 7.421 127 HB ILE 16 HB ILE 16 7.801 -9.139 4.613 128 HG12 ILE 16 HG12 ILE 16 8.604 -6.371 5.460 129 HG13 ILE 16 HG13 ILE 16 9.793 -7.473 4.773 130 HG21 ILE 16 HG21 ILE 16 6.028 -7.571 5.107 131 HG22 ILE 16 HG22 ILE 16 6.756 -7.208 6.672 132 HG23 ILE 16 HG23 ILE 16 6.104 -8.815 6.355 133 HD11 ILE 16 HD11 ILE 16 8.387 -7.686 2.768 134 HD12 ILE 16 HD12 ILE 16 8.922 -6.031 3.065 135 HD13 ILE 16 HD13 ILE 16 7.270 -6.508 3.456 136 H TYR 17 H TYR 17 7.433 -9.907 8.494 137 HA TYR 17 HA TYR 17 6.441 -11.801 9.211 138 HB2 TYR 17 HB2 TYR 17 5.553 -11.472 6.668 139 HB3 TYR 17 HB3 TYR 17 6.256 -13.080 6.560 140 HD1 TYR 17 HD2 TYR 17 4.301 -11.316 9.224 141 HD2 TYR 17 HD1 TYR 17 4.594 -14.689 6.644 142 HE1 TYR 17 HE2 TYR 17 2.267 -12.258 10.236 143 HE2 TYR 17 HE1 TYR 17 2.560 -15.640 7.652 144 HH TYR 17 HH TYR 17 0.532 -13.832 9.793 145 H GLY 18 H GLY 18 9.429 -11.715 8.589 146 HA2 GLY 18 HA2 GLY 18 10.846 -13.383 9.628 147 HA3 GLY 18 HA3 GLY 18 9.823 -14.618 8.922 148 H GLN 19 H GLN 19 9.816 -13.243 6.266 149 HA GLN 19 HA GLN 19 12.453 -14.249 5.457 150 HB2 GLN 19 HB2 GLN 19 10.032 -13.716 3.732 151 HB3 GLN 19 HB3 GLN 19 11.520 -14.505 3.228 152 HG2 GLN 19 HG2 GLN 19 9.490 -15.541 5.187 153 HG3 GLN 19 HG3 GLN 19 9.837 -16.159 3.574 154 HE21 GLN 19 HE21 GLN 19 9.926 -17.443 6.214 155 HE22 GLN 19 HE22 GLN 19 11.522 -18.095 6.358 156 H ASP 20 H ASP 20 13.589 -13.165 3.711 157 HA ASP 20 HA ASP 20 13.341 -10.252 3.953 158 HB2 ASP 20 HB2 ASP 20 15.649 -10.078 3.357 159 HB3 ASP 20 HB3 ASP 20 15.522 -11.337 4.579 160 H TYR 21 H TYR 21 13.171 -8.930 2.205 161 HA TYR 21 HA TYR 21 12.958 -10.201 -0.448 162 HB2 TYR 21 HB2 TYR 21 11.058 -8.063 0.530 163 HB3 TYR 21 HB3 TYR 21 10.948 -9.001 -0.956 164 HD1 TYR 21 HD2 TYR 21 10.445 -9.041 2.670 165 HD2 TYR 21 HD1 TYR 21 10.110 -11.276 -0.934 166 HE1 TYR 21 HE2 TYR 21 9.061 -10.708 3.835 167 HE2 TYR 21 HE1 TYR 21 8.725 -12.945 0.223 168 HH TYR 21 HH TYR 21 7.585 -12.444 3.493 169 H THR 22 H THR 22 13.508 -8.883 -2.210 170 HA THR 22 HA THR 22 15.111 -6.534 -1.493 171 HB THR 22 HB THR 22 15.028 -7.706 -4.256 172 HG1 THR 22 HG1 THR 22 15.953 -8.946 -1.951 173 HG21 THR 22 HG21 THR 22 16.277 -5.638 -3.893 174 HG22 THR 22 HG22 THR 22 17.379 -6.962 -4.269 175 HG23 THR 22 HG23 THR 22 17.207 -6.406 -2.606 176 H ILE 23 H ILE 23 13.843 -4.771 -1.451 177 HA ILE 23 HA ILE 23 11.969 -4.371 -3.697 178 HB ILE 23 HB ILE 23 10.671 -2.888 -2.223 179 HG12 ILE 23 HG12 ILE 23 12.448 -3.893 0.013 180 HG13 ILE 23 HG13 ILE 23 12.603 -2.300 -0.713 181 HG21 ILE 23 HG21 ILE 23 10.089 -5.260 -2.460 182 HG22 ILE 23 HG22 ILE 23 9.654 -4.634 -0.873 183 HG23 ILE 23 HG23 ILE 23 11.090 -5.637 -1.057 184 HD11 ILE 23 HD11 ILE 23 11.375 -1.909 1.202 185 HD12 ILE 23 HD12 ILE 23 10.432 -3.386 1.017 186 HD13 ILE 23 HD13 ILE 23 10.132 -2.011 -0.047 187 H VAL 24 H VAL 24 11.536 -2.040 -4.168 188 HA VAL 24 HA VAL 24 14.063 -0.672 -4.503 189 HB VAL 24 HB VAL 24 11.316 0.191 -5.417 190 HG11 VAL 24 HG11 VAL 24 13.105 1.943 -5.296 191 HG12 VAL 24 HG12 VAL 24 12.421 1.683 -6.899 192 HG13 VAL 24 HG13 VAL 24 14.002 1.013 -6.497 193 HG21 VAL 24 HG21 VAL 24 11.937 -0.721 -7.609 194 HG22 VAL 24 HG22 VAL 24 11.869 -1.980 -6.377 195 HG23 VAL 24 HG23 VAL 24 13.428 -1.358 -6.918 196 H GLY 25 H GLY 25 14.722 1.094 -3.377 197 HA2 GLY 25 HA2 GLY 25 12.746 2.363 -1.591 198 HA3 GLY 25 HA3 GLY 25 14.315 1.854 -0.979 199 H ALA 26 H ALA 26 12.971 3.784 -3.667 200 HA ALA 26 HA ALA 26 15.315 5.464 -3.739 201 HB1 ALA 26 HB1 ALA 26 12.665 5.774 -5.146 202 HB2 ALA 26 HB2 ALA 26 14.084 4.945 -5.786 203 HB3 ALA 26 HB3 ALA 26 14.134 6.684 -5.492 204 H GLU 27 H GLU 27 14.873 5.814 -1.318 205 HA GLU 27 HA GLU 27 13.862 8.488 -0.993 206 HB2 GLU 27 HB2 GLU 27 11.964 6.611 -0.673 207 HB3 GLU 27 HB3 GLU 27 12.670 6.551 0.933 208 HG2 GLU 27 HG2 GLU 27 12.297 8.997 1.125 209 HG3 GLU 27 HG3 GLU 27 11.455 8.939 -0.424 210 H SER 28 H SER 28 13.684 8.277 1.884 211 HA SER 28 HA SER 28 16.468 8.373 2.524 212 HB2 SER 28 HB2 SER 28 14.956 8.424 4.903 213 HB3 SER 28 HB3 SER 28 15.607 9.808 4.022 214 HG SER 28 HG SER 28 13.459 10.184 4.089 215 HA PRO 29 HA PRO 29 17.175 4.132 3.532 216 HB2 PRO 29 HB2 PRO 29 19.011 4.599 5.580 217 HB3 PRO 29 HB3 PRO 29 19.387 4.441 3.864 218 HG2 PRO 29 HG2 PRO 29 19.039 6.903 5.506 219 HG3 PRO 29 HG3 PRO 29 20.162 6.589 4.172 220 HD2 PRO 29 HD2 PRO 29 17.974 8.088 3.826 221 HD3 PRO 29 HD3 PRO 29 18.552 6.990 2.552 222 H ALA 30 H ALA 30 16.642 6.407 6.222 223 HA ALA 30 HA ALA 30 15.910 4.332 8.059 224 HB1 ALA 30 HB1 ALA 30 15.321 6.112 9.580 225 HB2 ALA 30 HB2 ALA 30 15.375 7.291 8.270 226 HB3 ALA 30 HB3 ALA 30 16.854 6.489 8.796 227 H HIS 31 H HIS 31 14.229 6.287 5.737 228 HA HIS 31 HA HIS 31 11.604 5.906 6.802 229 HB2 HIS 31 HB2 HIS 31 12.569 7.658 5.045 230 HB3 HIS 31 HB3 HIS 31 12.015 6.442 3.899 231 HD1 HIS 31 HD1 HIS 31 9.778 7.006 3.041 232 HD2 HIS 31 HD2 HIS 31 10.257 8.186 7.000 233 HE1 HIS 31 HE1 HIS 31 7.602 8.065 3.703 234 HE2 HIS 31 HE2 HIS 31 8.056 9.067 5.963 235 H ILE 32 H ILE 32 13.426 4.444 4.141 236 HA ILE 32 HA ILE 32 11.410 2.580 3.429 237 HB ILE 32 HB ILE 32 13.101 1.474 2.066 238 HG12 ILE 32 HG12 ILE 32 15.105 3.381 3.316 239 HG13 ILE 32 HG13 ILE 32 14.980 1.671 3.701 240 HG21 ILE 32 HG21 ILE 32 13.612 3.319 0.595 241 HG22 ILE 32 HG22 ILE 32 13.383 4.474 1.907 242 HG23 ILE 32 HG23 ILE 32 12.011 3.554 1.292 243 HD11 ILE 32 HD11 ILE 32 16.763 1.874 2.200 244 HD12 ILE 32 HD12 ILE 32 15.857 2.942 1.133 245 HD13 ILE 32 HD13 ILE 32 15.423 1.239 1.249 246 H ARG 33 H ARG 33 13.491 2.645 6.074 247 HA ARG 33 HA ARG 33 13.704 -0.214 6.387 248 HB2 ARG 33 HB2 ARG 33 14.611 2.174 7.899 249 HB3 ARG 33 HB3 ARG 33 14.396 0.684 8.805 250 HG2 ARG 33 HG2 ARG 33 15.991 -0.459 7.453 251 HG3 ARG 33 HG3 ARG 33 16.078 0.886 6.315 252 HD2 ARG 33 HD2 ARG 33 17.943 0.599 8.091 253 HD3 ARG 33 HD3 ARG 33 17.298 2.207 7.774 254 HE ARG 33 HE ARG 33 16.024 0.747 9.928 255 HH11 ARG 33 HH11 ARG 33 18.546 3.004 9.053 256 HH12 ARG 33 HH12 ARG 33 18.581 3.763 10.608 257 HH21 ARG 33 HH21 ARG 33 16.078 1.741 11.988 258 HH22 ARG 33 HH22 ARG 33 17.176 3.053 12.277 259 H LEU 34 H LEU 34 11.688 2.391 7.623 260 HA LEU 34 HA LEU 34 10.368 0.670 9.523 261 HB2 LEU 34 HB2 LEU 34 8.959 2.577 10.043 262 HB3 LEU 34 HB3 LEU 34 10.651 3.026 10.057 263 HG LEU 34 HG LEU 34 10.002 3.739 7.529 264 HD11 LEU 34 HD11 LEU 34 7.649 3.129 7.811 265 HD12 LEU 34 HD12 LEU 34 7.845 4.863 7.557 266 HD13 LEU 34 HD13 LEU 34 7.526 4.239 9.177 267 HD21 LEU 34 HD21 LEU 34 11.155 5.133 9.141 268 HD22 LEU 34 HD22 LEU 34 9.656 5.375 10.039 269 HD23 LEU 34 HD23 LEU 34 9.822 6.029 8.409 270 H VAL 35 H VAL 35 10.044 1.315 6.212 271 HA VAL 35 HA VAL 35 7.303 1.113 5.761 272 HB VAL 35 HB VAL 35 9.518 -0.038 4.046 273 HG11 VAL 35 HG11 VAL 35 6.708 0.739 3.278 274 HG12 VAL 35 HG12 VAL 35 7.286 -0.912 3.497 275 HG13 VAL 35 HG13 VAL 35 7.950 0.090 2.208 276 HG21 VAL 35 HG21 VAL 35 8.161 2.628 3.739 277 HG22 VAL 35 HG22 VAL 35 9.563 2.020 2.865 278 HG23 VAL 35 HG23 VAL 35 9.694 2.409 4.580 279 H ALA 36 H ALA 36 9.750 -1.425 5.946 280 HA ALA 36 HA ALA 36 8.118 -3.639 5.503 281 HB1 ALA 36 HB1 ALA 36 10.606 -3.622 5.543 282 HB2 ALA 36 HB2 ALA 36 9.878 -4.961 6.435 283 HB3 ALA 36 HB3 ALA 36 10.529 -3.570 7.304 284 H ALA 37 H ALA 37 8.988 -2.064 8.554 285 HA ALA 37 HA ALA 37 7.701 -3.841 10.293 286 HB1 ALA 37 HB1 ALA 37 8.283 -0.902 10.625 287 HB2 ALA 37 HB2 ALA 37 9.325 -2.244 11.097 288 HB3 ALA 37 HB3 ALA 37 7.789 -1.988 11.924 289 H PHE 38 H PHE 38 6.529 -0.942 8.646 290 HA PHE 38 HA PHE 38 4.042 -0.748 9.932 291 HB2 PHE 38 HB2 PHE 38 4.814 1.117 8.668 292 HB3 PHE 38 HB3 PHE 38 4.991 0.147 7.210 293 HD1 PHE 38 HD2 PHE 38 2.333 1.113 9.642 294 HD2 PHE 38 HD1 PHE 38 3.401 0.388 5.590 295 HE1 PHE 38 HE2 PHE 38 0.071 1.774 8.934 296 HE2 PHE 38 HE1 PHE 38 1.149 1.047 4.876 297 HZ PHE 38 HZ PHE 38 -0.521 1.742 6.546 298 H VAL 39 H VAL 39 5.043 -2.518 7.045 299 HA VAL 39 HA VAL 39 2.394 -3.445 6.462 300 HB VAL 39 HB VAL 39 5.027 -4.459 5.383 301 HG11 VAL 39 HG11 VAL 39 3.251 -6.021 4.948 302 HG12 VAL 39 HG12 VAL 39 3.628 -5.165 3.454 303 HG13 VAL 39 HG13 VAL 39 2.195 -4.727 4.381 304 HG21 VAL 39 HG21 VAL 39 5.174 -2.646 4.101 305 HG22 VAL 39 HG22 VAL 39 3.929 -1.925 5.118 306 HG23 VAL 39 HG23 VAL 39 3.479 -2.758 3.631 307 H ASP 40 H ASP 40 5.258 -4.796 8.044 308 HA ASP 40 HA ASP 40 4.386 -7.448 8.318 309 HB2 ASP 40 HB2 ASP 40 6.685 -6.834 8.806 310 HB3 ASP 40 HB3 ASP 40 6.168 -5.788 10.120 311 H ASP 41 H ASP 41 3.767 -4.586 10.258 312 HA ASP 41 HA ASP 41 2.392 -5.991 12.330 313 HB2 ASP 41 HB2 ASP 41 3.515 -3.595 12.294 314 HB3 ASP 41 HB3 ASP 41 1.889 -3.094 11.830 315 H LYS 42 H LYS 42 1.464 -4.443 9.343 316 HA LYS 42 HA LYS 42 -1.306 -4.283 9.784 317 HB2 LYS 42 HB2 LYS 42 -0.243 -3.073 7.961 318 HB3 LYS 42 HB3 LYS 42 0.251 -4.579 7.209 319 HG2 LYS 42 HG2 LYS 42 -1.619 -3.676 6.016 320 HG3 LYS 42 HG3 LYS 42 -2.115 -5.148 6.842 321 HD2 LYS 42 HD2 LYS 42 -3.845 -3.489 7.065 322 HD3 LYS 42 HD3 LYS 42 -3.100 -3.761 8.643 323 HE2 LYS 42 HE2 LYS 42 -1.734 -1.734 8.315 324 HE3 LYS 42 HE3 LYS 42 -2.531 -1.464 6.765 325 HZ1 LYS 42 HZ1 LYS 42 -3.974 -0.254 7.942 326 HZ2 LYS 42 HZ2 LYS 42 -3.455 -0.892 9.425 327 HZ3 LYS 42 HZ3 LYS 42 -4.601 -1.725 8.501 328 H MET 43 H MET 43 0.730 -6.894 8.504 329 HA MET 43 HA MET 43 -1.541 -8.584 7.964 330 HB2 MET 43 HB2 MET 43 0.133 -10.350 7.525 331 HB3 MET 43 HB3 MET 43 0.443 -8.885 6.610 332 HG2 MET 43 HG2 MET 43 2.052 -8.297 8.534 333 HG3 MET 43 HG3 MET 43 1.946 -10.013 8.925 334 HE1 MET 43 HE1 MET 43 2.367 -7.498 6.123 335 HE2 MET 43 HE2 MET 43 1.822 -8.779 5.034 336 HE3 MET 43 HE3 MET 43 3.503 -8.239 4.993 337 H HIS 44 H HIS 44 0.400 -7.874 10.686 338 HA HIS 44 HA HIS 44 0.050 -10.312 12.089 339 HB2 HIS 44 HB2 HIS 44 1.605 -8.175 12.529 340 HB3 HIS 44 HB3 HIS 44 0.284 -7.780 13.625 341 HD1 HIS 44 HD1 HIS 44 3.396 -9.519 13.547 342 HD2 HIS 44 HD2 HIS 44 -0.254 -10.119 15.438 343 HE1 HIS 44 HE1 HIS 44 3.866 -11.119 15.427 344 HE2 HIS 44 HE2 HIS 44 1.612 -11.594 16.442 345 H GLU 45 H GLU 45 -1.721 -7.235 12.112 346 HA GLU 45 HA GLU 45 -3.640 -8.093 14.031 347 HB2 GLU 45 HB2 GLU 45 -4.879 -6.080 13.451 348 HB3 GLU 45 HB3 GLU 45 -3.173 -5.727 13.664 349 HG2 GLU 45 HG2 GLU 45 -2.904 -5.740 11.192 350 HG3 GLU 45 HG3 GLU 45 -4.648 -5.966 11.046 351 H PHE 46 H PHE 46 -3.285 -8.708 10.696 352 HA PHE 46 HA PHE 46 -6.105 -9.344 10.370 353 HB2 PHE 46 HB2 PHE 46 -3.819 -8.941 8.538 354 HB3 PHE 46 HB3 PHE 46 -5.020 -10.127 8.034 355 HD1 PHE 46 HD2 PHE 46 -7.542 -9.183 8.636 356 HD2 PHE 46 HD1 PHE 46 -4.122 -6.886 7.572 357 HE1 PHE 46 HE2 PHE 46 -9.012 -7.378 7.838 358 HE2 PHE 46 HE1 PHE 46 -5.581 -5.076 6.772 359 HZ PHE 46 HZ PHE 46 -8.031 -5.321 6.903 360 H SER 47 H SER 47 -3.105 -10.886 11.044 361 HA SER 47 HA SER 47 -3.787 -13.506 10.203 362 HB2 SER 47 HB2 SER 47 -1.789 -12.538 12.266 363 HB3 SER 47 HB3 SER 47 -1.921 -14.213 11.724 364 HG SER 47 HG SER 47 -1.369 -11.965 10.068 365 H GLU 48 H GLU 48 -4.568 -11.598 12.978 366 HA GLU 48 HA GLU 48 -5.501 -13.861 14.526 367 HB2 GLU 48 HB2 GLU 48 -6.043 -12.261 16.241 368 HB3 GLU 48 HB3 GLU 48 -4.450 -11.874 15.602 369 HG2 GLU 48 HG2 GLU 48 -5.183 -9.960 14.557 370 HG3 GLU 48 HG3 GLU 48 -6.856 -10.511 14.495 371 H LYS 49 H LYS 49 -6.704 -11.748 12.154 372 HA LYS 49 HA LYS 49 -9.459 -11.782 12.907 373 HB2 LYS 49 HB2 LYS 49 -8.016 -11.096 10.350 374 HB3 LYS 49 HB3 LYS 49 -9.772 -11.105 10.444 375 HG2 LYS 49 HG2 LYS 49 -8.330 -9.561 12.513 376 HG3 LYS 49 HG3 LYS 49 -8.303 -8.922 10.868 377 HD2 LYS 49 HD2 LYS 49 -10.874 -9.782 12.153 378 HD3 LYS 49 HD3 LYS 49 -10.200 -8.181 12.455 379 HE2 LYS 49 HE2 LYS 49 -10.155 -7.801 9.997 380 HE3 LYS 49 HE3 LYS 49 -10.963 -9.351 9.778 381 HZ1 LYS 49 HZ1 LYS 49 -12.470 -7.406 9.747 382 HZ2 LYS 49 HZ2 LYS 49 -12.086 -7.112 11.366 383 HZ3 LYS 49 HZ3 LYS 49 -12.869 -8.544 10.931 384 H GLN 50 H GLN 50 -7.380 -13.682 10.839 385 HA GLN 50 HA GLN 50 -7.615 -15.667 9.763 386 HB2 GLN 50 HB2 GLN 50 -9.547 -16.148 12.040 387 HB3 GLN 50 HB3 GLN 50 -8.901 -17.400 10.987 388 HG2 GLN 50 HG2 GLN 50 -6.751 -17.188 11.850 389 HG3 GLN 50 HG3 GLN 50 -7.083 -15.601 12.536 390 HE21 GLN 50 HE21 GLN 50 -7.614 -19.040 12.886 391 HE22 GLN 50 HE22 GLN 50 -8.043 -18.996 14.562 392 HA PRO 51 HA PRO 51 -11.564 -14.423 7.661 393 HB2 PRO 51 HB2 PRO 51 -10.397 -14.012 5.192 394 HB3 PRO 51 HB3 PRO 51 -10.741 -12.753 6.378 395 HG2 PRO 51 HG2 PRO 51 -8.177 -13.928 5.600 396 HG3 PRO 51 HG3 PRO 51 -8.506 -12.406 6.432 397 HD2 PRO 51 HD2 PRO 51 -7.544 -14.810 7.571 398 HD3 PRO 51 HD3 PRO 51 -8.037 -13.341 8.431 399 H MET 52 H MET 52 -9.252 -15.825 5.359 400 HA MET 52 HA MET 52 -11.061 -18.124 5.088 401 HB2 MET 52 HB2 MET 52 -10.030 -18.460 2.877 402 HB3 MET 52 HB3 MET 52 -10.738 -16.861 3.030 403 HG2 MET 52 HG2 MET 52 -7.829 -17.322 3.546 404 HG3 MET 52 HG3 MET 52 -8.445 -17.104 1.909 405 HE1 MET 52 HE1 MET 52 -9.396 -14.902 0.951 406 HE2 MET 52 HE2 MET 52 -9.811 -13.487 1.920 407 HE3 MET 52 HE3 MET 52 -10.718 -14.988 2.115 408 H LEU 53 H LEU 53 -8.360 -17.319 6.669 409 HA LEU 53 HA LEU 53 -6.601 -18.380 7.606 410 HB2 LEU 53 HB2 LEU 53 -8.498 -20.653 7.152 411 HB3 LEU 53 HB3 LEU 53 -6.923 -20.928 7.874 412 HG LEU 53 HG LEU 53 -8.918 -18.970 9.006 413 HD11 LEU 53 HD11 LEU 53 -9.822 -21.284 8.934 414 HD12 LEU 53 HD12 LEU 53 -9.596 -20.648 10.564 415 HD13 LEU 53 HD13 LEU 53 -8.440 -21.802 9.897 416 HD21 LEU 53 HD21 LEU 53 -6.345 -20.188 9.957 417 HD22 LEU 53 HD22 LEU 53 -7.519 -19.489 11.070 418 HD23 LEU 53 HD23 LEU 53 -6.777 -18.483 9.827 419 H ASP 54 H ASP 54 -5.315 -17.717 5.797 420 HA ASP 54 HA ASP 54 -3.826 -19.877 4.680 421 HB2 ASP 54 HB2 ASP 54 -5.704 -19.848 3.094 422 HB3 ASP 54 HB3 ASP 54 -5.444 -18.134 2.806 423 H VAL 55 H VAL 55 -1.760 -19.183 4.196 424 HA VAL 55 HA VAL 55 -1.033 -16.594 5.100 425 HB VAL 55 HB VAL 55 0.768 -18.445 3.546 426 HG11 VAL 55 HG11 VAL 55 1.584 -16.156 3.869 427 HG12 VAL 55 HG12 VAL 55 2.548 -17.336 4.756 428 HG13 VAL 55 HG13 VAL 55 1.370 -16.339 5.610 429 HG21 VAL 55 HG21 VAL 55 0.153 -18.415 6.494 430 HG22 VAL 55 HG22 VAL 55 1.468 -19.318 5.743 431 HG23 VAL 55 HG23 VAL 55 -0.207 -19.712 5.353 432 HA PRO 56 HA PRO 56 0.033 -15.700 0.359 433 HB2 PRO 56 HB2 PRO 56 -2.137 -17.368 -0.814 434 HB3 PRO 56 HB3 PRO 56 -0.534 -16.993 -1.456 435 HG2 PRO 56 HG2 PRO 56 -1.048 -19.383 -0.408 436 HG3 PRO 56 HG3 PRO 56 0.510 -18.582 -0.134 437 HD2 PRO 56 HD2 PRO 56 -1.809 -18.899 1.715 438 HD3 PRO 56 HD3 PRO 56 -0.073 -18.924 2.059 439 H LYS 57 H LYS 57 -3.314 -16.608 1.110 440 HA LYS 57 HA LYS 57 -4.516 -14.368 -0.136 441 HB2 LYS 57 HB2 LYS 57 -5.403 -16.471 1.782 442 HB3 LYS 57 HB3 LYS 57 -6.408 -15.043 1.606 443 HG2 LYS 57 HG2 LYS 57 -6.901 -17.142 0.177 444 HG3 LYS 57 HG3 LYS 57 -6.977 -15.549 -0.573 445 HD2 LYS 57 HD2 LYS 57 -5.174 -15.936 -1.888 446 HD3 LYS 57 HD3 LYS 57 -4.352 -16.896 -0.658 447 HE2 LYS 57 HE2 LYS 57 -6.767 -17.923 -2.114 448 HE3 LYS 57 HE3 LYS 57 -5.142 -18.092 -2.778 449 HZ1 LYS 57 HZ1 LYS 57 -5.262 -20.014 -1.623 450 HZ2 LYS 57 HZ2 LYS 57 -6.360 -19.414 -0.488 451 HZ3 LYS 57 HZ3 LYS 57 -4.715 -19.026 -0.357 452 H LEU 58 H LEU 58 -3.216 -14.927 3.047 453 HA LEU 58 HA LEU 58 -4.356 -12.661 4.330 454 HB2 LEU 58 HB2 LEU 58 -3.149 -14.846 5.254 455 HB3 LEU 58 HB3 LEU 58 -1.736 -13.821 5.193 456 HG LEU 58 HG LEU 58 -2.723 -13.932 7.428 457 HD11 LEU 58 HD11 LEU 58 -2.722 -11.588 7.930 458 HD12 LEU 58 HD12 LEU 58 -3.020 -11.186 6.240 459 HD13 LEU 58 HD13 LEU 58 -1.492 -11.926 6.713 460 HD21 LEU 58 HD21 LEU 58 -4.862 -13.312 7.975 461 HD22 LEU 58 HD22 LEU 58 -5.115 -14.088 6.413 462 HD23 LEU 58 HD23 LEU 58 -5.071 -12.328 6.529 463 H ALA 59 H ALA 59 -1.266 -13.287 2.744 464 HA ALA 59 HA ALA 59 0.000 -10.865 3.346 465 HB1 ALA 59 HB1 ALA 59 1.460 -11.377 1.418 466 HB2 ALA 59 HB2 ALA 59 0.371 -12.691 0.977 467 HB3 ALA 59 HB3 ALA 59 1.245 -12.745 2.508 468 H VAL 60 H VAL 60 -1.798 -11.754 0.382 469 HA VAL 60 HA VAL 60 -1.528 -9.193 -0.803 470 HB VAL 60 HB VAL 60 -2.004 -11.196 -2.140 471 HG11 VAL 60 HG11 VAL 60 -4.474 -11.892 -2.226 472 HG12 VAL 60 HG12 VAL 60 -4.583 -11.165 -0.624 473 HG13 VAL 60 HG13 VAL 60 -3.478 -12.506 -0.912 474 HG21 VAL 60 HG21 VAL 60 -2.505 -9.027 -3.092 475 HG22 VAL 60 HG22 VAL 60 -4.111 -9.053 -2.359 476 HG23 VAL 60 HG23 VAL 60 -3.698 -10.215 -3.621 477 H LEU 61 H LEU 61 -3.733 -10.480 1.529 478 HA LEU 61 HA LEU 61 -5.912 -8.758 1.193 479 HB2 LEU 61 HB2 LEU 61 -5.937 -10.766 2.603 480 HB3 LEU 61 HB3 LEU 61 -4.846 -9.991 3.733 481 HG LEU 61 HG LEU 61 -6.659 -8.239 4.071 482 HD11 LEU 61 HD11 LEU 61 -7.981 -8.700 2.087 483 HD12 LEU 61 HD12 LEU 61 -8.947 -8.966 3.538 484 HD13 LEU 61 HD13 LEU 61 -8.291 -10.342 2.652 485 HD21 LEU 61 HD21 LEU 61 -6.161 -9.952 5.716 486 HD22 LEU 61 HD22 LEU 61 -7.198 -11.095 4.865 487 HD23 LEU 61 HD23 LEU 61 -7.900 -9.670 5.632 488 H THR 62 H THR 62 -2.830 -8.289 2.797 489 HA THR 62 HA THR 62 -3.611 -5.855 4.101 490 HB THR 62 HB THR 62 -1.247 -5.594 4.672 491 HG1 THR 62 HG1 THR 62 -0.850 -7.921 3.052 492 HG21 THR 62 HG21 THR 62 -2.878 -7.290 5.780 493 HG22 THR 62 HG22 THR 62 -1.165 -7.320 6.186 494 HG23 THR 62 HG23 THR 62 -1.819 -8.499 5.051 495 H ALA 63 H ALA 63 -2.078 -6.705 1.073 496 HA ALA 63 HA ALA 63 -0.982 -4.241 0.374 497 HB1 ALA 63 HB1 ALA 63 -2.169 -6.321 -1.456 498 HB2 ALA 63 HB2 ALA 63 -0.520 -6.316 -0.831 499 HB3 ALA 63 HB3 ALA 63 -1.054 -5.039 -1.926 500 H VAL 64 H VAL 64 -4.221 -5.535 -0.282 501 HA VAL 64 HA VAL 64 -5.081 -3.182 -1.646 502 HB VAL 64 HB VAL 64 -6.070 -5.433 -2.046 503 HG11 VAL 64 HG11 VAL 64 -7.922 -6.120 -0.476 504 HG12 VAL 64 HG12 VAL 64 -7.219 -4.997 0.693 505 HG13 VAL 64 HG13 VAL 64 -6.276 -6.365 0.105 506 HG21 VAL 64 HG21 VAL 64 -7.240 -3.493 -2.838 507 HG22 VAL 64 HG22 VAL 64 -7.965 -3.231 -1.253 508 HG23 VAL 64 HG23 VAL 64 -8.418 -4.642 -2.207 509 H GLN 65 H GLN 65 -5.128 -4.241 1.690 510 HA GLN 65 HA GLN 65 -7.036 -2.312 2.567 511 HB2 GLN 65 HB2 GLN 65 -6.094 -4.516 3.723 512 HB3 GLN 65 HB3 GLN 65 -4.962 -3.371 4.435 513 HG2 GLN 65 HG2 GLN 65 -7.824 -2.626 4.571 514 HG3 GLN 65 HG3 GLN 65 -7.323 -4.000 5.552 515 HE21 GLN 65 HE21 GLN 65 -6.837 -0.590 4.955 516 HE22 GLN 65 HE22 GLN 65 -6.094 -0.230 6.479 517 H ILE 66 H ILE 66 -3.490 -2.467 2.620 518 HA ILE 66 HA ILE 66 -3.025 0.019 3.829 519 HB ILE 66 HB ILE 66 -1.369 -1.654 1.950 520 HG12 ILE 66 HG12 ILE 66 -0.906 -0.914 4.845 521 HG13 ILE 66 HG13 ILE 66 -1.807 -2.342 4.348 522 HG21 ILE 66 HG21 ILE 66 -0.843 0.749 1.593 523 HG22 ILE 66 HG22 ILE 66 0.501 -0.179 2.248 524 HG23 ILE 66 HG23 ILE 66 -0.436 0.873 3.304 525 HD11 ILE 66 HD11 ILE 66 0.217 -3.121 3.140 526 HD12 ILE 66 HD12 ILE 66 0.424 -2.990 4.884 527 HD13 ILE 66 HD13 ILE 66 1.094 -1.753 3.822 528 H ALA 67 H ALA 67 -3.369 -0.874 0.414 529 HA ALA 67 HA ALA 67 -2.855 1.642 -0.698 530 HB1 ALA 67 HB1 ALA 67 -4.671 -0.533 -1.739 531 HB2 ALA 67 HB2 ALA 67 -2.935 -0.411 -2.022 532 HB3 ALA 67 HB3 ALA 67 -4.021 0.812 -2.681 533 H SER 68 H SER 68 -5.885 0.170 0.407 534 HA SER 68 HA SER 68 -7.634 2.208 -0.383 535 HB2 SER 68 HB2 SER 68 -8.297 -0.084 0.378 536 HB3 SER 68 HB3 SER 68 -7.912 0.396 2.028 537 HG SER 68 HG SER 68 -10.135 0.633 1.585 538 H GLU 69 H GLU 69 -5.364 2.070 2.220 539 HA GLU 69 HA GLU 69 -6.629 4.161 3.757 540 HB2 GLU 69 HB2 GLU 69 -4.054 2.634 4.016 541 HB3 GLU 69 HB3 GLU 69 -4.369 4.053 5.005 542 HG2 GLU 69 HG2 GLU 69 -6.496 2.916 5.741 543 HG3 GLU 69 HG3 GLU 69 -5.885 1.462 4.953 544 H TYR 70 H TYR 70 -3.531 3.842 2.037 545 HA TYR 70 HA TYR 70 -2.900 6.596 2.270 546 HB2 TYR 70 HB2 TYR 70 -1.733 4.307 0.742 547 HB3 TYR 70 HB3 TYR 70 -1.173 5.950 0.440 548 HD1 TYR 70 HD1 TYR 70 -0.202 7.271 2.350 549 HD2 TYR 70 HD2 TYR 70 -1.020 3.107 2.646 550 HE1 TYR 70 HE1 TYR 70 1.274 7.126 4.307 551 HE2 TYR 70 HE2 TYR 70 0.457 2.956 4.605 552 HH TYR 70 HH TYR 70 2.362 4.193 5.580 553 H LEU 71 H LEU 71 -4.688 4.817 -0.150 554 HA LEU 71 HA LEU 71 -4.388 6.630 -2.273 555 HB2 LEU 71 HB2 LEU 71 -6.217 4.434 -1.626 556 HB3 LEU 71 HB3 LEU 71 -6.928 5.674 -2.641 557 HG LEU 71 HG LEU 71 -4.292 4.380 -3.334 558 HD11 LEU 71 HD11 LEU 71 -7.057 3.472 -4.124 559 HD12 LEU 71 HD12 LEU 71 -5.859 2.554 -3.209 560 HD13 LEU 71 HD13 LEU 71 -5.567 2.946 -4.902 561 HD21 LEU 71 HD21 LEU 71 -6.323 5.624 -5.167 562 HD22 LEU 71 HD22 LEU 71 -4.633 5.246 -5.493 563 HD23 LEU 71 HD23 LEU 71 -5.046 6.561 -4.395 564 H LYS 72 H LYS 72 -6.366 6.749 0.579 565 HA LYS 72 HA LYS 72 -8.024 8.893 -0.406 566 HB2 LYS 72 HB2 LYS 72 -7.686 7.955 2.445 567 HB3 LYS 72 HB3 LYS 72 -9.003 8.928 1.805 568 HG2 LYS 72 HG2 LYS 72 -9.575 6.983 0.319 569 HG3 LYS 72 HG3 LYS 72 -8.409 6.038 1.245 570 HD2 LYS 72 HD2 LYS 72 -10.872 7.407 2.323 571 HD3 LYS 72 HD3 LYS 72 -10.650 5.671 2.098 572 HE2 LYS 72 HE2 LYS 72 -9.196 7.471 4.028 573 HE3 LYS 72 HE3 LYS 72 -10.331 6.180 4.414 574 HZ1 LYS 72 HZ1 LYS 72 -8.331 5.151 4.746 575 HZ2 LYS 72 HZ2 LYS 72 -7.548 5.994 3.513 576 HZ3 LYS 72 HZ3 LYS 72 -8.611 4.735 3.126 577 H LEU 73 H LEU 73 -5.056 8.533 1.355 578 HA LEU 73 HA LEU 73 -4.927 11.104 2.506 579 HB2 LEU 73 HB2 LEU 73 -3.520 8.995 2.998 580 HB3 LEU 73 HB3 LEU 73 -2.535 9.489 1.640 581 HG LEU 73 HG LEU 73 -1.638 10.095 3.897 582 HD11 LEU 73 HD11 LEU 73 -0.850 11.227 1.912 583 HD12 LEU 73 HD12 LEU 73 -0.934 12.340 3.277 584 HD13 LEU 73 HD13 LEU 73 -2.175 12.386 2.024 585 HD21 LEU 73 HD21 LEU 73 -3.962 10.750 4.759 586 HD22 LEU 73 HD22 LEU 73 -3.664 12.301 3.970 587 HD23 LEU 73 HD23 LEU 73 -2.583 11.736 5.239 588 H LYS 74 H LYS 74 -3.731 9.779 -0.554 589 HA LYS 74 HA LYS 74 -2.628 12.284 -1.405 590 HB2 LYS 74 HB2 LYS 74 -2.254 11.185 -3.547 591 HB3 LYS 74 HB3 LYS 74 -1.719 10.163 -2.223 592 HG2 LYS 74 HG2 LYS 74 -3.492 8.666 -2.498 593 HG3 LYS 74 HG3 LYS 74 -4.437 9.822 -3.437 594 HD2 LYS 74 HD2 LYS 74 -1.792 8.882 -4.468 595 HD3 LYS 74 HD3 LYS 74 -3.217 7.858 -4.643 596 HE2 LYS 74 HE2 LYS 74 -3.247 10.733 -5.489 597 HE3 LYS 74 HE3 LYS 74 -2.628 9.476 -6.558 598 HZ1 LYS 74 HZ1 LYS 74 -4.776 8.355 -6.397 599 HZ2 LYS 74 HZ2 LYS 74 -4.952 9.923 -7.001 600 HZ3 LYS 74 HZ3 LYS 74 -5.371 9.588 -5.395 601 H GLU 75 H GLU 75 -5.744 10.909 -1.395 602 HA GLU 75 HA GLU 75 -6.736 12.378 -3.655 603 HB2 GLU 75 HB2 GLU 75 -7.615 10.159 -2.308 604 HB3 GLU 75 HB3 GLU 75 -8.712 11.399 -1.713 605 HG2 GLU 75 HG2 GLU 75 -9.703 10.340 -3.612 606 HG3 GLU 75 HG3 GLU 75 -9.253 11.986 -4.050 607 H GLU 76 H GLU 76 -6.905 12.685 -0.120 608 HA GLU 76 HA GLU 76 -8.534 15.005 -0.143 609 HB2 GLU 76 HB2 GLU 76 -7.984 15.255 2.184 610 HB3 GLU 76 HB3 GLU 76 -8.225 13.551 1.847 611 HG2 GLU 76 HG2 GLU 76 -6.168 13.030 2.487 612 HG3 GLU 76 HG3 GLU 76 -5.457 14.352 1.559 613 H TYR 77 H TYR 77 -5.165 14.466 -0.638 614 HA TYR 77 HA TYR 77 -4.134 17.019 -0.107 615 HB2 TYR 77 HB2 TYR 77 -2.571 15.263 -0.448 616 HB3 TYR 77 HB3 TYR 77 -3.293 14.809 -1.985 617 HD1 TYR 77 HD1 TYR 77 -2.178 18.184 -0.794 618 HD2 TYR 77 HD2 TYR 77 -1.569 14.983 -3.528 619 HE1 TYR 77 HE1 TYR 77 -0.471 19.516 -1.961 620 HE2 TYR 77 HE2 TYR 77 0.133 16.305 -4.706 621 HH TYR 77 HH TYR 77 1.018 18.344 -4.959 622 H GLN 78 H GLN 78 -5.487 15.612 -3.064 623 HA GLN 78 HA GLN 78 -5.153 17.924 -4.662 624 HB2 GLN 78 HB2 GLN 78 -6.940 15.511 -4.927 625 HB3 GLN 78 HB3 GLN 78 -6.876 16.786 -6.139 626 HG2 GLN 78 HG2 GLN 78 -4.575 15.062 -5.250 627 HG3 GLN 78 HG3 GLN 78 -5.471 14.904 -6.759 628 HE21 GLN 78 HE21 GLN 78 -2.621 15.399 -6.290 629 HE22 GLN 78 HE22 GLN 78 -2.259 16.873 -7.119 630 H ARG 79 H ARG 79 -7.580 16.910 -2.398 631 HA ARG 79 HA ARG 79 -9.647 18.680 -3.254 632 HB2 ARG 79 HB2 ARG 79 -10.248 16.758 -1.948 633 HB3 ARG 79 HB3 ARG 79 -9.145 17.212 -0.659 634 HG2 ARG 79 HG2 ARG 79 -11.352 17.688 0.066 635 HG3 ARG 79 HG3 ARG 79 -10.556 19.228 -0.258 636 HD2 ARG 79 HD2 ARG 79 -11.628 19.130 -2.558 637 HD3 ARG 79 HD3 ARG 79 -12.613 17.810 -1.929 638 HE ARG 79 HE ARG 79 -13.255 19.527 -0.143 639 HH11 ARG 79 HH11 ARG 79 -12.572 20.256 -3.495 640 HH12 ARG 79 HH12 ARG 79 -13.534 21.703 -3.510 641 HH21 ARG 79 HH21 ARG 79 -14.516 21.439 -0.147 642 HH22 ARG 79 HH22 ARG 79 -14.620 22.395 -1.589 643 H LEU 80 H LEU 80 -7.270 18.767 -0.633 644 HA LEU 80 HA LEU 80 -7.923 21.277 0.418 645 HB2 LEU 80 HB2 LEU 80 -6.513 20.069 1.782 646 HB3 LEU 80 HB3 LEU 80 -5.515 19.527 0.448 647 HG LEU 80 HG LEU 80 -4.898 22.135 0.373 648 HD11 LEU 80 HD11 LEU 80 -6.383 22.687 2.238 649 HD12 LEU 80 HD12 LEU 80 -4.695 23.043 2.602 650 HD13 LEU 80 HD13 LEU 80 -5.458 21.607 3.282 651 HD21 LEU 80 HD21 LEU 80 -3.313 20.278 0.549 652 HD22 LEU 80 HD22 LEU 80 -3.656 20.148 2.276 653 HD23 LEU 80 HD23 LEU 80 -2.891 21.602 1.634 654 H ARG 81 H ARG 81 -5.695 20.350 -2.150 655 HA ARG 81 HA ARG 81 -4.641 22.948 -2.568 656 HB2 ARG 81 HB2 ARG 81 -4.624 20.432 -4.218 657 HB3 ARG 81 HB3 ARG 81 -3.856 21.918 -4.766 658 HG2 ARG 81 HG2 ARG 81 -3.135 21.145 -2.041 659 HG3 ARG 81 HG3 ARG 81 -2.649 19.979 -3.270 660 HD2 ARG 81 HD2 ARG 81 -0.879 21.600 -2.875 661 HD3 ARG 81 HD3 ARG 81 -1.521 21.776 -4.505 662 HE ARG 81 HE ARG 81 -2.490 23.543 -2.369 663 HH11 ARG 81 HH11 ARG 81 -0.753 23.088 -5.369 664 HH12 ARG 81 HH12 ARG 81 -0.707 24.780 -5.753 665 HH21 ARG 81 HH21 ARG 81 -2.434 25.785 -2.874 666 HH22 ARG 81 HH22 ARG 81 -1.670 26.311 -4.338 667 H GLU 82 H GLU 82 -7.298 21.160 -4.099 668 HA GLU 82 HA GLU 82 -7.760 23.105 -6.120 669 HB2 GLU 82 HB2 GLU 82 -9.551 21.817 -6.780 670 HB3 GLU 82 HB3 GLU 82 -8.589 20.619 -5.929 671 HG2 GLU 82 HG2 GLU 82 -9.998 20.871 -3.958 672 HG3 GLU 82 HG3 GLU 82 -10.940 22.109 -4.778 673 H GLN 83 H GLN 83 -8.815 22.710 -2.830 674 HA GLN 83 HA GLN 83 -10.951 24.545 -2.822 675 HB2 GLN 83 HB2 GLN 83 -10.413 22.819 -1.072 676 HB3 GLN 83 HB3 GLN 83 -9.110 23.862 -0.527 677 HG2 GLN 83 HG2 GLN 83 -10.711 25.598 0.032 678 HG3 GLN 83 HG3 GLN 83 -12.029 24.588 -0.559 679 HE21 GLN 83 HE21 GLN 83 -9.685 25.048 1.965 680 HE22 GLN 83 HE22 GLN 83 -10.393 23.951 3.097 681 H LEU 84 H LEU 84 -7.513 24.921 -2.658 682 HA LEU 84 HA LEU 84 -7.653 27.687 -1.809 683 HB2 LEU 84 HB2 LEU 84 -5.559 25.670 -2.128 684 HB3 LEU 84 HB3 LEU 84 -5.070 27.263 -2.668 685 HG LEU 84 HG LEU 84 -6.151 26.630 0.090 686 HD11 LEU 84 HD11 LEU 84 -3.319 27.160 -0.806 687 HD12 LEU 84 HD12 LEU 84 -3.957 25.628 -0.207 688 HD13 LEU 84 HD13 LEU 84 -3.859 27.023 0.866 689 HD21 LEU 84 HD21 LEU 84 -5.279 29.159 -1.247 690 HD22 LEU 84 HD22 LEU 84 -5.045 28.954 0.488 691 HD23 LEU 84 HD23 LEU 84 -6.665 28.863 -0.196 692 H LYS 85 H LYS 85 -6.959 25.869 -4.744 693 HA LYS 85 HA LYS 85 -6.163 28.076 -6.324 694 HB2 LYS 85 HB2 LYS 85 -7.175 25.323 -7.012 695 HB3 LYS 85 HB3 LYS 85 -6.759 26.499 -8.252 696 HG2 LYS 85 HG2 LYS 85 -4.474 26.609 -7.379 697 HG3 LYS 85 HG3 LYS 85 -4.896 25.424 -6.143 698 HD2 LYS 85 HD2 LYS 85 -5.285 24.827 -9.057 699 HD3 LYS 85 HD3 LYS 85 -3.717 24.599 -8.277 700 HE2 LYS 85 HE2 LYS 85 -4.392 22.738 -7.233 701 HE3 LYS 85 HE3 LYS 85 -5.925 23.458 -6.760 702 HZ1 LYS 85 HZ1 LYS 85 -6.840 22.936 -8.887 703 HZ2 LYS 85 HZ2 LYS 85 -6.146 21.530 -8.256 704 HZ3 LYS 85 HZ3 LYS 85 -5.345 22.397 -9.466 705 H LYS 86 H LYS 86 -9.301 26.575 -5.734 706 HA LYS 86 HA LYS 86 -10.576 28.386 -7.630 707 HB2 LYS 86 HB2 LYS 86 -11.254 26.024 -7.601 708 HB3 LYS 86 HB3 LYS 86 -11.729 26.182 -5.918 709 HG2 LYS 86 HG2 LYS 86 -13.312 28.036 -6.780 710 HG3 LYS 86 HG3 LYS 86 -13.046 27.301 -8.359 711 HD2 LYS 86 HD2 LYS 86 -15.047 26.386 -7.335 712 HD3 LYS 86 HD3 LYS 86 -13.805 25.138 -7.459 713 HE2 LYS 86 HE2 LYS 86 -15.041 25.189 -5.275 714 HE3 LYS 86 HE3 LYS 86 -13.291 25.303 -5.144 715 HZ1 LYS 86 HZ1 LYS 86 -13.428 27.623 -4.727 716 HZ2 LYS 86 HZ2 LYS 86 -14.547 26.871 -3.701 717 HZ3 LYS 86 HZ3 LYS 86 -15.084 27.666 -5.093 718 H1 GLY 1 H1 GLY 1 -27.370 -10.141 8.346 719 H2 GLY 1 H2 GLY 1 -27.059 -9.920 9.992 720 H3 GLY 1 H3 GLY 1 -25.829 -9.669 8.865 721 HA2 GLY 1 HA3 GLY 1 -27.060 -7.805 7.913 722 HA3 GLY 1 HA2 GLY 1 -28.294 -8.047 9.139 723 H SER 2 H SER 2 -26.925 -5.639 8.812 724 HA SER 2 HA SER 2 -24.736 -5.392 10.599 725 HB2 SER 2 HB2 SER 2 -26.462 -3.047 9.964 726 HB3 SER 2 HB3 SER 2 -24.704 -3.192 9.937 727 HG SER 2 HG SER 2 -25.609 -3.048 7.829 728 H HIS 3 H HIS 3 -28.150 -4.409 10.853 729 HA HIS 3 HA HIS 3 -29.497 -3.937 12.613 730 HB2 HIS 3 HB2 HIS 3 -27.903 -6.228 13.469 731 HB3 HIS 3 HB3 HIS 3 -28.483 -5.262 14.823 732 HD1 HIS 3 HD1 HIS 3 -31.169 -4.578 12.932 733 HD2 HIS 3 HD2 HIS 3 -29.756 -8.225 14.338 734 HE1 HIS 3 HE1 HIS 3 -33.148 -6.121 12.914 735 HE2 HIS 3 HE2 HIS 3 -32.240 -8.357 13.638 736 H MET 4 H MET 4 -28.024 -1.890 12.187 737 HA MET 4 HA MET 4 -27.506 -0.811 14.820 738 HB2 MET 4 HB2 MET 4 -25.257 0.014 14.263 739 HB3 MET 4 HB3 MET 4 -25.319 -1.742 14.259 740 HG2 MET 4 HG2 MET 4 -25.434 -1.751 11.831 741 HG3 MET 4 HG3 MET 4 -25.417 0.011 11.817 742 HE1 MET 4 HE1 MET 4 -21.866 -2.668 13.039 743 HE2 MET 4 HE2 MET 4 -23.432 -3.256 12.469 744 HE3 MET 4 HE3 MET 4 -23.297 -2.503 14.060 745 H THR 5 H THR 5 -27.871 1.365 14.915 746 HA THR 5 HA THR 5 -28.972 2.609 12.534 747 HB THR 5 HB THR 5 -29.162 4.511 14.462 748 HG1 THR 5 HG1 THR 5 -28.989 3.651 16.396 749 HG21 THR 5 HG21 THR 5 -31.011 3.670 13.129 750 HG22 THR 5 HG22 THR 5 -31.453 3.660 14.836 751 HG23 THR 5 HG23 THR 5 -31.007 2.155 14.032 752 H GLU 6 H GLU 6 -25.971 2.249 13.637 753 HA GLU 6 HA GLU 6 -25.070 4.984 13.145 754 HB2 GLU 6 HB2 GLU 6 -24.276 3.681 15.157 755 HB3 GLU 6 HB3 GLU 6 -23.451 2.592 14.051 756 HG2 GLU 6 HG2 GLU 6 -22.058 4.402 15.135 757 HG3 GLU 6 HG3 GLU 6 -21.929 4.245 13.383 758 H GLN 7 H GLN 7 -23.403 5.405 11.601 759 HA GLN 7 HA GLN 7 -23.213 3.355 9.488 760 HB2 GLN 7 HB2 GLN 7 -24.594 5.433 8.960 761 HB3 GLN 7 HB3 GLN 7 -23.085 6.334 9.019 762 HG2 GLN 7 HG2 GLN 7 -22.200 4.810 7.247 763 HG3 GLN 7 HG3 GLN 7 -23.817 4.117 7.122 764 HE21 GLN 7 HE21 GLN 7 -25.143 6.685 7.585 765 HE22 GLN 7 HE22 GLN 7 -24.951 7.588 6.126 766 HA PRO 8 HA PRO 8 -18.918 4.240 10.811 767 HB2 PRO 8 HB2 PRO 8 -18.429 1.413 10.794 768 HB3 PRO 8 HB3 PRO 8 -18.540 2.483 12.193 769 HG2 PRO 8 HG2 PRO 8 -20.353 0.484 11.602 770 HG3 PRO 8 HG3 PRO 8 -20.705 1.899 12.614 771 HD2 PRO 8 HD2 PRO 8 -21.349 1.419 9.728 772 HD3 PRO 8 HD3 PRO 8 -22.337 2.184 10.994 773 H LYS 9 H LYS 9 -16.879 2.765 9.879 774 HA LYS 9 HA LYS 9 -16.809 3.386 7.115 775 HB2 LYS 9 HB2 LYS 9 -14.925 1.694 8.774 776 HB3 LYS 9 HB3 LYS 9 -14.598 2.269 7.145 777 HG2 LYS 9 HG2 LYS 9 -14.758 4.588 7.958 778 HG3 LYS 9 HG3 LYS 9 -15.000 3.973 9.595 779 HD2 LYS 9 HD2 LYS 9 -12.608 3.155 7.988 780 HD3 LYS 9 HD3 LYS 9 -12.624 4.688 8.855 781 HE2 LYS 9 HE2 LYS 9 -13.166 2.013 10.131 782 HE3 LYS 9 HE3 LYS 9 -11.591 2.796 10.107 783 HZ1 LYS 9 HZ1 LYS 9 -12.376 4.545 11.444 784 HZ2 LYS 9 HZ2 LYS 9 -12.965 3.133 12.164 785 HZ3 LYS 9 HZ3 LYS 9 -13.995 4.100 11.239 786 H THR 10 H THR 10 -17.807 2.271 5.583 787 HA THR 10 HA THR 10 -18.840 -0.331 5.998 788 HB THR 10 HB THR 10 -19.826 1.465 4.501 789 HG1 THR 10 HG1 THR 10 -19.931 -0.558 2.775 790 HG21 THR 10 HG21 THR 10 -17.751 1.991 3.251 791 HG22 THR 10 HG22 THR 10 -19.091 1.556 2.188 792 HG23 THR 10 HG23 THR 10 -17.814 0.386 2.520 793 H ARG 11 H ARG 11 -18.402 -2.217 4.742 794 HA ARG 11 HA ARG 11 -15.569 -2.445 3.978 795 HB2 ARG 11 HB2 ARG 11 -15.782 -4.860 4.540 796 HB3 ARG 11 HB3 ARG 11 -16.040 -3.806 5.926 797 HG2 ARG 11 HG2 ARG 11 -18.406 -4.138 5.821 798 HG3 ARG 11 HG3 ARG 11 -18.265 -5.006 4.292 799 HD2 ARG 11 HD2 ARG 11 -16.567 -6.285 6.164 800 HD3 ARG 11 HD3 ARG 11 -18.124 -6.026 6.949 801 HE ARG 11 HE ARG 11 -18.106 -7.223 4.278 802 HH11 ARG 11 HH11 ARG 11 -18.524 -7.635 7.733 803 HH12 ARG 11 HH12 ARG 11 -19.342 -9.157 7.580 804 HH21 ARG 11 HH21 ARG 11 -19.186 -9.235 4.079 805 HH22 ARG 11 HH22 ARG 11 -19.724 -10.056 5.511 806 H VAL 12 H VAL 12 -15.056 -3.581 2.083 807 HA VAL 12 HA VAL 12 -17.349 -4.277 0.376 808 HB VAL 12 HB VAL 12 -16.478 -2.042 -0.257 809 HG11 VAL 12 HG11 VAL 12 -14.262 -1.958 -1.420 810 HG12 VAL 12 HG12 VAL 12 -13.934 -3.565 -0.770 811 HG13 VAL 12 HG13 VAL 12 -14.180 -2.204 0.324 812 HG21 VAL 12 HG21 VAL 12 -16.091 -4.254 -2.270 813 HG22 VAL 12 HG22 VAL 12 -16.176 -2.540 -2.680 814 HG23 VAL 12 HG23 VAL 12 -17.568 -3.344 -1.953 815 H SER 13 H SER 13 -17.047 -5.969 -1.027 816 HA SER 13 HA SER 13 -14.668 -7.611 -0.541 817 HB2 SER 13 HB2 SER 13 -17.290 -8.456 -1.799 818 HB3 SER 13 HB3 SER 13 -16.005 -9.503 -1.198 819 HG SER 13 HG SER 13 -16.486 -8.913 0.880 820 H VAL 14 H VAL 14 -13.142 -7.442 -2.065 821 HA VAL 14 HA VAL 14 -14.003 -7.015 -4.850 822 HB VAL 14 HB VAL 14 -11.765 -5.963 -5.242 823 HG11 VAL 14 HG11 VAL 14 -13.628 -4.571 -3.324 824 HG12 VAL 14 HG12 VAL 14 -13.761 -4.610 -5.082 825 HG13 VAL 14 HG13 VAL 14 -12.410 -3.773 -4.318 826 HG21 VAL 14 HG21 VAL 14 -10.436 -5.165 -3.442 827 HG22 VAL 14 HG22 VAL 14 -10.733 -6.877 -3.134 828 HG23 VAL 14 HG23 VAL 14 -11.639 -5.649 -2.247 829 H ARG 15 H ARG 15 -12.686 -7.971 -6.489 830 HA ARG 15 HA ARG 15 -11.567 -10.515 -5.598 831 HB2 ARG 15 HB2 ARG 15 -13.394 -10.446 -7.311 832 HB3 ARG 15 HB3 ARG 15 -12.264 -9.655 -8.402 833 HG2 ARG 15 HG2 ARG 15 -10.853 -11.586 -8.447 834 HG3 ARG 15 HG3 ARG 15 -11.807 -12.368 -7.183 835 HD2 ARG 15 HD2 ARG 15 -12.689 -11.696 -9.982 836 HD3 ARG 15 HD3 ARG 15 -12.416 -13.301 -9.312 837 HE ARG 15 HE ARG 15 -14.613 -11.490 -8.543 838 HH11 ARG 15 HH11 ARG 15 -13.255 -14.710 -8.819 839 HH12 ARG 15 HH12 ARG 15 -14.711 -15.498 -8.301 840 HH21 ARG 15 HH21 ARG 15 -16.520 -12.522 -7.888 841 HH22 ARG 15 HH22 ARG 15 -16.576 -14.254 -7.795 842 H ILE 16 H ILE 16 -9.458 -10.834 -5.552 843 HA ILE 16 HA ILE 16 -7.724 -9.366 -7.418 844 HB ILE 16 HB ILE 16 -6.967 -9.824 -4.528 845 HG12 ILE 16 HG12 ILE 16 -7.713 -7.139 -5.675 846 HG13 ILE 16 HG13 ILE 16 -8.919 -8.177 -4.922 847 HG21 ILE 16 HG21 ILE 16 -5.742 -8.039 -6.630 848 HG22 ILE 16 HG22 ILE 16 -5.139 -9.635 -6.176 849 HG23 ILE 16 HG23 ILE 16 -5.135 -8.322 -4.999 850 HD11 ILE 16 HD11 ILE 16 -8.149 -6.593 -3.315 851 HD12 ILE 16 HD12 ILE 16 -6.466 -7.011 -3.634 852 HD13 ILE 16 HD13 ILE 16 -7.534 -8.182 -2.860 853 H TYR 17 H TYR 17 -6.374 -10.694 -8.457 854 HA TYR 17 HA TYR 17 -5.219 -12.544 -9.085 855 HB2 TYR 17 HB2 TYR 17 -4.427 -12.072 -6.527 856 HB3 TYR 17 HB3 TYR 17 -5.011 -13.725 -6.391 857 HD1 TYR 17 HD2 TYR 17 -3.073 -11.837 -8.973 858 HD2 TYR 17 HD1 TYR 17 -3.291 -15.252 -6.449 859 HE1 TYR 17 HE2 TYR 17 -0.945 -12.650 -9.902 860 HE2 TYR 17 HE1 TYR 17 -1.162 -16.074 -7.367 861 HH TYR 17 HH TYR 17 0.208 -15.814 -9.360 862 H GLY 18 H GLY 18 -8.203 -12.632 -8.604 863 HA2 GLY 18 HA2 GLY 18 -9.674 -14.303 -9.367 864 HA3 GLY 18 HA3 GLY 18 -8.445 -15.507 -9.028 865 H GLN 19 H GLN 19 -8.524 -13.651 -6.334 866 HA GLN 19 HA GLN 19 -10.535 -15.400 -5.075 867 HB2 GLN 19 HB2 GLN 19 -7.951 -14.261 -4.029 868 HB3 GLN 19 HB3 GLN 19 -9.194 -14.878 -2.950 869 HG2 GLN 19 HG2 GLN 19 -8.016 -16.527 -5.163 870 HG3 GLN 19 HG3 GLN 19 -7.318 -16.458 -3.546 871 HE21 GLN 19 HE21 GLN 19 -8.516 -18.712 -4.995 872 HE22 GLN 19 HE22 GLN 19 -9.794 -19.286 -3.981 873 H ASP 20 H ASP 20 -11.782 -14.478 -3.324 874 HA ASP 20 HA ASP 20 -12.295 -11.627 -3.779 875 HB2 ASP 20 HB2 ASP 20 -14.238 -13.053 -4.044 876 HB3 ASP 20 HB3 ASP 20 -13.976 -13.771 -2.460 877 H TYR 21 H TYR 21 -11.852 -10.128 -2.277 878 HA TYR 21 HA TYR 21 -11.239 -11.034 0.458 879 HB2 TYR 21 HB2 TYR 21 -9.719 -8.912 -1.081 880 HB3 TYR 21 HB3 TYR 21 -9.392 -9.434 0.568 881 HD1 TYR 21 HD1 TYR 21 -8.498 -11.726 0.974 882 HD2 TYR 21 HD2 TYR 21 -8.897 -10.124 -2.947 883 HE1 TYR 21 HE1 TYR 21 -6.970 -13.448 0.120 884 HE2 TYR 21 HE2 TYR 21 -7.370 -11.844 -3.809 885 HH TYR 21 HH TYR 21 -5.668 -13.320 -3.060 886 H THR 22 H THR 22 -12.225 -9.889 2.027 887 HA THR 22 HA THR 22 -13.700 -7.484 1.214 888 HB THR 22 HB THR 22 -14.198 -9.252 3.613 889 HG1 THR 22 HG1 THR 22 -14.671 -10.307 1.610 890 HG21 THR 22 HG21 THR 22 -16.333 -8.051 3.747 891 HG22 THR 22 HG22 THR 22 -15.850 -7.038 2.386 892 HG23 THR 22 HG23 THR 22 -14.968 -6.948 3.911 893 H ILE 23 H ILE 23 -12.836 -5.628 1.821 894 HA ILE 23 HA ILE 23 -11.570 -5.442 4.459 895 HB ILE 23 HB ILE 23 -9.719 -4.179 3.739 896 HG12 ILE 23 HG12 ILE 23 -10.871 -2.832 1.999 897 HG13 ILE 23 HG13 ILE 23 -9.280 -3.387 1.508 898 HG21 ILE 23 HG21 ILE 23 -10.148 -6.654 2.135 899 HG22 ILE 23 HG22 ILE 23 -9.094 -6.368 3.518 900 HG23 ILE 23 HG23 ILE 23 -8.673 -5.707 1.939 901 HD11 ILE 23 HD11 ILE 23 -10.471 -3.733 -0.401 902 HD12 ILE 23 HD12 ILE 23 -11.960 -4.110 0.456 903 HD13 ILE 23 HD13 ILE 23 -10.670 -5.309 0.363 904 H VAL 24 H VAL 24 -11.088 -2.948 4.850 905 HA VAL 24 HA VAL 24 -13.653 -1.697 4.832 906 HB VAL 24 HB VAL 24 -10.964 -0.620 5.700 907 HG11 VAL 24 HG11 VAL 24 -13.736 0.471 6.171 908 HG12 VAL 24 HG12 VAL 24 -12.460 1.216 5.205 909 HG13 VAL 24 HG13 VAL 24 -12.269 1.059 6.952 910 HG21 VAL 24 HG21 VAL 24 -11.695 -2.570 6.985 911 HG22 VAL 24 HG22 VAL 24 -13.229 -1.770 7.328 912 HG23 VAL 24 HG23 VAL 24 -11.723 -1.103 7.965 913 H GLY 25 H GLY 25 -14.466 -0.315 3.372 914 HA2 GLY 25 HA2 GLY 25 -12.583 0.939 1.472 915 HA3 GLY 25 HA3 GLY 25 -14.079 0.194 0.927 916 H ALA 26 H ALA 26 -13.286 2.368 3.624 917 HA ALA 26 HA ALA 26 -15.660 3.926 3.123 918 HB1 ALA 26 HB1 ALA 26 -13.444 4.305 5.133 919 HB2 ALA 26 HB2 ALA 26 -14.987 3.500 5.417 920 HB3 ALA 26 HB3 ALA 26 -14.944 5.231 5.082 921 H GLU 27 H GLU 27 -15.130 4.640 0.994 922 HA GLU 27 HA GLU 27 -13.741 7.166 0.985 923 HB2 GLU 27 HB2 GLU 27 -11.826 5.885 0.533 924 HB3 GLU 27 HB3 GLU 27 -12.699 4.740 -0.461 925 HG2 GLU 27 HG2 GLU 27 -11.080 6.304 -1.625 926 HG3 GLU 27 HG3 GLU 27 -12.698 6.169 -2.309 927 H SER 28 H SER 28 -14.417 5.027 -1.764 928 HA SER 28 HA SER 28 -16.960 6.228 -2.338 929 HB2 SER 28 HB2 SER 28 -14.620 6.794 -4.184 930 HB3 SER 28 HB3 SER 28 -16.304 7.119 -4.565 931 HG SER 28 HG SER 28 -14.641 8.365 -2.642 932 HA PRO 29 HA PRO 29 -17.628 2.170 -3.891 933 HB2 PRO 29 HB2 PRO 29 -19.288 2.939 -6.040 934 HB3 PRO 29 HB3 PRO 29 -19.789 2.442 -4.428 935 HG2 PRO 29 HG2 PRO 29 -19.492 5.166 -5.554 936 HG3 PRO 29 HG3 PRO 29 -20.601 4.573 -4.307 937 HD2 PRO 29 HD2 PRO 29 -18.466 6.090 -3.700 938 HD3 PRO 29 HD3 PRO 29 -19.035 4.795 -2.625 939 H ALA 30 H ALA 30 -17.019 4.628 -6.431 940 HA ALA 30 HA ALA 30 -16.034 2.664 -8.263 941 HB1 ALA 30 HB1 ALA 30 -15.363 4.564 -9.656 942 HB2 ALA 30 HB2 ALA 30 -15.755 5.664 -8.337 943 HB3 ALA 30 HB3 ALA 30 -17.028 4.715 -9.099 944 H HIS 31 H HIS 31 -14.555 4.945 -6.029 945 HA HIS 31 HA HIS 31 -11.890 4.668 -6.812 946 HB2 HIS 31 HB2 HIS 31 -13.269 5.567 -4.353 947 HB3 HIS 31 HB3 HIS 31 -11.593 5.084 -4.164 948 HD1 HIS 31 HD1 HIS 31 -12.660 8.051 -3.835 949 HD2 HIS 31 HD2 HIS 31 -10.802 6.472 -7.209 950 HE1 HIS 31 HE1 HIS 31 -11.686 10.014 -5.061 951 HE2 HIS 31 HE2 HIS 31 -10.397 9.012 -6.974 952 H ILE 32 H ILE 32 -13.709 2.880 -4.353 953 HA ILE 32 HA ILE 32 -11.557 1.237 -3.544 954 HB ILE 32 HB ILE 32 -13.188 -0.135 -2.387 955 HG12 ILE 32 HG12 ILE 32 -15.257 1.446 -3.941 956 HG13 ILE 32 HG13 ILE 32 -14.931 -0.274 -4.084 957 HG21 ILE 32 HG21 ILE 32 -12.493 2.136 -1.556 958 HG22 ILE 32 HG22 ILE 32 -13.996 1.509 -0.888 959 HG23 ILE 32 HG23 ILE 32 -14.041 2.741 -2.151 960 HD11 ILE 32 HD11 ILE 32 -15.620 -0.447 -1.648 961 HD12 ILE 32 HD12 ILE 32 -16.885 -0.106 -2.828 962 HD13 ILE 32 HD13 ILE 32 -16.240 1.196 -1.828 963 H ARG 33 H ARG 33 -13.572 1.065 -6.315 964 HA ARG 33 HA ARG 33 -13.243 -1.764 -6.716 965 HB2 ARG 33 HB2 ARG 33 -14.434 0.470 -8.315 966 HB3 ARG 33 HB3 ARG 33 -14.086 -1.069 -9.092 967 HG2 ARG 33 HG2 ARG 33 -15.614 -2.225 -7.758 968 HG3 ARG 33 HG3 ARG 33 -15.684 -0.930 -6.563 969 HD2 ARG 33 HD2 ARG 33 -17.711 -0.973 -7.891 970 HD3 ARG 33 HD3 ARG 33 -16.804 0.505 -8.201 971 HE ARG 33 HE ARG 33 -16.345 -1.692 -10.052 972 HH11 ARG 33 HH11 ARG 33 -18.049 1.290 -9.371 973 HH12 ARG 33 HH12 ARG 33 -18.439 1.593 -11.034 974 HH21 ARG 33 HH21 ARG 33 -16.894 -1.303 -12.248 975 HH22 ARG 33 HH22 ARG 33 -17.808 0.116 -12.660 976 H LEU 34 H LEU 34 -11.704 1.188 -7.922 977 HA LEU 34 HA LEU 34 -10.074 -0.235 -9.796 978 HB2 LEU 34 HB2 LEU 34 -8.926 1.851 -10.183 979 HB3 LEU 34 HB3 LEU 34 -10.657 2.109 -10.166 980 HG LEU 34 HG LEU 34 -10.125 2.739 -7.614 981 HD11 LEU 34 HD11 LEU 34 -8.052 4.014 -7.486 982 HD12 LEU 34 HD12 LEU 34 -7.629 3.512 -9.122 983 HD13 LEU 34 HD13 LEU 34 -7.723 2.316 -7.829 984 HD21 LEU 34 HD21 LEU 34 -9.858 4.505 -10.039 985 HD22 LEU 34 HD22 LEU 34 -10.009 5.101 -8.390 986 HD23 LEU 34 HD23 LEU 34 -11.320 4.172 -9.114 987 H VAL 35 H VAL 35 -9.882 0.375 -6.437 988 HA VAL 35 HA VAL 35 -7.124 0.377 -5.991 989 HB VAL 35 HB VAL 35 -9.221 -0.912 -4.228 990 HG11 VAL 35 HG11 VAL 35 -6.503 0.188 -3.523 991 HG12 VAL 35 HG12 VAL 35 -6.900 -1.523 -3.673 992 HG13 VAL 35 HG13 VAL 35 -7.657 -0.549 -2.411 993 HG21 VAL 35 HG21 VAL 35 -9.837 1.377 -4.672 994 HG22 VAL 35 HG22 VAL 35 -8.203 1.924 -4.299 995 HG23 VAL 35 HG23 VAL 35 -9.218 1.249 -3.025 996 H ALA 36 H ALA 36 -9.402 -2.317 -6.226 997 HA ALA 36 HA ALA 36 -7.557 -4.387 -5.773 998 HB1 ALA 36 HB1 ALA 36 -9.240 -5.864 -6.703 999 HB2 ALA 36 HB2 ALA 36 -10.094 -4.485 -7.398 1000 HB3 ALA 36 HB3 ALA 36 -9.991 -4.667 -5.648 1001 H ALA 37 H ALA 37 -8.636 -2.812 -8.749 1002 HA ALA 37 HA ALA 37 -7.300 -4.504 -10.560 1003 HB1 ALA 37 HB1 ALA 37 -9.089 -2.955 -11.221 1004 HB2 ALA 37 HB2 ALA 37 -7.636 -2.734 -12.193 1005 HB3 ALA 37 HB3 ALA 37 -8.016 -1.593 -10.905 1006 H PHE 38 H PHE 38 -6.276 -1.745 -8.694 1007 HA PHE 38 HA PHE 38 -3.804 -1.317 -10.044 1008 HB2 PHE 38 HB2 PHE 38 -4.546 0.547 -8.858 1009 HB3 PHE 38 HB3 PHE 38 -5.015 -0.405 -7.457 1010 HD1 PHE 38 HD1 PHE 38 -1.922 0.437 -9.369 1011 HD2 PHE 38 HD2 PHE 38 -3.744 -0.183 -5.577 1012 HE1 PHE 38 HE1 PHE 38 0.189 1.040 -8.256 1013 HE2 PHE 38 HE2 PHE 38 -1.644 0.417 -4.460 1014 HZ PHE 38 HZ PHE 38 0.331 1.029 -5.799 1015 H VAL 39 H VAL 39 -4.732 -3.029 -7.081 1016 HA VAL 39 HA VAL 39 -2.108 -3.860 -6.381 1017 HB VAL 39 HB VAL 39 -4.786 -5.047 -5.615 1018 HG11 VAL 39 HG11 VAL 39 -2.061 -5.481 -4.399 1019 HG12 VAL 39 HG12 VAL 39 -3.005 -6.673 -5.288 1020 HG13 VAL 39 HG13 VAL 39 -3.584 -6.071 -3.736 1021 HG21 VAL 39 HG21 VAL 39 -3.106 -3.422 -3.775 1022 HG22 VAL 39 HG22 VAL 39 -4.858 -3.609 -3.840 1023 HG23 VAL 39 HG23 VAL 39 -4.037 -2.587 -5.017 1024 H ASP 40 H ASP 40 -4.784 -5.507 -8.040 1025 HA ASP 40 HA ASP 40 -3.593 -7.999 -8.403 1026 HB2 ASP 40 HB2 ASP 40 -6.000 -7.318 -8.859 1027 HB3 ASP 40 HB3 ASP 40 -5.435 -6.673 -10.393 1028 H ASP 41 H ASP 41 -3.423 -5.085 -10.378 1029 HA ASP 41 HA ASP 41 -1.972 -6.174 -12.538 1030 HB2 ASP 41 HB2 ASP 41 -3.142 -4.077 -12.795 1031 HB3 ASP 41 HB3 ASP 41 -2.194 -3.337 -11.511 1032 H LYS 42 H LYS 42 -0.945 -4.501 -9.589 1033 HA LYS 42 HA LYS 42 1.801 -4.403 -10.174 1034 HB2 LYS 42 HB2 LYS 42 0.383 -3.288 -8.249 1035 HB3 LYS 42 HB3 LYS 42 0.862 -4.723 -7.351 1036 HG2 LYS 42 HG2 LYS 42 2.832 -3.821 -6.914 1037 HG3 LYS 42 HG3 LYS 42 3.164 -3.643 -8.636 1038 HD2 LYS 42 HD2 LYS 42 1.552 -1.567 -8.369 1039 HD3 LYS 42 HD3 LYS 42 2.086 -1.673 -6.692 1040 HE2 LYS 42 HE2 LYS 42 3.625 -0.223 -7.648 1041 HE3 LYS 42 HE3 LYS 42 4.456 -1.777 -7.674 1042 HZ1 LYS 42 HZ1 LYS 42 3.788 -2.028 -10.010 1043 HZ2 LYS 42 HZ2 LYS 42 4.729 -0.643 -9.765 1044 HZ3 LYS 42 HZ3 LYS 42 3.059 -0.498 -9.961 1045 H MET 43 H MET 43 -0.204 -6.907 -8.754 1046 HA MET 43 HA MET 43 1.940 -8.583 -7.909 1047 HB2 MET 43 HB2 MET 43 -0.940 -9.225 -8.556 1048 HB3 MET 43 HB3 MET 43 0.189 -10.364 -7.832 1049 HG2 MET 43 HG2 MET 43 0.419 -8.942 -5.887 1050 HG3 MET 43 HG3 MET 43 -0.640 -7.737 -6.617 1051 HE1 MET 43 HE1 MET 43 -0.330 -11.173 -4.867 1052 HE2 MET 43 HE2 MET 43 -0.874 -11.697 -6.462 1053 HE3 MET 43 HE3 MET 43 -1.937 -11.876 -5.069 1054 H HIS 44 H HIS 44 0.274 -8.095 -10.912 1055 HA HIS 44 HA HIS 44 1.203 -10.512 -12.131 1056 HB2 HIS 44 HB2 HIS 44 -0.794 -8.791 -12.753 1057 HB3 HIS 44 HB3 HIS 44 0.442 -8.269 -13.894 1058 HD1 HIS 44 HD1 HIS 44 -2.229 -10.637 -13.546 1059 HD2 HIS 44 HD2 HIS 44 1.457 -10.610 -15.473 1060 HE1 HIS 44 HE1 HIS 44 -2.347 -12.474 -15.262 1061 HE2 HIS 44 HE2 HIS 44 -0.063 -12.525 -16.321 1062 H GLU 45 H GLU 45 2.334 -7.166 -12.012 1063 HA GLU 45 HA GLU 45 4.318 -7.514 -14.029 1064 HB2 GLU 45 HB2 GLU 45 5.076 -5.343 -13.484 1065 HB3 GLU 45 HB3 GLU 45 3.334 -5.313 -13.263 1066 HG2 GLU 45 HG2 GLU 45 3.687 -5.626 -10.823 1067 HG3 GLU 45 HG3 GLU 45 5.426 -5.498 -11.099 1068 H PHE 46 H PHE 46 4.244 -8.093 -10.587 1069 HA PHE 46 HA PHE 46 7.127 -8.448 -10.489 1070 HB2 PHE 46 HB2 PHE 46 4.948 -8.365 -8.452 1071 HB3 PHE 46 HB3 PHE 46 6.463 -9.165 -8.044 1072 HD1 PHE 46 HD2 PHE 46 8.619 -7.830 -8.371 1073 HD2 PHE 46 HD1 PHE 46 4.754 -6.059 -8.270 1074 HE1 PHE 46 HE2 PHE 46 9.640 -5.653 -7.854 1075 HE2 PHE 46 HE1 PHE 46 5.765 -3.873 -7.757 1076 HZ PHE 46 HZ PHE 46 8.210 -3.667 -7.549 1077 H SER 47 H SER 47 4.405 -10.335 -11.153 1078 HA SER 47 HA SER 47 5.279 -12.816 -10.075 1079 HB2 SER 47 HB2 SER 47 2.911 -12.319 -10.695 1080 HB3 SER 47 HB3 SER 47 3.382 -12.353 -12.393 1081 HG SER 47 HG SER 47 4.281 -14.576 -11.597 1082 H GLU 48 H GLU 48 6.148 -11.016 -12.885 1083 HA GLU 48 HA GLU 48 7.211 -13.303 -14.304 1084 HB2 GLU 48 HB2 GLU 48 7.894 -11.748 -16.001 1085 HB3 GLU 48 HB3 GLU 48 6.264 -11.324 -15.493 1086 HG2 GLU 48 HG2 GLU 48 6.893 -9.281 -14.898 1087 HG3 GLU 48 HG3 GLU 48 8.240 -9.904 -13.946 1088 H LYS 49 H LYS 49 8.219 -11.452 -11.734 1089 HA LYS 49 HA LYS 49 11.046 -11.478 -12.398 1090 HB2 LYS 49 HB2 LYS 49 9.833 -10.782 -9.721 1091 HB3 LYS 49 HB3 LYS 49 11.414 -10.326 -10.336 1092 HG2 LYS 49 HG2 LYS 49 8.823 -9.369 -11.529 1093 HG3 LYS 49 HG3 LYS 49 9.718 -8.493 -10.293 1094 HD2 LYS 49 HD2 LYS 49 11.034 -9.328 -12.848 1095 HD3 LYS 49 HD3 LYS 49 10.061 -7.863 -12.771 1096 HE2 LYS 49 HE2 LYS 49 11.500 -7.144 -10.832 1097 HE3 LYS 49 HE3 LYS 49 12.548 -8.512 -11.203 1098 HZ1 LYS 49 HZ1 LYS 49 13.166 -7.591 -13.230 1099 HZ2 LYS 49 HZ2 LYS 49 13.131 -6.250 -12.198 1100 HZ3 LYS 49 HZ3 LYS 49 11.858 -6.523 -13.271 1101 H GLN 50 H GLN 50 8.841 -12.995 -10.097 1102 HA GLN 50 HA GLN 50 8.956 -14.860 -8.816 1103 HB2 GLN 50 HB2 GLN 50 10.745 -15.711 -11.093 1104 HB3 GLN 50 HB3 GLN 50 10.189 -16.807 -9.832 1105 HG2 GLN 50 HG2 GLN 50 8.100 -16.936 -10.679 1106 HG3 GLN 50 HG3 GLN 50 8.094 -15.254 -11.205 1107 HE21 GLN 50 HE21 GLN 50 8.825 -18.522 -12.057 1108 HE22 GLN 50 HE22 GLN 50 9.131 -18.230 -13.734 1109 HA PRO 51 HA PRO 51 12.937 -13.306 -6.893 1110 HB2 PRO 51 HB2 PRO 51 11.736 -13.257 -4.370 1111 HB3 PRO 51 HB3 PRO 51 11.971 -11.867 -5.432 1112 HG2 PRO 51 HG2 PRO 51 9.536 -13.502 -4.959 1113 HG3 PRO 51 HG3 PRO 51 9.681 -11.782 -5.347 1114 HD2 PRO 51 HD2 PRO 51 8.893 -13.635 -7.151 1115 HD3 PRO 51 HD3 PRO 51 9.783 -12.169 -7.607 1116 H MET 52 H MET 52 10.862 -15.197 -4.702 1117 HA MET 52 HA MET 52 12.987 -17.227 -4.633 1118 HB2 MET 52 HB2 MET 52 12.127 -17.825 -2.387 1119 HB3 MET 52 HB3 MET 52 12.706 -16.172 -2.481 1120 HG2 MET 52 HG2 MET 52 9.801 -16.800 -2.824 1121 HG3 MET 52 HG3 MET 52 10.519 -16.651 -1.222 1122 HE1 MET 52 HE1 MET 52 12.711 -14.215 -1.732 1123 HE2 MET 52 HE2 MET 52 11.704 -14.582 -0.332 1124 HE3 MET 52 HE3 MET 52 11.658 -12.972 -1.056 1125 H LEU 53 H LEU 53 10.380 -16.814 -6.273 1126 HA LEU 53 HA LEU 53 8.801 -18.103 -7.275 1127 HB2 LEU 53 HB2 LEU 53 10.828 -20.135 -6.416 1128 HB3 LEU 53 HB3 LEU 53 9.334 -20.655 -7.169 1129 HG LEU 53 HG LEU 53 9.925 -19.179 -9.130 1130 HD11 LEU 53 HD11 LEU 53 12.284 -18.556 -9.381 1131 HD12 LEU 53 HD12 LEU 53 12.593 -19.083 -7.726 1132 HD13 LEU 53 HD13 LEU 53 11.525 -17.713 -8.029 1133 HD21 LEU 53 HD21 LEU 53 10.211 -21.576 -9.218 1134 HD22 LEU 53 HD22 LEU 53 11.774 -21.447 -8.408 1135 HD23 LEU 53 HD23 LEU 53 11.561 -20.784 -10.029 1136 H ASP 54 H ASP 54 7.849 -17.245 -4.923 1137 HA ASP 54 HA ASP 54 6.263 -19.531 -4.015 1138 HB2 ASP 54 HB2 ASP 54 8.189 -19.062 -2.417 1139 HB3 ASP 54 HB3 ASP 54 7.398 -17.534 -2.058 1140 H VAL 55 H VAL 55 4.156 -19.068 -3.810 1141 HA VAL 55 HA VAL 55 3.107 -16.724 -4.908 1142 HB VAL 55 HB VAL 55 1.646 -18.703 -3.161 1143 HG11 VAL 55 HG11 VAL 55 -0.352 -17.965 -4.343 1144 HG12 VAL 55 HG12 VAL 55 0.605 -16.809 -5.267 1145 HG13 VAL 55 HG13 VAL 55 0.421 -16.607 -3.525 1146 HG21 VAL 55 HG21 VAL 55 2.836 -19.756 -5.059 1147 HG22 VAL 55 HG22 VAL 55 1.951 -18.698 -6.161 1148 HG23 VAL 55 HG23 VAL 55 1.081 -19.883 -5.184 1149 HA PRO 56 HA PRO 56 1.694 -15.352 -0.456 1150 HB2 PRO 56 HB2 PRO 56 3.296 -16.291 1.587 1151 HB3 PRO 56 HB3 PRO 56 1.713 -16.953 1.160 1152 HG2 PRO 56 HG2 PRO 56 4.439 -17.937 0.435 1153 HG3 PRO 56 HG3 PRO 56 2.991 -18.860 0.878 1154 HD2 PRO 56 HD2 PRO 56 3.797 -18.625 -1.676 1155 HD3 PRO 56 HD3 PRO 56 2.080 -18.683 -1.239 1156 H LYS 57 H LYS 57 5.084 -16.023 -1.087 1157 HA LYS 57 HA LYS 57 6.049 -13.703 0.269 1158 HB2 LYS 57 HB2 LYS 57 7.250 -15.769 -1.522 1159 HB3 LYS 57 HB3 LYS 57 8.143 -14.293 -1.220 1160 HG2 LYS 57 HG2 LYS 57 8.657 -16.307 0.256 1161 HG3 LYS 57 HG3 LYS 57 8.386 -14.763 1.062 1162 HD2 LYS 57 HD2 LYS 57 6.214 -15.401 1.757 1163 HD3 LYS 57 HD3 LYS 57 6.199 -16.792 0.675 1164 HE2 LYS 57 HE2 LYS 57 8.075 -16.478 3.010 1165 HE3 LYS 57 HE3 LYS 57 6.547 -17.352 3.079 1166 HZ1 LYS 57 HZ1 LYS 57 7.525 -18.626 1.072 1167 HZ2 LYS 57 HZ2 LYS 57 8.041 -19.018 2.639 1168 HZ3 LYS 57 HZ3 LYS 57 9.016 -18.057 1.645 1169 H LEU 58 H LEU 58 4.870 -14.397 -2.908 1170 HA LEU 58 HA LEU 58 5.952 -12.045 -4.143 1171 HB2 LEU 58 HB2 LEU 58 5.241 -14.254 -5.267 1172 HB3 LEU 58 HB3 LEU 58 3.601 -13.679 -5.106 1173 HG LEU 58 HG LEU 58 4.628 -13.392 -7.376 1174 HD11 LEU 58 HD11 LEU 58 3.706 -10.892 -5.982 1175 HD12 LEU 58 HD12 LEU 58 2.685 -12.106 -6.753 1176 HD13 LEU 58 HD13 LEU 58 3.777 -11.122 -7.730 1177 HD21 LEU 58 HD21 LEU 58 6.877 -12.667 -6.363 1178 HD22 LEU 58 HD22 LEU 58 6.141 -11.064 -6.263 1179 HD23 LEU 58 HD23 LEU 58 6.307 -11.862 -7.822 1180 H ALA 59 H ALA 59 2.880 -13.037 -2.748 1181 HA ALA 59 HA ALA 59 1.379 -10.752 -3.394 1182 HB1 ALA 59 HB1 ALA 59 1.081 -12.771 -1.183 1183 HB2 ALA 59 HB2 ALA 59 0.244 -12.730 -2.736 1184 HB3 ALA 59 HB3 ALA 59 -0.099 -11.505 -1.517 1185 H VAL 60 H VAL 60 3.481 -11.469 -0.652 1186 HA VAL 60 HA VAL 60 2.749 -9.067 0.754 1187 HB VAL 60 HB VAL 60 3.541 -11.192 1.878 1188 HG11 VAL 60 HG11 VAL 60 6.316 -10.228 1.310 1189 HG12 VAL 60 HG12 VAL 60 5.519 -11.400 0.263 1190 HG13 VAL 60 HG13 VAL 60 5.791 -11.780 1.966 1191 HG21 VAL 60 HG21 VAL 60 4.965 -8.626 2.556 1192 HG22 VAL 60 HG22 VAL 60 4.765 -10.001 3.641 1193 HG23 VAL 60 HG23 VAL 60 3.352 -9.100 3.086 1194 H LEU 61 H LEU 61 5.040 -9.964 -1.648 1195 HA LEU 61 HA LEU 61 6.999 -7.985 -1.236 1196 HB2 LEU 61 HB2 LEU 61 7.339 -9.939 -2.673 1197 HB3 LEU 61 HB3 LEU 61 6.125 -9.346 -3.787 1198 HG LEU 61 HG LEU 61 7.631 -7.306 -4.105 1199 HD11 LEU 61 HD11 LEU 61 9.045 -7.654 -2.148 1200 HD12 LEU 61 HD12 LEU 61 9.998 -7.653 -3.633 1201 HD13 LEU 61 HD13 LEU 61 9.622 -9.176 -2.827 1202 HD21 LEU 61 HD21 LEU 61 8.561 -10.029 -5.004 1203 HD22 LEU 61 HD22 LEU 61 9.044 -8.496 -5.728 1204 HD23 LEU 61 HD23 LEU 61 7.361 -9.016 -5.803 1205 H THR 62 H THR 62 4.023 -8.028 -3.147 1206 HA THR 62 HA THR 62 4.406 -5.419 -4.219 1207 HB THR 62 HB THR 62 1.796 -5.717 -4.558 1208 HG1 THR 62 HG1 THR 62 1.397 -7.533 -3.382 1209 HG21 THR 62 HG21 THR 62 3.624 -5.765 -6.285 1210 HG22 THR 62 HG22 THR 62 2.232 -6.786 -6.638 1211 HG23 THR 62 HG23 THR 62 3.721 -7.509 -6.027 1212 H ALA 63 H ALA 63 2.828 -6.705 -1.366 1213 HA ALA 63 HA ALA 63 1.277 -4.502 -0.628 1214 HB1 ALA 63 HB1 ALA 63 1.146 -6.744 0.416 1215 HB2 ALA 63 HB2 ALA 63 1.264 -5.440 1.597 1216 HB3 ALA 63 HB3 ALA 63 2.679 -6.425 1.226 1217 H VAL 64 H VAL 64 4.611 -5.327 0.279 1218 HA VAL 64 HA VAL 64 4.983 -2.938 1.785 1219 HB VAL 64 HB VAL 64 6.229 -5.066 2.181 1220 HG11 VAL 64 HG11 VAL 64 7.663 -4.248 -0.332 1221 HG12 VAL 64 HG12 VAL 64 6.785 -5.749 -0.031 1222 HG13 VAL 64 HG13 VAL 64 8.290 -5.422 0.825 1223 HG21 VAL 64 HG21 VAL 64 8.412 -3.949 2.634 1224 HG22 VAL 64 HG22 VAL 64 7.005 -3.086 3.249 1225 HG23 VAL 64 HG23 VAL 64 7.802 -2.533 1.775 1226 H GLN 65 H GLN 65 5.412 -3.801 -1.542 1227 HA GLN 65 HA GLN 65 7.151 -1.672 -2.254 1228 HB2 GLN 65 HB2 GLN 65 6.342 -3.885 -3.547 1229 HB3 GLN 65 HB3 GLN 65 5.228 -2.727 -4.263 1230 HG2 GLN 65 HG2 GLN 65 8.168 -2.147 -4.185 1231 HG3 GLN 65 HG3 GLN 65 7.489 -3.188 -5.438 1232 HE21 GLN 65 HE21 GLN 65 8.759 -0.573 -5.659 1233 HE22 GLN 65 HE22 GLN 65 7.606 0.453 -6.431 1234 H ILE 66 H ILE 66 3.635 -2.114 -2.457 1235 HA ILE 66 HA ILE 66 2.967 0.365 -3.548 1236 HB ILE 66 HB ILE 66 1.417 -1.430 -1.673 1237 HG12 ILE 66 HG12 ILE 66 1.062 -0.945 -4.635 1238 HG13 ILE 66 HG13 ILE 66 2.031 -2.258 -3.977 1239 HG21 ILE 66 HG21 ILE 66 -0.579 -0.166 -2.234 1240 HG22 ILE 66 HG22 ILE 66 0.376 0.933 -3.230 1241 HG23 ILE 66 HG23 ILE 66 0.620 0.885 -1.485 1242 HD11 ILE 66 HD11 ILE 66 -0.935 -1.856 -3.714 1243 HD12 ILE 66 HD12 ILE 66 -0.026 -3.062 -2.803 1244 HD13 ILE 66 HD13 ILE 66 -0.084 -3.145 -4.564 1245 H ALA 67 H ALA 67 3.248 -0.628 -0.153 1246 HA ALA 67 HA ALA 67 2.497 1.795 1.027 1247 HB1 ALA 67 HB1 ALA 67 3.436 0.950 3.047 1248 HB2 ALA 67 HB2 ALA 67 4.488 -0.156 2.164 1249 HB3 ALA 67 HB3 ALA 67 2.744 -0.416 2.172 1250 H SER 68 H SER 68 5.695 0.612 0.075 1251 HA SER 68 HA SER 68 7.257 2.654 1.146 1252 HB2 SER 68 HB2 SER 68 8.103 0.495 0.194 1253 HB3 SER 68 HB3 SER 68 7.801 1.139 -1.418 1254 HG SER 68 HG SER 68 9.958 1.471 -0.841 1255 H GLU 69 H GLU 69 5.760 2.415 -2.072 1256 HA GLU 69 HA GLU 69 6.856 4.884 -2.972 1257 HB2 GLU 69 HB2 GLU 69 4.530 3.313 -4.081 1258 HB3 GLU 69 HB3 GLU 69 5.409 4.590 -4.913 1259 HG2 GLU 69 HG2 GLU 69 6.419 1.873 -4.117 1260 HG3 GLU 69 HG3 GLU 69 6.211 2.516 -5.744 1261 H TYR 70 H TYR 70 3.740 3.974 -1.565 1262 HA TYR 70 HA TYR 70 2.535 6.514 -2.045 1263 HB2 TYR 70 HB2 TYR 70 1.801 4.082 -0.499 1264 HB3 TYR 70 HB3 TYR 70 0.994 5.587 -0.079 1265 HD1 TYR 70 HD2 TYR 70 1.492 3.081 -2.711 1266 HD2 TYR 70 HD1 TYR 70 -0.587 6.614 -1.584 1267 HE1 TYR 70 HE2 TYR 70 -0.055 2.764 -4.590 1268 HE2 TYR 70 HE1 TYR 70 -2.143 6.304 -3.460 1269 HH TYR 70 HH TYR 70 -2.144 5.164 -5.676 1270 H LEU 71 H LEU 71 4.610 5.281 0.436 1271 HA LEU 71 HA LEU 71 3.952 7.181 2.448 1272 HB2 LEU 71 HB2 LEU 71 6.070 5.172 2.020 1273 HB3 LEU 71 HB3 LEU 71 6.533 6.538 3.017 1274 HG LEU 71 HG LEU 71 4.008 4.996 3.578 1275 HD11 LEU 71 HD11 LEU 71 5.739 3.327 3.619 1276 HD12 LEU 71 HD12 LEU 71 5.266 3.721 5.270 1277 HD13 LEU 71 HD13 LEU 71 6.768 4.365 4.611 1278 HD21 LEU 71 HD21 LEU 71 4.594 7.290 4.592 1279 HD22 LEU 71 HD22 LEU 71 5.764 6.393 5.562 1280 HD23 LEU 71 HD23 LEU 71 4.047 6.002 5.663 1281 H LYS 72 H LYS 72 6.192 7.211 -0.266 1282 HA LYS 72 HA LYS 72 7.590 9.558 0.486 1283 HB2 LYS 72 HB2 LYS 72 7.148 8.935 -2.400 1284 HB3 LYS 72 HB3 LYS 72 8.603 9.494 -1.589 1285 HG2 LYS 72 HG2 LYS 72 8.520 7.114 -0.487 1286 HG3 LYS 72 HG3 LYS 72 7.543 6.732 -1.906 1287 HD2 LYS 72 HD2 LYS 72 9.501 7.943 -3.180 1288 HD3 LYS 72 HD3 LYS 72 10.414 7.522 -1.730 1289 HE2 LYS 72 HE2 LYS 72 9.016 5.679 -3.652 1290 HE3 LYS 72 HE3 LYS 72 10.737 5.767 -3.289 1291 HZ1 LYS 72 HZ1 LYS 72 8.772 5.063 -1.198 1292 HZ2 LYS 72 HZ2 LYS 72 10.432 4.737 -1.245 1293 HZ3 LYS 72 HZ3 LYS 72 9.371 3.889 -2.263 1294 H LEU 73 H LEU 73 4.726 8.966 -1.483 1295 HA LEU 73 HA LEU 73 4.359 11.588 -2.410 1296 HB2 LEU 73 HB2 LEU 73 3.283 9.546 -3.348 1297 HB3 LEU 73 HB3 LEU 73 2.253 9.477 -1.936 1298 HG LEU 73 HG LEU 73 1.143 11.533 -2.572 1299 HD11 LEU 73 HD11 LEU 73 3.223 11.640 -4.742 1300 HD12 LEU 73 HD12 LEU 73 2.842 12.862 -3.525 1301 HD13 LEU 73 HD13 LEU 73 1.706 12.534 -4.832 1302 HD21 LEU 73 HD21 LEU 73 0.352 9.438 -3.546 1303 HD22 LEU 73 HD22 LEU 73 1.413 9.686 -4.933 1304 HD23 LEU 73 HD23 LEU 73 0.087 10.807 -4.626 1305 H LYS 74 H LYS 74 3.226 9.958 0.520 1306 HA LYS 74 HA LYS 74 1.553 12.115 1.354 1307 HB2 LYS 74 HB2 LYS 74 1.140 10.910 3.300 1308 HB3 LYS 74 HB3 LYS 74 1.499 9.644 2.134 1309 HG2 LYS 74 HG2 LYS 74 3.486 9.107 3.126 1310 HG3 LYS 74 HG3 LYS 74 3.732 10.724 3.769 1311 HD2 LYS 74 HD2 LYS 74 1.460 9.091 4.795 1312 HD3 LYS 74 HD3 LYS 74 3.094 8.735 5.356 1313 HE2 LYS 74 HE2 LYS 74 2.098 11.537 5.361 1314 HE3 LYS 74 HE3 LYS 74 1.615 10.435 6.646 1315 HZ1 LYS 74 HZ1 LYS 74 4.041 10.006 6.986 1316 HZ2 LYS 74 HZ2 LYS 74 3.533 11.562 7.386 1317 HZ3 LYS 74 HZ3 LYS 74 4.370 11.297 5.939 1318 H GLU 75 H GLU 75 4.934 11.422 1.615 1319 HA GLU 75 HA GLU 75 5.425 13.246 3.773 1320 HB2 GLU 75 HB2 GLU 75 6.902 11.240 2.545 1321 HB3 GLU 75 HB3 GLU 75 7.716 12.715 2.036 1322 HG2 GLU 75 HG2 GLU 75 8.739 11.899 4.037 1323 HG3 GLU 75 HG3 GLU 75 7.882 13.395 4.399 1324 H GLU 76 H GLU 76 5.763 13.299 0.258 1325 HA GLU 76 HA GLU 76 6.790 15.888 -0.031 1326 HB2 GLU 76 HB2 GLU 76 6.820 14.487 -1.941 1327 HB3 GLU 76 HB3 GLU 76 5.104 14.131 -1.808 1328 HG2 GLU 76 HG2 GLU 76 4.476 16.176 -2.717 1329 HG3 GLU 76 HG3 GLU 76 6.041 16.916 -2.377 1330 H TYR 77 H TYR 77 3.519 14.672 0.280 1331 HA TYR 77 HA TYR 77 1.991 16.898 -0.254 1332 HB2 TYR 77 HB2 TYR 77 0.859 14.875 0.072 1333 HB3 TYR 77 HB3 TYR 77 1.669 14.557 1.598 1334 HD1 TYR 77 HD1 TYR 77 -0.509 17.265 0.210 1335 HD2 TYR 77 HD2 TYR 77 0.272 14.590 3.416 1336 HE1 TYR 77 HE1 TYR 77 -2.481 18.124 1.390 1337 HE2 TYR 77 HE2 TYR 77 -1.699 15.440 4.616 1338 HH TYR 77 HH TYR 77 -4.118 16.895 3.395 1339 H GLN 78 H GLN 78 3.648 16.043 2.752 1340 HA GLN 78 HA GLN 78 2.650 18.434 4.071 1341 HB2 GLN 78 HB2 GLN 78 4.353 16.121 4.967 1342 HB3 GLN 78 HB3 GLN 78 4.137 17.554 5.962 1343 HG2 GLN 78 HG2 GLN 78 1.924 15.771 4.974 1344 HG3 GLN 78 HG3 GLN 78 2.613 15.754 6.597 1345 HE21 GLN 78 HE21 GLN 78 -0.126 16.265 5.790 1346 HE22 GLN 78 HE22 GLN 78 -0.520 17.848 6.364 1347 H ARG 79 H ARG 79 5.403 17.414 2.316 1348 HA ARG 79 HA ARG 79 7.355 19.128 3.442 1349 HB2 ARG 79 HB2 ARG 79 7.406 17.121 1.558 1350 HB3 ARG 79 HB3 ARG 79 7.707 18.558 0.591 1351 HG2 ARG 79 HG2 ARG 79 9.265 17.754 3.035 1352 HG3 ARG 79 HG3 ARG 79 9.769 17.481 1.366 1353 HD2 ARG 79 HD2 ARG 79 10.093 19.755 0.969 1354 HD3 ARG 79 HD3 ARG 79 9.089 20.233 2.335 1355 HE ARG 79 HE ARG 79 10.864 19.661 3.801 1356 HH11 ARG 79 HH11 ARG 79 11.742 19.462 0.410 1357 HH12 ARG 79 HH12 ARG 79 13.445 19.586 0.724 1358 HH21 ARG 79 HH21 ARG 79 13.075 19.789 4.219 1359 HH22 ARG 79 HH22 ARG 79 14.208 19.763 2.902 1360 H LEU 80 H LEU 80 5.306 19.473 0.554 1361 HA LEU 80 HA LEU 80 6.271 22.076 -0.056 1362 HB2 LEU 80 HB2 LEU 80 4.550 22.172 -1.707 1363 HB3 LEU 80 HB3 LEU 80 5.205 20.550 -1.698 1364 HG LEU 80 HG LEU 80 3.034 20.437 0.061 1365 HD11 LEU 80 HD11 LEU 80 2.260 22.600 -0.803 1366 HD12 LEU 80 HD12 LEU 80 1.155 21.290 -1.213 1367 HD13 LEU 80 HD13 LEU 80 2.246 21.934 -2.438 1368 HD21 LEU 80 HD21 LEU 80 3.738 18.656 -1.427 1369 HD22 LEU 80 HD22 LEU 80 3.225 19.598 -2.829 1370 HD23 LEU 80 HD23 LEU 80 2.031 19.022 -1.668 1371 H ARG 81 H ARG 81 3.861 20.868 2.101 1372 HA ARG 81 HA ARG 81 2.392 23.310 2.317 1373 HB2 ARG 81 HB2 ARG 81 2.438 20.762 3.914 1374 HB3 ARG 81 HB3 ARG 81 1.485 22.149 4.423 1375 HG2 ARG 81 HG2 ARG 81 0.296 22.095 2.264 1376 HG3 ARG 81 HG3 ARG 81 1.229 20.667 1.815 1377 HD2 ARG 81 HD2 ARG 81 -1.135 20.334 2.773 1378 HD3 ARG 81 HD3 ARG 81 0.168 19.324 3.385 1379 HE ARG 81 HE ARG 81 -0.048 20.327 5.441 1380 HH11 ARG 81 HH11 ARG 81 -1.911 22.130 3.097 1381 HH12 ARG 81 HH12 ARG 81 -2.756 23.057 4.291 1382 HH21 ARG 81 HH21 ARG 81 -1.176 21.519 7.018 1383 HH22 ARG 81 HH22 ARG 81 -2.344 22.705 6.525 1384 H GLU 82 H GLU 82 4.959 21.759 4.230 1385 HA GLU 82 HA GLU 82 4.955 23.761 6.252 1386 HB2 GLU 82 HB2 GLU 82 7.034 22.779 7.030 1387 HB3 GLU 82 HB3 GLU 82 5.877 21.510 6.645 1388 HG2 GLU 82 HG2 GLU 82 7.026 20.938 4.661 1389 HG3 GLU 82 HG3 GLU 82 8.023 22.390 4.734 1390 H GLN 83 H GLN 83 6.337 23.546 3.108 1391 HA GLN 83 HA GLN 83 8.425 25.440 3.427 1392 HB2 GLN 83 HB2 GLN 83 8.348 23.825 1.576 1393 HB3 GLN 83 HB3 GLN 83 6.917 24.617 0.939 1394 HG2 GLN 83 HG2 GLN 83 8.228 26.662 0.584 1395 HG3 GLN 83 HG3 GLN 83 9.664 25.823 1.170 1396 HE21 GLN 83 HE21 GLN 83 7.360 26.121 -1.410 1397 HE22 GLN 83 HE22 GLN 83 8.244 25.198 -2.580 1398 H LEU 84 H LEU 84 5.014 25.723 2.606 1399 HA LEU 84 HA LEU 84 5.163 28.439 1.765 1400 HB2 LEU 84 HB2 LEU 84 3.357 26.990 1.019 1401 HB3 LEU 84 HB3 LEU 84 2.809 26.789 2.671 1402 HG LEU 84 HG LEU 84 2.209 29.172 2.785 1403 HD11 LEU 84 HD11 LEU 84 2.179 30.522 0.713 1404 HD12 LEU 84 HD12 LEU 84 3.108 29.258 -0.090 1405 HD13 LEU 84 HD13 LEU 84 3.806 30.138 1.272 1406 HD21 LEU 84 HD21 LEU 84 0.478 27.622 2.090 1407 HD22 LEU 84 HD22 LEU 84 1.010 27.744 0.411 1408 HD23 LEU 84 HD23 LEU 84 0.314 29.146 1.222 1409 H LYS 85 H LYS 85 4.127 26.895 4.803 1410 HA LYS 85 HA LYS 85 3.648 29.443 6.066 1411 HB2 LYS 85 HB2 LYS 85 3.091 28.155 8.041 1412 HB3 LYS 85 HB3 LYS 85 2.316 27.445 6.630 1413 HG2 LYS 85 HG2 LYS 85 3.709 25.596 6.625 1414 HG3 LYS 85 HG3 LYS 85 4.958 26.413 7.565 1415 HD2 LYS 85 HD2 LYS 85 3.333 26.418 9.501 1416 HD3 LYS 85 HD3 LYS 85 2.313 25.347 8.538 1417 HE2 LYS 85 HE2 LYS 85 3.901 23.627 8.562 1418 HE3 LYS 85 HE3 LYS 85 5.199 24.715 9.057 1419 HZ1 LYS 85 HZ1 LYS 85 4.150 24.938 11.213 1420 HZ2 LYS 85 HZ2 LYS 85 4.453 23.311 10.878 1421 HZ3 LYS 85 HZ3 LYS 85 2.881 23.922 10.741 1422 H LYS 86 H LYS 86 6.421 27.621 5.481 1423 HA LYS 86 HA LYS 86 7.904 29.177 7.464 1424 HB2 LYS 86 HB2 LYS 86 7.523 27.058 8.561 1425 HB3 LYS 86 HB3 LYS 86 8.031 26.179 7.128 1426 HG2 LYS 86 HG2 LYS 86 10.295 27.356 7.477 1427 HG3 LYS 86 HG3 LYS 86 9.700 27.681 9.103 1428 HD2 LYS 86 HD2 LYS 86 11.086 25.604 8.880 1429 HD3 LYS 86 HD3 LYS 86 9.489 25.355 9.580 1430 HE2 LYS 86 HE2 LYS 86 10.179 23.635 7.892 1431 HE3 LYS 86 HE3 LYS 86 8.651 24.435 7.542 1432 HZ1 LYS 86 HZ1 LYS 86 11.275 24.903 6.245 1433 HZ2 LYS 86 HZ2 LYS 86 9.956 25.944 6.037 1434 HZ3 LYS 86 HZ3 LYS 86 9.853 24.332 5.532 Start of MODEL 16 1 H1 GLY 1 H1 GLY 1 41.568 -1.386 -13.149 2 H2 GLY 1 H2 GLY 1 41.104 -2.957 -12.730 3 H3 GLY 1 H3 GLY 1 41.344 -1.793 -11.525 4 HA2 GLY 1 HA3 GLY 1 39.217 -1.770 -13.582 5 HA3 GLY 1 HA2 GLY 1 39.001 -2.116 -11.873 6 H SER 2 H SER 2 38.731 0.227 -14.177 7 HA SER 2 HA SER 2 38.490 2.284 -12.131 8 HB2 SER 2 HB2 SER 2 40.124 2.691 -14.650 9 HB3 SER 2 HB3 SER 2 39.755 3.932 -13.450 10 HG SER 2 HG SER 2 40.780 2.054 -12.041 11 H HIS 3 H HIS 3 36.629 3.305 -12.367 12 HA HIS 3 HA HIS 3 35.609 4.067 -14.934 13 HB2 HIS 3 HB2 HIS 3 33.429 2.906 -14.711 14 HB3 HIS 3 HB3 HIS 3 34.765 1.787 -14.942 15 HD1 HIS 3 HD1 HIS 3 34.910 -0.091 -13.330 16 HD2 HIS 3 HD2 HIS 3 32.548 3.016 -11.894 17 HE1 HIS 3 HE1 HIS 3 33.880 -0.949 -11.202 18 HE2 HIS 3 HE2 HIS 3 32.546 0.987 -10.293 19 H MET 4 H MET 4 33.328 5.106 -14.546 20 HA MET 4 HA MET 4 33.725 6.964 -12.378 21 HB2 MET 4 HB2 MET 4 31.602 6.797 -14.521 22 HB3 MET 4 HB3 MET 4 31.698 8.083 -13.328 23 HG2 MET 4 HG2 MET 4 33.962 8.633 -14.168 24 HG3 MET 4 HG3 MET 4 33.751 7.420 -15.427 25 HE1 MET 4 HE1 MET 4 31.408 11.366 -15.072 26 HE2 MET 4 HE2 MET 4 32.638 10.792 -13.947 27 HE3 MET 4 HE3 MET 4 31.058 10.013 -13.998 28 H THR 5 H THR 5 32.481 7.227 -10.586 29 HA THR 5 HA THR 5 30.942 4.923 -9.751 30 HB THR 5 HB THR 5 31.189 7.384 -8.073 31 HG1 THR 5 HG1 THR 5 33.335 5.788 -7.722 32 HG21 THR 5 HG21 THR 5 31.493 5.718 -6.295 33 HG22 THR 5 HG22 THR 5 31.448 4.430 -7.499 34 HG23 THR 5 HG23 THR 5 30.014 5.414 -7.213 35 H GLU 6 H GLU 6 28.768 4.891 -9.264 36 HA GLU 6 HA GLU 6 27.202 7.325 -9.657 37 HB2 GLU 6 HB2 GLU 6 25.567 6.015 -11.066 38 HB3 GLU 6 HB3 GLU 6 27.097 6.393 -11.847 39 HG2 GLU 6 HG2 GLU 6 27.877 4.099 -11.228 40 HG3 GLU 6 HG3 GLU 6 26.232 3.756 -10.693 41 H GLN 7 H GLN 7 25.174 7.286 -8.647 42 HA GLN 7 HA GLN 7 24.736 5.019 -6.824 43 HB2 GLN 7 HB2 GLN 7 24.451 7.968 -6.240 44 HB3 GLN 7 HB3 GLN 7 23.844 6.700 -5.186 45 HG2 GLN 7 HG2 GLN 7 26.026 5.914 -4.718 46 HG3 GLN 7 HG3 GLN 7 26.729 6.915 -5.989 47 HE21 GLN 7 HE21 GLN 7 26.960 9.129 -5.647 48 HE22 GLN 7 HE22 GLN 7 26.874 9.831 -4.071 49 HA PRO 8 HA PRO 8 20.847 5.670 -9.134 50 HB2 PRO 8 HB2 PRO 8 20.717 2.962 -9.866 51 HB3 PRO 8 HB3 PRO 8 21.299 4.286 -10.874 52 HG2 PRO 8 HG2 PRO 8 22.820 2.147 -9.842 53 HG3 PRO 8 HG3 PRO 8 23.442 3.597 -10.645 54 HD2 PRO 8 HD2 PRO 8 23.261 2.967 -7.744 55 HD3 PRO 8 HD3 PRO 8 24.443 3.965 -8.617 56 H LYS 9 H LYS 9 18.868 3.930 -9.115 57 HA LYS 9 HA LYS 9 17.937 3.850 -6.463 58 HB2 LYS 9 HB2 LYS 9 16.962 2.320 -8.887 59 HB3 LYS 9 HB3 LYS 9 16.086 2.462 -7.369 60 HG2 LYS 9 HG2 LYS 9 15.992 4.906 -7.693 61 HG3 LYS 9 HG3 LYS 9 16.785 4.705 -9.254 62 HD2 LYS 9 HD2 LYS 9 14.909 3.293 -10.005 63 HD3 LYS 9 HD3 LYS 9 14.117 3.536 -8.447 64 HE2 LYS 9 HE2 LYS 9 14.857 5.767 -10.334 65 HE3 LYS 9 HE3 LYS 9 13.271 4.996 -10.287 66 HZ1 LYS 9 HZ1 LYS 9 14.558 6.414 -8.020 67 HZ2 LYS 9 HZ2 LYS 9 13.024 5.705 -8.001 68 HZ3 LYS 9 HZ3 LYS 9 13.326 7.039 -8.993 69 H THR 10 H THR 10 19.121 2.704 -5.022 70 HA THR 10 HA THR 10 20.101 0.068 -5.662 71 HB THR 10 HB THR 10 21.415 1.703 -4.280 72 HG1 THR 10 HG1 THR 10 21.303 -0.347 -2.515 73 HG21 THR 10 HG21 THR 10 20.882 1.815 -1.854 74 HG22 THR 10 HG22 THR 10 19.350 1.006 -2.186 75 HG23 THR 10 HG23 THR 10 19.669 2.602 -2.865 76 H ARG 11 H ARG 11 19.673 -1.782 -4.275 77 HA ARG 11 HA ARG 11 16.876 -1.804 -3.386 78 HB2 ARG 11 HB2 ARG 11 16.821 -4.176 -3.847 79 HB3 ARG 11 HB3 ARG 11 17.397 -3.323 -5.268 80 HG2 ARG 11 HG2 ARG 11 19.755 -3.912 -4.198 81 HG3 ARG 11 HG3 ARG 11 18.810 -5.217 -3.485 82 HD2 ARG 11 HD2 ARG 11 18.147 -4.929 -6.261 83 HD3 ARG 11 HD3 ARG 11 19.892 -5.098 -6.077 84 HE ARG 11 HE ARG 11 19.023 -7.099 -4.551 85 HH11 ARG 11 HH11 ARG 11 18.079 -6.109 -7.787 86 HH12 ARG 11 HH12 ARG 11 17.622 -7.711 -8.280 87 HH21 ARG 11 HH21 ARG 11 18.415 -9.204 -5.207 88 HH22 ARG 11 HH22 ARG 11 17.818 -9.463 -6.819 89 H VAL 12 H VAL 12 16.327 -2.911 -1.459 90 HA VAL 12 HA VAL 12 18.554 -3.540 0.346 91 HB VAL 12 HB VAL 12 18.157 -1.282 0.938 92 HG11 VAL 12 HG11 VAL 12 16.061 -0.979 -0.277 93 HG12 VAL 12 HG12 VAL 12 15.958 -0.334 1.359 94 HG13 VAL 12 HG13 VAL 12 15.203 -1.880 0.976 95 HG21 VAL 12 HG21 VAL 12 16.514 -2.936 2.852 96 HG22 VAL 12 HG22 VAL 12 17.268 -1.379 3.200 97 HG23 VAL 12 HG23 VAL 12 18.270 -2.794 2.869 98 H SER 13 H SER 13 18.102 -5.123 1.849 99 HA SER 13 HA SER 13 15.554 -6.516 1.481 100 HB2 SER 13 HB2 SER 13 17.997 -7.541 2.920 101 HB3 SER 13 HB3 SER 13 16.654 -8.478 2.267 102 HG SER 13 HG SER 13 17.351 -8.033 0.201 103 H VAL 14 H VAL 14 14.055 -6.599 3.034 104 HA VAL 14 HA VAL 14 14.807 -5.836 5.785 105 HB VAL 14 HB VAL 14 12.584 -4.789 6.049 106 HG11 VAL 14 HG11 VAL 14 14.470 -3.362 5.579 107 HG12 VAL 14 HG12 VAL 14 13.043 -2.749 4.742 108 HG13 VAL 14 HG13 VAL 14 14.278 -3.627 3.844 109 HG21 VAL 14 HG21 VAL 14 12.317 -5.061 3.057 110 HG22 VAL 14 HG22 VAL 14 11.172 -4.299 4.161 111 HG23 VAL 14 HG23 VAL 14 11.443 -6.041 4.238 112 H ARG 15 H ARG 15 13.527 -6.848 7.465 113 HA ARG 15 HA ARG 15 12.510 -9.447 6.595 114 HB2 ARG 15 HB2 ARG 15 14.346 -9.073 8.402 115 HB3 ARG 15 HB3 ARG 15 12.986 -8.710 9.456 116 HG2 ARG 15 HG2 ARG 15 12.021 -10.916 8.929 117 HG3 ARG 15 HG3 ARG 15 13.437 -11.273 7.940 118 HD2 ARG 15 HD2 ARG 15 13.408 -10.723 10.902 119 HD3 ARG 15 HD3 ARG 15 13.659 -12.287 10.132 120 HE ARG 15 HE ARG 15 15.705 -11.157 9.116 121 HH11 ARG 15 HH11 ARG 15 14.417 -10.374 12.274 122 HH12 ARG 15 HH12 ARG 15 15.941 -9.838 12.906 123 HH21 ARG 15 HH21 ARG 15 17.719 -10.432 9.948 124 HH22 ARG 15 HH22 ARG 15 17.817 -9.870 11.585 125 H ILE 16 H ILE 16 10.411 -9.866 6.568 126 HA ILE 16 HA ILE 16 8.609 -8.468 8.421 127 HB ILE 16 HB ILE 16 8.124 -8.779 5.457 128 HG12 ILE 16 HG12 ILE 16 8.340 -6.247 7.091 129 HG13 ILE 16 HG13 ILE 16 9.653 -6.914 6.125 130 HG21 ILE 16 HG21 ILE 16 6.319 -7.571 7.546 131 HG22 ILE 16 HG22 ILE 16 6.098 -9.155 6.803 132 HG23 ILE 16 HG23 ILE 16 5.986 -7.696 5.818 133 HD11 ILE 16 HD11 ILE 16 8.831 -5.437 4.629 134 HD12 ILE 16 HD12 ILE 16 7.196 -5.510 5.283 135 HD13 ILE 16 HD13 ILE 16 7.787 -6.802 4.241 136 H TYR 17 H TYR 17 7.333 -9.877 9.435 137 HA TYR 17 HA TYR 17 6.250 -11.779 10.038 138 HB2 TYR 17 HB2 TYR 17 5.360 -11.225 7.543 139 HB3 TYR 17 HB3 TYR 17 6.021 -12.835 7.282 140 HD1 TYR 17 HD2 TYR 17 3.727 -10.977 9.572 141 HD2 TYR 17 HD1 TYR 17 4.701 -14.693 7.737 142 HE1 TYR 17 HE2 TYR 17 1.668 -11.963 10.488 143 HE2 TYR 17 HE1 TYR 17 2.642 -15.685 8.647 144 HH TYR 17 HH TYR 17 0.142 -13.807 10.032 145 H GLY 18 H GLY 18 9.220 -11.776 9.461 146 HA2 GLY 18 HA2 GLY 18 10.617 -13.554 10.301 147 HA3 GLY 18 HA3 GLY 18 9.520 -14.704 9.555 148 H GLN 19 H GLN 19 9.304 -13.641 7.002 149 HA GLN 19 HA GLN 19 11.886 -14.421 5.932 150 HB2 GLN 19 HB2 GLN 19 9.169 -13.959 4.759 151 HB3 GLN 19 HB3 GLN 19 10.576 -13.987 3.710 152 HG2 GLN 19 HG2 GLN 19 10.795 -16.204 3.848 153 HG3 GLN 19 HG3 GLN 19 10.424 -16.237 5.573 154 HE21 GLN 19 HE21 GLN 19 9.485 -18.052 3.563 155 HE22 GLN 19 HE22 GLN 19 7.761 -17.926 3.536 156 H ASP 20 H ASP 20 12.966 -13.163 4.266 157 HA ASP 20 HA ASP 20 12.692 -10.286 4.789 158 HB2 ASP 20 HB2 ASP 20 14.960 -10.046 4.594 159 HB3 ASP 20 HB3 ASP 20 14.920 -11.726 5.109 160 H TYR 21 H TYR 21 12.531 -8.836 3.129 161 HA TYR 21 HA TYR 21 12.245 -9.947 0.415 162 HB2 TYR 21 HB2 TYR 21 10.597 -7.587 1.291 163 HB3 TYR 21 HB3 TYR 21 10.323 -8.690 -0.047 164 HD1 TYR 21 HD1 TYR 21 10.514 -11.302 1.510 165 HD2 TYR 21 HD2 TYR 21 8.522 -7.643 2.338 166 HE1 TYR 21 HE1 TYR 21 8.880 -12.513 2.886 167 HE2 TYR 21 HE2 TYR 21 6.881 -8.842 3.716 168 HH TYR 21 HH TYR 21 7.246 -11.558 5.049 169 H THR 22 H THR 22 13.185 -8.728 -1.194 170 HA THR 22 HA THR 22 14.724 -6.413 -0.265 171 HB THR 22 HB THR 22 15.195 -8.031 -2.773 172 HG1 THR 22 HG1 THR 22 15.469 -9.075 -0.563 173 HG21 THR 22 HG21 THR 22 17.327 -6.942 -2.854 174 HG22 THR 22 HG22 THR 22 17.055 -6.173 -1.288 175 HG23 THR 22 HG23 THR 22 16.096 -5.690 -2.686 176 H ILE 23 H ILE 23 13.947 -4.509 -0.771 177 HA ILE 23 HA ILE 23 12.349 -4.235 -3.227 178 HB ILE 23 HB ILE 23 11.066 -2.470 -2.218 179 HG12 ILE 23 HG12 ILE 23 13.118 -1.938 -0.595 180 HG13 ILE 23 HG13 ILE 23 11.478 -1.435 -0.230 181 HG21 ILE 23 HG21 ILE 23 10.145 -4.640 -1.979 182 HG22 ILE 23 HG22 ILE 23 9.869 -3.782 -0.466 183 HG23 ILE 23 HG23 ILE 23 11.149 -4.989 -0.577 184 HD11 ILE 23 HD11 ILE 23 12.694 -3.960 0.855 185 HD12 ILE 23 HD12 ILE 23 11.220 -3.152 1.381 186 HD13 ILE 23 HD13 ILE 23 12.786 -2.406 1.671 187 H VAL 24 H VAL 24 12.205 -1.765 -3.799 188 HA VAL 24 HA VAL 24 14.975 -0.916 -4.164 189 HB VAL 24 HB VAL 24 12.436 0.101 -5.448 190 HG11 VAL 24 HG11 VAL 24 14.248 1.772 -5.397 191 HG12 VAL 24 HG12 VAL 24 13.887 1.229 -7.037 192 HG13 VAL 24 HG13 VAL 24 15.315 0.620 -6.202 193 HG21 VAL 24 HG21 VAL 24 14.543 -1.767 -6.530 194 HG22 VAL 24 HG22 VAL 24 13.156 -1.142 -7.421 195 HG23 VAL 24 HG23 VAL 24 12.910 -2.217 -6.044 196 H GLY 25 H GLY 25 15.769 0.456 -2.692 197 HA2 GLY 25 HA2 GLY 25 13.941 2.441 -1.496 198 HA3 GLY 25 HA3 GLY 25 15.346 1.772 -0.678 199 H ALA 26 H ALA 26 14.313 3.846 -3.333 200 HA ALA 26 HA ALA 26 17.007 4.909 -3.638 201 HB1 ALA 26 HB1 ALA 26 14.467 5.628 -5.095 202 HB2 ALA 26 HB2 ALA 26 15.671 4.460 -5.639 203 HB3 ALA 26 HB3 ALA 26 16.091 6.169 -5.511 204 H GLU 27 H GLU 27 13.942 5.742 -2.255 205 HA GLU 27 HA GLU 27 14.260 8.503 -1.976 206 HB2 GLU 27 HB2 GLU 27 12.686 6.467 -0.402 207 HB3 GLU 27 HB3 GLU 27 12.621 8.183 -0.032 208 HG2 GLU 27 HG2 GLU 27 10.749 7.607 -1.397 209 HG3 GLU 27 HG3 GLU 27 11.843 8.616 -2.339 210 H SER 28 H SER 28 14.558 6.167 0.715 211 HA SER 28 HA SER 28 17.082 7.209 1.552 212 HB2 SER 28 HB2 SER 28 15.136 7.597 3.747 213 HB3 SER 28 HB3 SER 28 16.549 8.551 3.312 214 HG SER 28 HG SER 28 15.228 9.338 1.513 215 HA PRO 29 HA PRO 29 17.277 3.081 3.139 216 HB2 PRO 29 HB2 PRO 29 19.078 3.496 5.188 217 HB3 PRO 29 HB3 PRO 29 19.516 3.265 3.494 218 HG2 PRO 29 HG2 PRO 29 19.247 5.802 5.056 219 HG3 PRO 29 HG3 PRO 29 20.466 5.351 3.849 220 HD2 PRO 29 HD2 PRO 29 18.435 6.992 3.240 221 HD3 PRO 29 HD3 PRO 29 19.052 5.805 2.067 222 H ALA 30 H ALA 30 16.751 5.742 5.407 223 HA ALA 30 HA ALA 30 15.678 3.928 7.411 224 HB1 ALA 30 HB1 ALA 30 15.433 5.992 8.779 225 HB2 ALA 30 HB2 ALA 30 16.097 6.912 7.427 226 HB3 ALA 30 HB3 ALA 30 17.079 5.689 8.227 227 H HIS 31 H HIS 31 14.488 5.500 4.723 228 HA HIS 31 HA HIS 31 11.907 6.194 5.828 229 HB2 HIS 31 HB2 HIS 31 13.304 6.696 3.328 230 HB3 HIS 31 HB3 HIS 31 11.641 6.196 3.055 231 HD1 HIS 31 HD1 HIS 31 13.448 9.159 3.308 232 HD2 HIS 31 HD2 HIS 31 9.935 7.830 5.099 233 HE1 HIS 31 HE1 HIS 31 12.245 11.228 4.066 234 HE2 HIS 31 HE2 HIS 31 10.048 10.417 4.994 235 H ILE 32 H ILE 32 13.121 3.763 3.527 236 HA ILE 32 HA ILE 32 10.551 2.491 3.413 237 HB ILE 32 HB ILE 32 11.369 0.927 1.910 238 HG12 ILE 32 HG12 ILE 32 13.331 0.200 3.262 239 HG13 ILE 32 HG13 ILE 32 13.634 0.285 1.536 240 HG21 ILE 32 HG21 ILE 32 12.686 2.218 0.240 241 HG22 ILE 32 HG22 ILE 32 12.831 3.507 1.431 242 HG23 ILE 32 HG23 ILE 32 11.243 3.025 0.849 243 HD11 ILE 32 HD11 ILE 32 14.583 2.192 3.658 244 HD12 ILE 32 HD12 ILE 32 14.767 2.475 1.925 245 HD13 ILE 32 HD13 ILE 32 15.549 1.093 2.681 246 H ARG 33 H ARG 33 13.120 2.384 5.586 247 HA ARG 33 HA ARG 33 12.897 -0.320 6.422 248 HB2 ARG 33 HB2 ARG 33 14.870 1.060 6.958 249 HB3 ARG 33 HB3 ARG 33 13.874 2.084 7.984 250 HG2 ARG 33 HG2 ARG 33 13.688 0.483 9.631 251 HG3 ARG 33 HG3 ARG 33 13.980 -0.850 8.512 252 HD2 ARG 33 HD2 ARG 33 15.901 -0.641 9.908 253 HD3 ARG 33 HD3 ARG 33 16.339 -0.059 8.305 254 HE ARG 33 HE ARG 33 15.525 2.157 9.751 255 HH11 ARG 33 HH11 ARG 33 18.033 -0.264 9.996 256 HH12 ARG 33 HH12 ARG 33 19.176 0.808 10.738 257 HH21 ARG 33 HH21 ARG 33 17.020 3.571 10.738 258 HH22 ARG 33 HH22 ARG 33 18.596 2.986 11.172 259 H LEU 34 H LEU 34 11.221 2.638 7.192 260 HA LEU 34 HA LEU 34 9.825 1.673 9.473 261 HB2 LEU 34 HB2 LEU 34 9.093 3.890 7.559 262 HB3 LEU 34 HB3 LEU 34 8.356 3.617 9.126 263 HG LEU 34 HG LEU 34 11.272 4.285 8.728 264 HD11 LEU 34 HD11 LEU 34 10.667 6.525 9.531 265 HD12 LEU 34 HD12 LEU 34 8.964 6.072 9.482 266 HD13 LEU 34 HD13 LEU 34 9.902 6.143 7.988 267 HD21 LEU 34 HD21 LEU 34 10.929 3.130 10.788 268 HD22 LEU 34 HD22 LEU 34 9.510 4.105 11.162 269 HD23 LEU 34 HD23 LEU 34 11.110 4.845 11.160 270 H VAL 35 H VAL 35 9.390 1.464 6.054 271 HA VAL 35 HA VAL 35 6.660 0.788 5.953 272 HB VAL 35 HB VAL 35 8.881 -0.025 4.064 273 HG11 VAL 35 HG11 VAL 35 5.889 -0.079 3.766 274 HG12 VAL 35 HG12 VAL 35 7.008 -1.437 3.664 275 HG13 VAL 35 HG13 VAL 35 7.006 -0.198 2.408 276 HG21 VAL 35 HG21 VAL 35 6.936 2.249 3.757 277 HG22 VAL 35 HG22 VAL 35 8.365 1.904 2.785 278 HG23 VAL 35 HG23 VAL 35 8.543 2.441 4.456 279 H ALA 36 H ALA 36 9.580 -1.088 6.464 280 HA ALA 36 HA ALA 36 8.533 -3.660 6.169 281 HB1 ALA 36 HB1 ALA 36 10.937 -3.111 6.335 282 HB2 ALA 36 HB2 ALA 36 10.452 -4.424 7.406 283 HB3 ALA 36 HB3 ALA 36 10.721 -2.805 8.058 284 H ALA 37 H ALA 37 8.797 -1.609 9.045 285 HA ALA 37 HA ALA 37 7.580 -3.497 10.797 286 HB1 ALA 37 HB1 ALA 37 7.907 -0.517 11.135 287 HB2 ALA 37 HB2 ALA 37 9.098 -1.735 11.592 288 HB3 ALA 37 HB3 ALA 37 7.535 -1.678 12.406 289 H PHE 38 H PHE 38 6.423 -0.988 8.694 290 HA PHE 38 HA PHE 38 3.839 -0.685 9.808 291 HB2 PHE 38 HB2 PHE 38 4.841 0.995 8.339 292 HB3 PHE 38 HB3 PHE 38 4.854 -0.152 7.008 293 HD1 PHE 38 HD1 PHE 38 2.166 0.661 9.461 294 HD2 PHE 38 HD2 PHE 38 3.458 0.717 5.406 295 HE1 PHE 38 HE1 PHE 38 -0.057 1.451 8.769 296 HE2 PHE 38 HE2 PHE 38 1.237 1.509 4.705 297 HZ PHE 38 HZ PHE 38 -0.525 1.875 6.389 298 H VAL 39 H VAL 39 5.067 -2.624 7.079 299 HA VAL 39 HA VAL 39 2.544 -3.785 6.462 300 HB VAL 39 HB VAL 39 5.312 -4.805 5.786 301 HG11 VAL 39 HG11 VAL 39 3.610 -6.545 5.575 302 HG12 VAL 39 HG12 VAL 39 4.206 -6.042 3.991 303 HG13 VAL 39 HG13 VAL 39 2.638 -5.476 4.564 304 HG21 VAL 39 HG21 VAL 39 3.526 -2.765 4.563 305 HG22 VAL 39 HG22 VAL 39 4.471 -3.799 3.494 306 HG23 VAL 39 HG23 VAL 39 5.285 -2.797 4.694 307 H ASP 40 H ASP 40 5.324 -4.885 8.378 308 HA ASP 40 HA ASP 40 4.427 -7.468 8.944 309 HB2 ASP 40 HB2 ASP 40 6.709 -6.702 9.452 310 HB3 ASP 40 HB3 ASP 40 6.078 -5.647 10.712 311 H ASP 41 H ASP 41 3.688 -4.396 10.503 312 HA ASP 41 HA ASP 41 2.273 -5.455 12.716 313 HB2 ASP 41 HB2 ASP 41 3.138 -3.099 12.539 314 HB3 ASP 41 HB3 ASP 41 1.840 -2.763 11.399 315 H LYS 42 H LYS 42 1.201 -4.179 9.586 316 HA LYS 42 HA LYS 42 -1.544 -4.513 9.933 317 HB2 LYS 42 HB2 LYS 42 0.193 -4.523 7.476 318 HB3 LYS 42 HB3 LYS 42 -1.555 -4.681 7.377 319 HG2 LYS 42 HG2 LYS 42 -0.853 -2.452 9.045 320 HG3 LYS 42 HG3 LYS 42 -0.050 -2.324 7.480 321 HD2 LYS 42 HD2 LYS 42 -2.113 -1.240 7.195 322 HD3 LYS 42 HD3 LYS 42 -2.326 -2.825 6.453 323 HE2 LYS 42 HE2 LYS 42 -4.277 -2.468 7.713 324 HE3 LYS 42 HE3 LYS 42 -3.297 -3.569 8.678 325 HZ1 LYS 42 HZ1 LYS 42 -4.061 -0.821 9.213 326 HZ2 LYS 42 HZ2 LYS 42 -2.476 -1.232 9.628 327 HZ3 LYS 42 HZ3 LYS 42 -3.770 -2.101 10.291 328 H MET 43 H MET 43 0.873 -6.772 8.634 329 HA MET 43 HA MET 43 -0.912 -8.818 7.905 330 HB2 MET 43 HB2 MET 43 1.966 -9.011 8.804 331 HB3 MET 43 HB3 MET 43 1.058 -10.330 8.082 332 HG2 MET 43 HG2 MET 43 0.768 -8.951 6.046 333 HG3 MET 43 HG3 MET 43 1.806 -7.726 6.773 334 HE1 MET 43 HE1 MET 43 3.073 -11.829 5.160 335 HE2 MET 43 HE2 MET 43 1.489 -11.069 5.000 336 HE3 MET 43 HE3 MET 43 1.990 -11.741 6.550 337 H HIS 44 H HIS 44 0.682 -8.092 10.946 338 HA HIS 44 HA HIS 44 0.010 -10.481 12.283 339 HB2 HIS 44 HB2 HIS 44 0.998 -7.804 13.088 340 HB3 HIS 44 HB3 HIS 44 0.248 -8.786 14.341 341 HD1 HIS 44 HD1 HIS 44 3.309 -8.512 12.245 342 HD2 HIS 44 HD2 HIS 44 1.634 -11.174 14.970 343 HE1 HIS 44 HE1 HIS 44 5.152 -10.114 12.860 344 HE2 HIS 44 HE2 HIS 44 4.076 -11.793 14.399 345 H GLU 45 H GLU 45 -1.637 -7.309 12.239 346 HA GLU 45 HA GLU 45 -3.683 -8.170 14.023 347 HB2 GLU 45 HB2 GLU 45 -4.753 -6.086 13.620 348 HB3 GLU 45 HB3 GLU 45 -3.022 -5.778 13.635 349 HG2 GLU 45 HG2 GLU 45 -2.945 -5.465 11.314 350 HG3 GLU 45 HG3 GLU 45 -4.510 -6.241 11.072 351 H PHE 46 H PHE 46 -3.281 -8.352 10.566 352 HA PHE 46 HA PHE 46 -6.048 -8.938 10.067 353 HB2 PHE 46 HB2 PHE 46 -3.583 -8.754 8.417 354 HB3 PHE 46 HB3 PHE 46 -4.894 -9.755 7.801 355 HD1 PHE 46 HD1 PHE 46 -7.296 -8.561 8.052 356 HD2 PHE 46 HD2 PHE 46 -3.551 -6.570 7.701 357 HE1 PHE 46 HE1 PHE 46 -8.445 -6.556 7.201 358 HE2 PHE 46 HE2 PHE 46 -4.691 -4.567 6.851 359 HZ PHE 46 HZ PHE 46 -7.141 -4.557 6.600 360 H SER 47 H SER 47 -3.151 -10.756 10.761 361 HA SER 47 HA SER 47 -4.042 -13.298 9.902 362 HB2 SER 47 HB2 SER 47 -2.073 -12.569 12.087 363 HB3 SER 47 HB3 SER 47 -2.297 -14.192 11.440 364 HG SER 47 HG SER 47 -1.572 -11.936 9.868 365 H GLU 48 H GLU 48 -4.706 -11.370 12.699 366 HA GLU 48 HA GLU 48 -5.728 -13.444 14.365 367 HB2 GLU 48 HB2 GLU 48 -4.947 -11.340 15.314 368 HB3 GLU 48 HB3 GLU 48 -6.149 -10.446 14.398 369 HG2 GLU 48 HG2 GLU 48 -7.498 -12.409 15.940 370 HG3 GLU 48 HG3 GLU 48 -6.362 -11.565 16.989 371 H LYS 49 H LYS 49 -6.966 -11.590 11.749 372 HA LYS 49 HA LYS 49 -9.745 -12.115 12.396 373 HB2 LYS 49 HB2 LYS 49 -8.703 -10.911 9.832 374 HB3 LYS 49 HB3 LYS 49 -10.309 -10.761 10.521 375 HG2 LYS 49 HG2 LYS 49 -7.805 -9.574 11.709 376 HG3 LYS 49 HG3 LYS 49 -8.982 -8.705 10.729 377 HD2 LYS 49 HD2 LYS 49 -10.721 -9.321 12.424 378 HD3 LYS 49 HD3 LYS 49 -9.424 -9.960 13.437 379 HE2 LYS 49 HE2 LYS 49 -9.526 -7.122 12.415 380 HE3 LYS 49 HE3 LYS 49 -10.133 -7.618 13.992 381 HZ1 LYS 49 HZ1 LYS 49 -7.328 -7.914 13.058 382 HZ2 LYS 49 HZ2 LYS 49 -7.912 -8.352 14.587 383 HZ3 LYS 49 HZ3 LYS 49 -7.891 -6.725 14.124 384 H GLN 50 H GLN 50 -7.606 -12.793 9.633 385 HA GLN 50 HA GLN 50 -7.664 -14.351 7.987 386 HB2 GLN 50 HB2 GLN 50 -8.127 -15.859 10.513 387 HB3 GLN 50 HB3 GLN 50 -8.265 -16.725 8.988 388 HG2 GLN 50 HG2 GLN 50 -5.997 -16.034 8.394 389 HG3 GLN 50 HG3 GLN 50 -5.866 -15.168 9.923 390 HE21 GLN 50 HE21 GLN 50 -5.614 -16.318 11.827 391 HE22 GLN 50 HE22 GLN 50 -5.177 -17.994 11.835 392 HA PRO 51 HA PRO 51 -12.175 -13.981 7.199 393 HB2 PRO 51 HB2 PRO 51 -11.827 -13.532 4.511 394 HB3 PRO 51 HB3 PRO 51 -11.883 -12.265 5.739 395 HG2 PRO 51 HG2 PRO 51 -9.525 -13.506 4.399 396 HG3 PRO 51 HG3 PRO 51 -9.798 -11.816 4.864 397 HD2 PRO 51 HD2 PRO 51 -8.222 -13.484 6.304 398 HD3 PRO 51 HD3 PRO 51 -9.167 -12.179 7.050 399 H MET 52 H MET 52 -9.836 -15.585 5.023 400 HA MET 52 HA MET 52 -11.726 -17.830 4.838 401 HB2 MET 52 HB2 MET 52 -9.878 -16.756 2.704 402 HB3 MET 52 HB3 MET 52 -10.825 -18.229 2.552 403 HG2 MET 52 HG2 MET 52 -12.645 -17.102 1.977 404 HG3 MET 52 HG3 MET 52 -12.474 -15.995 3.338 405 HE1 MET 52 HE1 MET 52 -13.741 -15.046 0.641 406 HE2 MET 52 HE2 MET 52 -12.919 -13.508 0.384 407 HE3 MET 52 HE3 MET 52 -13.450 -13.965 2.002 408 H LEU 53 H LEU 53 -9.183 -17.115 6.451 409 HA LEU 53 HA LEU 53 -7.300 -18.119 7.254 410 HB2 LEU 53 HB2 LEU 53 -9.205 -20.387 6.794 411 HB3 LEU 53 HB3 LEU 53 -7.610 -20.687 7.452 412 HG LEU 53 HG LEU 53 -8.207 -18.992 9.270 413 HD11 LEU 53 HD11 LEU 53 -10.947 -19.482 8.112 414 HD12 LEU 53 HD12 LEU 53 -10.115 -17.936 8.273 415 HD13 LEU 53 HD13 LEU 53 -10.647 -18.804 9.711 416 HD21 LEU 53 HD21 LEU 53 -8.086 -21.403 9.635 417 HD22 LEU 53 HD22 LEU 53 -9.766 -21.567 9.121 418 HD23 LEU 53 HD23 LEU 53 -9.373 -20.666 10.586 419 H ASP 54 H ASP 54 -6.082 -17.424 5.318 420 HA ASP 54 HA ASP 54 -4.819 -19.720 4.073 421 HB2 ASP 54 HB2 ASP 54 -6.673 -19.135 2.539 422 HB3 ASP 54 HB3 ASP 54 -6.022 -17.507 2.397 423 H VAL 55 H VAL 55 -2.678 -19.392 3.805 424 HA VAL 55 HA VAL 55 -1.472 -17.140 4.998 425 HB VAL 55 HB VAL 55 -0.048 -19.095 3.209 426 HG11 VAL 55 HG11 VAL 55 0.853 -17.466 5.581 427 HG12 VAL 55 HG12 VAL 55 1.273 -17.178 3.891 428 HG13 VAL 55 HG13 VAL 55 1.843 -18.635 4.705 429 HG21 VAL 55 HG21 VAL 55 -0.834 -19.404 6.102 430 HG22 VAL 55 HG22 VAL 55 0.331 -20.432 5.268 431 HG23 VAL 55 HG23 VAL 55 -1.353 -20.405 4.745 432 HA PRO 56 HA PRO 56 0.058 -15.770 0.563 433 HB2 PRO 56 HB2 PRO 56 -1.570 -16.669 -1.497 434 HB3 PRO 56 HB3 PRO 56 0.017 -17.332 -1.100 435 HG2 PRO 56 HG2 PRO 56 -2.697 -18.331 -0.361 436 HG3 PRO 56 HG3 PRO 56 -1.253 -19.246 -0.827 437 HD2 PRO 56 HD2 PRO 56 -2.023 -19.070 1.732 438 HD3 PRO 56 HD3 PRO 56 -0.306 -19.070 1.283 439 H LYS 57 H LYS 57 -3.343 -16.484 1.068 440 HA LYS 57 HA LYS 57 -4.425 -14.191 -0.172 441 HB2 LYS 57 HB2 LYS 57 -5.560 -16.385 0.629 442 HB3 LYS 57 HB3 LYS 57 -5.682 -15.571 2.181 443 HG2 LYS 57 HG2 LYS 57 -7.051 -13.850 1.236 444 HG3 LYS 57 HG3 LYS 57 -6.811 -14.500 -0.390 445 HD2 LYS 57 HD2 LYS 57 -7.877 -16.357 1.654 446 HD3 LYS 57 HD3 LYS 57 -8.958 -15.073 1.110 447 HE2 LYS 57 HE2 LYS 57 -9.349 -16.982 -0.262 448 HE3 LYS 57 HE3 LYS 57 -8.504 -15.782 -1.233 449 HZ1 LYS 57 HZ1 LYS 57 -6.697 -17.587 0.057 450 HZ2 LYS 57 HZ2 LYS 57 -6.836 -17.187 -1.584 451 HZ3 LYS 57 HZ3 LYS 57 -7.811 -18.402 -0.921 452 H LEU 58 H LEU 58 -3.314 -14.866 3.085 453 HA LEU 58 HA LEU 58 -4.265 -12.496 4.313 454 HB2 LEU 58 HB2 LEU 58 -3.142 -14.787 5.240 455 HB3 LEU 58 HB3 LEU 58 -1.752 -13.727 5.318 456 HG LEU 58 HG LEU 58 -2.920 -13.904 7.463 457 HD11 LEU 58 HD11 LEU 58 -1.690 -11.859 6.900 458 HD12 LEU 58 HD12 LEU 58 -3.045 -11.563 7.988 459 HD13 LEU 58 HD13 LEU 58 -3.182 -11.153 6.279 460 HD21 LEU 58 HD21 LEU 58 -5.220 -12.301 6.524 461 HD22 LEU 58 HD22 LEU 58 -5.116 -13.501 7.809 462 HD23 LEU 58 HD23 LEU 58 -5.223 -14.020 6.128 463 H ALA 59 H ALA 59 -1.336 -13.337 2.602 464 HA ALA 59 HA ALA 59 0.193 -11.057 3.235 465 HB1 ALA 59 HB1 ALA 59 1.411 -11.678 1.077 466 HB2 ALA 59 HB2 ALA 59 0.284 -13.030 0.975 467 HB3 ALA 59 HB3 ALA 59 1.366 -12.887 2.361 468 H VAL 60 H VAL 60 -1.759 -11.763 0.323 469 HA VAL 60 HA VAL 60 -1.358 -9.165 -0.769 470 HB VAL 60 HB VAL 60 -1.831 -11.019 -2.250 471 HG11 VAL 60 HG11 VAL 60 -4.266 -11.289 -0.581 472 HG12 VAL 60 HG12 VAL 60 -3.223 -12.532 -1.277 473 HG13 VAL 60 HG13 VAL 60 -4.386 -11.683 -2.294 474 HG21 VAL 60 HG21 VAL 60 -2.434 -8.824 -3.051 475 HG22 VAL 60 HG22 VAL 60 -4.015 -8.943 -2.275 476 HG23 VAL 60 HG23 VAL 60 -3.611 -10.006 -3.624 477 H LEU 61 H LEU 61 -3.676 -10.490 1.445 478 HA LEU 61 HA LEU 61 -5.793 -8.700 1.129 479 HB2 LEU 61 HB2 LEU 61 -5.854 -10.764 2.499 480 HB3 LEU 61 HB3 LEU 61 -4.839 -9.978 3.691 481 HG LEU 61 HG LEU 61 -6.656 -8.250 3.964 482 HD11 LEU 61 HD11 LEU 61 -8.149 -10.215 2.238 483 HD12 LEU 61 HD12 LEU 61 -7.887 -8.494 1.944 484 HD13 LEU 61 HD13 LEU 61 -8.937 -9.014 3.260 485 HD21 LEU 61 HD21 LEU 61 -6.345 -10.003 5.592 486 HD22 LEU 61 HD22 LEU 61 -7.284 -11.127 4.608 487 HD23 LEU 61 HD23 LEU 61 -8.069 -9.728 5.342 488 H THR 62 H THR 62 -2.733 -8.334 2.785 489 HA THR 62 HA THR 62 -3.474 -5.979 4.209 490 HB THR 62 HB THR 62 -1.078 -5.683 4.642 491 HG1 THR 62 HG1 THR 62 -0.620 -8.021 3.071 492 HG21 THR 62 HG21 THR 62 -0.743 -7.642 5.950 493 HG22 THR 62 HG22 THR 62 -1.784 -8.600 4.894 494 HG23 THR 62 HG23 THR 62 -2.480 -7.344 5.914 495 H ALA 63 H ALA 63 -1.795 -6.609 1.169 496 HA ALA 63 HA ALA 63 -1.014 -4.017 0.524 497 HB1 ALA 63 HB1 ALA 63 -1.880 -6.125 -1.445 498 HB2 ALA 63 HB2 ALA 63 -0.310 -6.098 -0.644 499 HB3 ALA 63 HB3 ALA 63 -0.767 -4.784 -1.726 500 H VAL 64 H VAL 64 -4.048 -5.688 -0.250 501 HA VAL 64 HA VAL 64 -5.108 -3.544 -1.770 502 HB VAL 64 HB VAL 64 -5.860 -5.903 -1.989 503 HG11 VAL 64 HG11 VAL 64 -7.199 -5.353 0.648 504 HG12 VAL 64 HG12 VAL 64 -6.039 -6.626 0.270 505 HG13 VAL 64 HG13 VAL 64 -7.656 -6.670 -0.432 506 HG21 VAL 64 HG21 VAL 64 -7.217 -4.341 -3.063 507 HG22 VAL 64 HG22 VAL 64 -7.839 -3.698 -1.547 508 HG23 VAL 64 HG23 VAL 64 -8.345 -5.294 -2.101 509 H GLN 65 H GLN 65 -5.084 -4.183 1.672 510 HA GLN 65 HA GLN 65 -7.162 -2.200 2.105 511 HB2 GLN 65 HB2 GLN 65 -5.743 -4.148 3.856 512 HB3 GLN 65 HB3 GLN 65 -6.457 -2.720 4.598 513 HG2 GLN 65 HG2 GLN 65 -8.063 -4.473 2.767 514 HG3 GLN 65 HG3 GLN 65 -7.876 -4.868 4.472 515 HE21 GLN 65 HE21 GLN 65 -8.022 -1.542 3.423 516 HE22 GLN 65 HE22 GLN 65 -9.603 -1.227 4.028 517 H ILE 66 H ILE 66 -3.679 -2.455 2.317 518 HA ILE 66 HA ILE 66 -3.281 -0.066 3.815 519 HB ILE 66 HB ILE 66 -1.445 -1.579 1.946 520 HG12 ILE 66 HG12 ILE 66 -1.343 -1.281 4.952 521 HG13 ILE 66 HG13 ILE 66 -2.142 -2.619 4.136 522 HG21 ILE 66 HG21 ILE 66 -0.796 0.776 1.954 523 HG22 ILE 66 HG22 ILE 66 0.389 -0.202 2.818 524 HG23 ILE 66 HG23 ILE 66 -0.773 0.774 3.717 525 HD11 ILE 66 HD11 ILE 66 -0.063 -3.471 4.705 526 HD12 ILE 66 HD12 ILE 66 0.775 -1.979 4.288 527 HD13 ILE 66 HD13 ILE 66 0.137 -3.016 3.012 528 H ALA 67 H ALA 67 -3.417 -0.829 0.376 529 HA ALA 67 HA ALA 67 -2.734 1.761 -0.534 530 HB1 ALA 67 HB1 ALA 67 -3.705 0.939 -2.707 531 HB2 ALA 67 HB2 ALA 67 -4.083 -0.566 -1.866 532 HB3 ALA 67 HB3 ALA 67 -2.411 -0.038 -2.019 533 H SER 68 H SER 68 -5.803 0.308 0.416 534 HA SER 68 HA SER 68 -7.418 2.299 -0.839 535 HB2 SER 68 HB2 SER 68 -9.054 1.318 1.076 536 HB3 SER 68 HB3 SER 68 -8.770 0.515 -0.470 537 HG SER 68 HG SER 68 -7.602 -0.977 0.494 538 H GLU 69 H GLU 69 -6.240 1.851 2.493 539 HA GLU 69 HA GLU 69 -7.546 4.210 3.445 540 HB2 GLU 69 HB2 GLU 69 -6.217 3.910 5.480 541 HB3 GLU 69 HB3 GLU 69 -6.971 2.402 4.984 542 HG2 GLU 69 HG2 GLU 69 -4.969 1.448 4.376 543 HG3 GLU 69 HG3 GLU 69 -4.177 3.005 4.141 544 H TYR 70 H TYR 70 -4.718 3.661 1.650 545 HA TYR 70 HA TYR 70 -3.540 6.226 2.417 546 HB2 TYR 70 HB2 TYR 70 -2.564 3.756 1.137 547 HB3 TYR 70 HB3 TYR 70 -1.902 5.245 0.478 548 HD1 TYR 70 HD2 TYR 70 -2.878 4.875 4.013 549 HD2 TYR 70 HD1 TYR 70 0.336 4.856 1.234 550 HE1 TYR 70 HE2 TYR 70 -1.279 4.996 5.873 551 HE2 TYR 70 HE1 TYR 70 1.952 4.978 3.083 552 HH TYR 70 HH TYR 70 1.033 4.538 6.371 553 H LEU 71 H LEU 71 -5.308 4.720 -0.174 554 HA LEU 71 HA LEU 71 -4.717 6.554 -2.229 555 HB2 LEU 71 HB2 LEU 71 -5.921 4.270 -2.343 556 HB3 LEU 71 HB3 LEU 71 -7.367 5.169 -1.930 557 HG LEU 71 HG LEU 71 -6.906 6.611 -3.983 558 HD11 LEU 71 HD11 LEU 71 -5.567 5.527 -5.764 559 HD12 LEU 71 HD12 LEU 71 -4.981 4.364 -4.576 560 HD13 LEU 71 HD13 LEU 71 -4.598 6.076 -4.398 561 HD21 LEU 71 HD21 LEU 71 -8.692 4.988 -4.012 562 HD22 LEU 71 HD22 LEU 71 -7.551 3.682 -4.347 563 HD23 LEU 71 HD23 LEU 71 -7.835 4.936 -5.551 564 H LYS 72 H LYS 72 -7.159 6.511 0.302 565 HA LYS 72 HA LYS 72 -8.500 8.866 -0.595 566 HB2 LYS 72 HB2 LYS 72 -9.670 8.782 1.547 567 HB3 LYS 72 HB3 LYS 72 -9.646 7.199 0.787 568 HG2 LYS 72 HG2 LYS 72 -8.069 6.367 2.303 569 HG3 LYS 72 HG3 LYS 72 -7.621 7.979 2.859 570 HD2 LYS 72 HD2 LYS 72 -10.329 6.719 3.272 571 HD3 LYS 72 HD3 LYS 72 -9.032 6.714 4.469 572 HE2 LYS 72 HE2 LYS 72 -9.027 9.232 4.299 573 HE3 LYS 72 HE3 LYS 72 -10.508 9.092 3.356 574 HZ1 LYS 72 HZ1 LYS 72 -11.252 9.426 5.503 575 HZ2 LYS 72 HZ2 LYS 72 -10.064 8.443 6.194 576 HZ3 LYS 72 HZ3 LYS 72 -11.346 7.743 5.347 577 H LEU 73 H LEU 73 -5.525 8.389 0.839 578 HA LEU 73 HA LEU 73 -5.534 10.873 2.351 579 HB2 LEU 73 HB2 LEU 73 -4.426 8.686 3.114 580 HB3 LEU 73 HB3 LEU 73 -3.199 9.011 1.911 581 HG LEU 73 HG LEU 73 -2.622 9.615 4.296 582 HD11 LEU 73 HD11 LEU 73 -1.494 11.686 3.706 583 HD12 LEU 73 HD12 LEU 73 -2.506 11.843 2.270 584 HD13 LEU 73 HD13 LEU 73 -1.371 10.501 2.404 585 HD21 LEU 73 HD21 LEU 73 -4.920 10.617 4.743 586 HD22 LEU 73 HD22 LEU 73 -4.338 12.045 3.879 587 HD23 LEU 73 HD23 LEU 73 -3.517 11.503 5.338 588 H LYS 74 H LYS 74 -3.920 9.409 -0.454 589 HA LYS 74 HA LYS 74 -2.344 11.673 -1.070 590 HB2 LYS 74 HB2 LYS 74 -2.058 10.642 -3.309 591 HB3 LYS 74 HB3 LYS 74 -1.726 9.536 -1.988 592 HG2 LYS 74 HG2 LYS 74 -3.112 8.085 -2.903 593 HG3 LYS 74 HG3 LYS 74 -4.441 9.206 -2.622 594 HD2 LYS 74 HD2 LYS 74 -4.437 8.605 -4.945 595 HD3 LYS 74 HD3 LYS 74 -3.916 10.283 -4.804 596 HE2 LYS 74 HE2 LYS 74 -1.783 9.816 -5.476 597 HE3 LYS 74 HE3 LYS 74 -1.812 8.186 -4.805 598 HZ1 LYS 74 HZ1 LYS 74 -3.190 9.067 -7.285 599 HZ2 LYS 74 HZ2 LYS 74 -3.229 7.506 -6.645 600 HZ3 LYS 74 HZ3 LYS 74 -1.775 8.145 -7.216 601 H GLU 75 H GLU 75 -5.657 10.889 -1.745 602 HA GLU 75 HA GLU 75 -5.962 12.853 -3.818 603 HB2 GLU 75 HB2 GLU 75 -8.245 12.262 -3.856 604 HB3 GLU 75 HB3 GLU 75 -7.402 10.766 -3.470 605 HG2 GLU 75 HG2 GLU 75 -8.017 10.890 -1.202 606 HG3 GLU 75 HG3 GLU 75 -8.561 12.557 -1.366 607 H GLU 76 H GLU 76 -6.108 12.810 -0.359 608 HA GLU 76 HA GLU 76 -7.707 15.064 0.137 609 HB2 GLU 76 HB2 GLU 76 -6.856 13.381 1.825 610 HB3 GLU 76 HB3 GLU 76 -5.298 14.192 1.744 611 HG2 GLU 76 HG2 GLU 76 -6.320 15.076 3.633 612 HG3 GLU 76 HG3 GLU 76 -6.565 16.303 2.390 613 H TYR 77 H TYR 77 -4.472 14.664 -0.950 614 HA TYR 77 HA TYR 77 -3.449 17.245 -0.454 615 HB2 TYR 77 HB2 TYR 77 -1.967 15.394 -0.945 616 HB3 TYR 77 HB3 TYR 77 -2.752 15.117 -2.491 617 HD1 TYR 77 HD1 TYR 77 -1.732 18.431 -1.169 618 HD2 TYR 77 HD2 TYR 77 -0.886 15.289 -3.906 619 HE1 TYR 77 HE1 TYR 77 -0.063 19.854 -2.274 620 HE2 TYR 77 HE2 TYR 77 0.787 16.700 -5.021 621 HH TYR 77 HH TYR 77 2.061 19.449 -3.681 622 H GLN 78 H GLN 78 -4.926 15.756 -3.319 623 HA GLN 78 HA GLN 78 -4.855 18.093 -4.914 624 HB2 GLN 78 HB2 GLN 78 -6.454 15.546 -5.096 625 HB3 GLN 78 HB3 GLN 78 -6.592 16.833 -6.284 626 HG2 GLN 78 HG2 GLN 78 -4.101 15.277 -5.623 627 HG3 GLN 78 HG3 GLN 78 -5.097 15.101 -7.066 628 HE21 GLN 78 HE21 GLN 78 -2.296 15.732 -6.914 629 HE22 GLN 78 HE22 GLN 78 -2.087 17.275 -7.669 630 H ARG 79 H ARG 79 -7.263 16.700 -2.771 631 HA ARG 79 HA ARG 79 -9.531 18.081 -3.421 632 HB2 ARG 79 HB2 ARG 79 -8.496 17.204 -0.740 633 HB3 ARG 79 HB3 ARG 79 -10.069 17.968 -0.918 634 HG2 ARG 79 HG2 ARG 79 -10.584 16.131 -2.609 635 HG3 ARG 79 HG3 ARG 79 -9.144 15.321 -1.983 636 HD2 ARG 79 HD2 ARG 79 -10.205 15.698 0.333 637 HD3 ARG 79 HD3 ARG 79 -11.693 16.003 -0.558 638 HE ARG 79 HE ARG 79 -10.867 13.615 -1.543 639 HH11 ARG 79 HH11 ARG 79 -11.388 14.839 1.697 640 HH12 ARG 79 HH12 ARG 79 -11.823 13.295 2.357 641 HH21 ARG 79 HH21 ARG 79 -11.461 11.566 -0.676 642 HH22 ARG 79 HH22 ARG 79 -11.864 11.436 1.006 643 H LEU 80 H LEU 80 -6.968 19.275 -1.234 644 HA LEU 80 HA LEU 80 -8.411 21.783 -0.984 645 HB2 LEU 80 HB2 LEU 80 -6.838 22.415 0.674 646 HB3 LEU 80 HB3 LEU 80 -7.269 20.743 0.966 647 HG LEU 80 HG LEU 80 -5.036 20.367 -0.500 648 HD11 LEU 80 HD11 LEU 80 -4.629 22.792 -0.718 649 HD12 LEU 80 HD12 LEU 80 -3.329 21.956 0.132 650 HD13 LEU 80 HD13 LEU 80 -4.504 22.907 1.039 651 HD21 LEU 80 HD21 LEU 80 -5.308 19.285 1.575 652 HD22 LEU 80 HD22 LEU 80 -5.341 20.813 2.458 653 HD23 LEU 80 HD23 LEU 80 -3.839 20.247 1.732 654 H ARG 81 H ARG 81 -5.733 20.492 -2.781 655 HA ARG 81 HA ARG 81 -4.553 22.998 -3.410 656 HB2 ARG 81 HB2 ARG 81 -4.294 20.230 -4.513 657 HB3 ARG 81 HB3 ARG 81 -3.558 21.588 -5.357 658 HG2 ARG 81 HG2 ARG 81 -3.035 21.375 -2.457 659 HG3 ARG 81 HG3 ARG 81 -2.280 20.169 -3.498 660 HD2 ARG 81 HD2 ARG 81 -0.770 22.024 -3.197 661 HD3 ARG 81 HD3 ARG 81 -1.332 21.996 -4.867 662 HE ARG 81 HE ARG 81 -2.887 23.713 -3.163 663 HH11 ARG 81 HH11 ARG 81 -0.011 23.479 -5.137 664 HH12 ARG 81 HH12 ARG 81 0.083 25.187 -5.439 665 HH21 ARG 81 HH21 ARG 81 -2.759 25.985 -3.546 666 HH22 ARG 81 HH22 ARG 81 -1.482 26.608 -4.534 667 H GLU 82 H GLU 82 -6.992 20.983 -4.972 668 HA GLU 82 HA GLU 82 -7.099 22.503 -7.371 669 HB2 GLU 82 HB2 GLU 82 -9.166 21.300 -7.845 670 HB3 GLU 82 HB3 GLU 82 -7.919 20.203 -7.277 671 HG2 GLU 82 HG2 GLU 82 -8.952 20.011 -5.140 672 HG3 GLU 82 HG3 GLU 82 -10.088 21.309 -5.511 673 H GLN 83 H GLN 83 -8.664 22.816 -4.256 674 HA GLN 83 HA GLN 83 -10.506 24.811 -5.252 675 HB2 GLN 83 HB2 GLN 83 -11.535 24.766 -3.166 676 HB3 GLN 83 HB3 GLN 83 -10.972 23.117 -3.368 677 HG2 GLN 83 HG2 GLN 83 -8.983 23.690 -1.981 678 HG3 GLN 83 HG3 GLN 83 -9.716 25.263 -1.673 679 HE21 GLN 83 HE21 GLN 83 -10.036 25.049 0.473 680 HE22 GLN 83 HE22 GLN 83 -11.098 23.885 1.184 681 H LEU 84 H LEU 84 -7.365 24.698 -3.877 682 HA LEU 84 HA LEU 84 -7.379 27.429 -2.948 683 HB2 LEU 84 HB2 LEU 84 -5.603 25.156 -2.730 684 HB3 LEU 84 HB3 LEU 84 -4.714 26.580 -3.217 685 HG LEU 84 HG LEU 84 -4.654 26.325 -0.801 686 HD11 LEU 84 HD11 LEU 84 -6.525 28.615 -1.271 687 HD12 LEU 84 HD12 LEU 84 -4.897 28.624 -1.942 688 HD13 LEU 84 HD13 LEU 84 -5.130 28.516 -0.199 689 HD21 LEU 84 HD21 LEU 84 -7.660 26.400 -0.983 690 HD22 LEU 84 HD22 LEU 84 -6.751 26.587 0.516 691 HD23 LEU 84 HD23 LEU 84 -6.653 25.079 -0.392 692 H LYS 85 H LYS 85 -6.544 25.693 -5.832 693 HA LYS 85 HA LYS 85 -5.170 27.981 -6.985 694 HB2 LYS 85 HB2 LYS 85 -4.502 26.583 -8.722 695 HB3 LYS 85 HB3 LYS 85 -4.538 25.493 -7.344 696 HG2 LYS 85 HG2 LYS 85 -6.626 24.560 -8.045 697 HG3 LYS 85 HG3 LYS 85 -6.801 25.778 -9.306 698 HD2 LYS 85 HD2 LYS 85 -4.612 24.844 -10.263 699 HD3 LYS 85 HD3 LYS 85 -4.876 23.471 -9.185 700 HE2 LYS 85 HE2 LYS 85 -5.818 22.831 -11.241 701 HE3 LYS 85 HE3 LYS 85 -7.184 23.288 -10.229 702 HZ1 LYS 85 HZ1 LYS 85 -7.628 24.324 -12.232 703 HZ2 LYS 85 HZ2 LYS 85 -6.017 24.733 -12.518 704 HZ3 LYS 85 HZ3 LYS 85 -6.906 25.580 -11.349 705 H LYS 86 H LYS 86 -5.856 28.434 -9.371 706 HA LYS 86 HA LYS 86 -8.786 28.578 -9.495 707 HB2 LYS 86 HB2 LYS 86 -6.792 30.750 -10.184 708 HB3 LYS 86 HB3 LYS 86 -8.504 30.829 -10.570 709 HG2 LYS 86 HG2 LYS 86 -9.121 30.940 -8.295 710 HG3 LYS 86 HG3 LYS 86 -7.502 30.482 -7.761 711 HD2 LYS 86 HD2 LYS 86 -6.608 32.587 -8.577 712 HD3 LYS 86 HD3 LYS 86 -8.193 33.039 -9.209 713 HE2 LYS 86 HE2 LYS 86 -7.804 34.163 -7.104 714 HE3 LYS 86 HE3 LYS 86 -9.101 32.987 -6.924 715 HZ1 LYS 86 HZ1 LYS 86 -7.655 32.847 -5.046 716 HZ2 LYS 86 HZ2 LYS 86 -6.290 32.677 -6.028 717 HZ3 LYS 86 HZ3 LYS 86 -7.451 31.444 -5.968 718 H1 GLY 1 H1 GLY 1 -39.731 -5.785 11.597 719 H2 GLY 1 H2 GLY 1 -40.022 -6.743 12.956 720 H3 GLY 1 H3 GLY 1 -38.439 -6.343 12.530 721 HA2 GLY 1 HA3 GLY 1 -40.481 -4.346 13.307 722 HA3 GLY 1 HA2 GLY 1 -39.323 -5.046 14.433 723 H SER 2 H SER 2 -39.903 -2.401 12.636 724 HA SER 2 HA SER 2 -37.313 -1.919 11.513 725 HB2 SER 2 HB2 SER 2 -39.342 0.213 12.126 726 HB3 SER 2 HB3 SER 2 -38.205 0.124 10.781 727 HG SER 2 HG SER 2 -39.458 -1.730 10.054 728 H HIS 3 H HIS 3 -35.637 -0.747 12.346 729 HA HIS 3 HA HIS 3 -35.982 0.543 14.945 730 HB2 HIS 3 HB2 HIS 3 -34.186 -1.771 14.357 731 HB3 HIS 3 HB3 HIS 3 -33.607 -0.526 15.452 732 HD1 HIS 3 HD1 HIS 3 -34.994 -0.188 17.682 733 HD2 HIS 3 HD2 HIS 3 -36.034 -3.526 15.429 734 HE1 HIS 3 HE1 HIS 3 -36.344 -1.646 19.221 735 HE2 HIS 3 HE2 HIS 3 -36.896 -3.697 17.870 736 H MET 4 H MET 4 -33.723 1.636 15.501 737 HA MET 4 HA MET 4 -33.238 3.443 13.333 738 HB2 MET 4 HB2 MET 4 -31.897 3.199 16.032 739 HB3 MET 4 HB3 MET 4 -31.623 4.511 14.894 740 HG2 MET 4 HG2 MET 4 -34.094 4.982 15.032 741 HG3 MET 4 HG3 MET 4 -34.145 3.851 16.380 742 HE1 MET 4 HE1 MET 4 -31.976 7.913 16.329 743 HE2 MET 4 HE2 MET 4 -33.053 7.315 15.070 744 HE3 MET 4 HE3 MET 4 -31.470 6.573 15.300 745 H THR 5 H THR 5 -31.770 3.277 11.789 746 HA THR 5 HA THR 5 -29.327 1.756 12.287 747 HB THR 5 HB THR 5 -30.705 0.134 11.190 748 HG1 THR 5 HG1 THR 5 -29.281 1.009 8.955 749 HG21 THR 5 HG21 THR 5 -31.241 2.233 9.086 750 HG22 THR 5 HG22 THR 5 -32.407 1.587 10.239 751 HG23 THR 5 HG23 THR 5 -31.737 0.545 8.985 752 H GLU 6 H GLU 6 -27.572 2.700 11.531 753 HA GLU 6 HA GLU 6 -27.871 5.060 9.798 754 HB2 GLU 6 HB2 GLU 6 -25.328 4.575 11.257 755 HB3 GLU 6 HB3 GLU 6 -26.174 6.083 10.946 756 HG2 GLU 6 HG2 GLU 6 -26.465 5.936 13.195 757 HG3 GLU 6 HG3 GLU 6 -27.906 5.077 12.655 758 H GLN 7 H GLN 7 -25.233 5.328 8.998 759 HA GLN 7 HA GLN 7 -24.818 2.901 7.379 760 HB2 GLN 7 HB2 GLN 7 -24.250 5.782 6.650 761 HB3 GLN 7 HB3 GLN 7 -23.866 4.390 5.646 762 HG2 GLN 7 HG2 GLN 7 -26.104 3.948 5.188 763 HG3 GLN 7 HG3 GLN 7 -26.670 4.903 6.556 764 HE21 GLN 7 HE21 GLN 7 -26.754 7.141 6.378 765 HE22 GLN 7 HE22 GLN 7 -26.669 7.945 4.848 766 HA PRO 8 HA PRO 8 -20.943 3.350 9.764 767 HB2 PRO 8 HB2 PRO 8 -20.685 0.786 10.473 768 HB3 PRO 8 HB3 PRO 8 -21.875 1.823 11.264 769 HG2 PRO 8 HG2 PRO 8 -22.267 -0.234 9.137 770 HG3 PRO 8 HG3 PRO 8 -23.279 0.128 10.546 771 HD2 PRO 8 HD2 PRO 8 -23.741 1.027 7.952 772 HD3 PRO 8 HD3 PRO 8 -24.436 1.734 9.424 773 H LYS 9 H LYS 9 -18.913 1.692 9.590 774 HA LYS 9 HA LYS 9 -17.996 1.868 6.939 775 HB2 LYS 9 HB2 LYS 9 -16.087 0.434 7.725 776 HB3 LYS 9 HB3 LYS 9 -16.359 1.884 8.676 777 HG2 LYS 9 HG2 LYS 9 -17.161 0.691 10.498 778 HG3 LYS 9 HG3 LYS 9 -17.537 -0.731 9.528 779 HD2 LYS 9 HD2 LYS 9 -15.215 -1.272 9.302 780 HD3 LYS 9 HD3 LYS 9 -14.736 0.258 10.038 781 HE2 LYS 9 HE2 LYS 9 -16.308 -1.903 11.437 782 HE3 LYS 9 HE3 LYS 9 -14.565 -1.685 11.576 783 HZ1 LYS 9 HZ1 LYS 9 -16.649 0.262 12.395 784 HZ2 LYS 9 HZ2 LYS 9 -14.983 0.546 12.461 785 HZ3 LYS 9 HZ3 LYS 9 -15.673 -0.661 13.426 786 H THR 10 H THR 10 -18.807 0.732 5.305 787 HA THR 10 HA THR 10 -19.838 -1.945 5.761 788 HB THR 10 HB THR 10 -21.108 -0.208 4.420 789 HG1 THR 10 HG1 THR 10 -21.748 -1.785 2.843 790 HG21 THR 10 HG21 THR 10 -20.462 -0.048 2.005 791 HG22 THR 10 HG22 THR 10 -18.921 -0.794 2.424 792 HG23 THR 10 HG23 THR 10 -19.356 0.770 3.109 793 H ARG 11 H ARG 11 -19.256 -3.697 4.280 794 HA ARG 11 HA ARG 11 -16.453 -3.468 3.420 795 HB2 ARG 11 HB2 ARG 11 -16.112 -5.771 3.958 796 HB3 ARG 11 HB3 ARG 11 -16.860 -5.009 5.351 797 HG2 ARG 11 HG2 ARG 11 -19.052 -5.915 4.564 798 HG3 ARG 11 HG3 ARG 11 -18.159 -6.827 3.348 799 HD2 ARG 11 HD2 ARG 11 -17.933 -7.052 6.340 800 HD3 ARG 11 HD3 ARG 11 -18.528 -8.267 5.212 801 HE ARG 11 HE ARG 11 -15.794 -7.445 4.768 802 HH11 ARG 11 HH11 ARG 11 -17.920 -9.691 6.404 803 HH12 ARG 11 HH12 ARG 11 -16.691 -10.896 6.623 804 HH21 ARG 11 HH21 ARG 11 -14.168 -9.034 5.037 805 HH22 ARG 11 HH22 ARG 11 -14.563 -10.532 5.828 806 H VAL 12 H VAL 12 -15.838 -4.630 1.517 807 HA VAL 12 HA VAL 12 -18.048 -5.430 -0.242 808 HB VAL 12 HB VAL 12 -17.534 -3.038 -0.676 809 HG11 VAL 12 HG11 VAL 12 -15.249 -2.926 -2.100 810 HG12 VAL 12 HG12 VAL 12 -14.799 -4.097 -0.861 811 HG13 VAL 12 HG13 VAL 12 -15.373 -2.496 -0.396 812 HG21 VAL 12 HG21 VAL 12 -16.849 -4.961 -2.891 813 HG22 VAL 12 HG22 VAL 12 -17.224 -3.253 -3.125 814 HG23 VAL 12 HG23 VAL 12 -18.448 -4.342 -2.471 815 H SER 13 H SER 13 -17.474 -6.947 -1.835 816 HA SER 13 HA SER 13 -14.942 -8.305 -1.337 817 HB2 SER 13 HB2 SER 13 -16.265 -9.877 -3.134 818 HB3 SER 13 HB3 SER 13 -16.436 -10.013 -1.385 819 HG SER 13 HG SER 13 -18.380 -9.674 -2.930 820 H VAL 14 H VAL 14 -13.250 -7.953 -2.628 821 HA VAL 14 HA VAL 14 -13.760 -7.129 -5.412 822 HB VAL 14 HB VAL 14 -11.495 -6.017 -5.322 823 HG11 VAL 14 HG11 VAL 14 -13.508 -4.700 -5.279 824 HG12 VAL 14 HG12 VAL 14 -12.331 -4.002 -4.167 825 HG13 VAL 14 HG13 VAL 14 -13.678 -4.951 -3.540 826 HG21 VAL 14 HG21 VAL 14 -10.457 -5.504 -3.262 827 HG22 VAL 14 HG22 VAL 14 -10.788 -7.236 -3.216 828 HG23 VAL 14 HG23 VAL 14 -11.823 -6.112 -2.331 829 H ARG 15 H ARG 15 -12.677 -8.190 -7.023 830 HA ARG 15 HA ARG 15 -11.338 -10.656 -6.239 831 HB2 ARG 15 HB2 ARG 15 -13.049 -10.927 -7.881 832 HB3 ARG 15 HB3 ARG 15 -12.389 -9.630 -8.870 833 HG2 ARG 15 HG2 ARG 15 -10.330 -11.057 -9.160 834 HG3 ARG 15 HG3 ARG 15 -11.243 -12.368 -8.410 835 HD2 ARG 15 HD2 ARG 15 -12.232 -10.856 -10.820 836 HD3 ARG 15 HD3 ARG 15 -11.232 -12.302 -10.943 837 HE ARG 15 HE ARG 15 -13.027 -13.484 -9.734 838 HH11 ARG 15 HH11 ARG 15 -13.802 -10.465 -11.337 839 HH12 ARG 15 HH12 ARG 15 -15.469 -10.873 -11.573 840 HH21 ARG 15 HH21 ARG 15 -15.225 -14.018 -10.044 841 HH22 ARG 15 HH22 ARG 15 -16.279 -12.898 -10.841 842 H ILE 16 H ILE 16 -9.208 -10.854 -6.205 843 HA ILE 16 HA ILE 16 -7.564 -9.287 -8.060 844 HB ILE 16 HB ILE 16 -7.019 -9.535 -5.095 845 HG12 ILE 16 HG12 ILE 16 -7.327 -6.988 -6.663 846 HG13 ILE 16 HG13 ILE 16 -8.725 -7.805 -5.973 847 HG21 ILE 16 HG21 ILE 16 -5.013 -8.197 -5.536 848 HG22 ILE 16 HG22 ILE 16 -5.368 -8.241 -7.262 849 HG23 ILE 16 HG23 ILE 16 -4.968 -9.731 -6.407 850 HD11 ILE 16 HD11 ILE 16 -7.987 -6.053 -4.504 851 HD12 ILE 16 HD12 ILE 16 -6.359 -6.722 -4.467 852 HD13 ILE 16 HD13 ILE 16 -7.695 -7.618 -3.748 853 H TYR 17 H TYR 17 -6.126 -10.518 -9.051 854 HA TYR 17 HA TYR 17 -4.823 -12.266 -9.665 855 HB2 TYR 17 HB2 TYR 17 -4.122 -11.813 -7.070 856 HB3 TYR 17 HB3 TYR 17 -4.600 -13.504 -7.002 857 HD1 TYR 17 HD2 TYR 17 -2.403 -11.147 -8.854 858 HD2 TYR 17 HD1 TYR 17 -3.104 -15.176 -7.685 859 HE1 TYR 17 HE2 TYR 17 -0.212 -11.786 -9.766 860 HE2 TYR 17 HE1 TYR 17 -0.911 -15.827 -8.593 861 HH TYR 17 HH TYR 17 1.468 -13.564 -9.475 862 H GLY 18 H GLY 18 -7.808 -12.529 -9.213 863 HA2 GLY 18 HA2 GLY 18 -9.134 -14.270 -10.116 864 HA3 GLY 18 HA3 GLY 18 -7.883 -15.418 -9.676 865 H GLN 19 H GLN 19 -8.171 -13.583 -7.004 866 HA GLN 19 HA GLN 19 -10.341 -15.257 -5.916 867 HB2 GLN 19 HB2 GLN 19 -7.900 -14.350 -4.381 868 HB3 GLN 19 HB3 GLN 19 -9.138 -15.478 -3.841 869 HG2 GLN 19 HG2 GLN 19 -8.421 -16.980 -5.738 870 HG3 GLN 19 HG3 GLN 19 -7.045 -15.901 -5.959 871 HE21 GLN 19 HE21 GLN 19 -7.095 -18.697 -5.236 872 HE22 GLN 19 HE22 GLN 19 -6.280 -18.827 -3.717 873 H ASP 20 H ASP 20 -11.816 -14.270 -4.574 874 HA ASP 20 HA ASP 20 -11.678 -11.355 -4.544 875 HB2 ASP 20 HB2 ASP 20 -14.040 -11.331 -4.243 876 HB3 ASP 20 HB3 ASP 20 -13.686 -12.495 -5.511 877 H TYR 21 H TYR 21 -11.658 -10.143 -2.758 878 HA TYR 21 HA TYR 21 -11.654 -11.532 -0.156 879 HB2 TYR 21 HB2 TYR 21 -10.042 -9.037 -0.672 880 HB3 TYR 21 HB3 TYR 21 -9.857 -10.215 0.621 881 HD1 TYR 21 HD1 TYR 21 -9.670 -12.761 -0.771 882 HD2 TYR 21 HD2 TYR 21 -8.070 -8.971 -1.857 883 HE1 TYR 21 HE1 TYR 21 -7.909 -13.878 -2.072 884 HE2 TYR 21 HE2 TYR 21 -6.304 -10.083 -3.151 885 HH TYR 21 HH TYR 21 -6.351 -12.869 -4.301 886 H THR 22 H THR 22 -13.010 -10.721 1.346 887 HA THR 22 HA THR 22 -14.637 -8.434 0.644 888 HB THR 22 HB THR 22 -15.128 -9.506 3.289 889 HG1 THR 22 HG1 THR 22 -15.900 -11.564 1.911 890 HG21 THR 22 HG21 THR 22 -17.364 -9.841 2.387 891 HG22 THR 22 HG22 THR 22 -16.759 -9.595 0.747 892 HG23 THR 22 HG23 THR 22 -16.749 -8.260 1.901 893 H ILE 23 H ILE 23 -13.073 -6.783 0.805 894 HA ILE 23 HA ILE 23 -11.815 -6.278 3.379 895 HB ILE 23 HB ILE 23 -10.679 -4.423 2.277 896 HG12 ILE 23 HG12 ILE 23 -11.959 -5.210 -0.327 897 HG13 ILE 23 HG13 ILE 23 -12.718 -4.013 0.718 898 HG21 ILE 23 HG21 ILE 23 -10.621 -6.939 0.622 899 HG22 ILE 23 HG22 ILE 23 -9.748 -6.683 2.132 900 HG23 ILE 23 HG23 ILE 23 -9.348 -5.723 0.708 901 HD11 ILE 23 HD11 ILE 23 -10.748 -2.618 0.576 902 HD12 ILE 23 HD12 ILE 23 -11.357 -2.995 -1.037 903 HD13 ILE 23 HD13 ILE 23 -9.940 -3.836 -0.407 904 H VAL 24 H VAL 24 -11.763 -3.764 3.891 905 HA VAL 24 HA VAL 24 -14.571 -3.009 4.248 906 HB VAL 24 HB VAL 24 -12.069 -2.115 5.689 907 HG11 VAL 24 HG11 VAL 24 -13.583 -0.919 7.226 908 HG12 VAL 24 HG12 VAL 24 -14.941 -1.308 6.170 909 HG13 VAL 24 HG13 VAL 24 -13.643 -0.265 5.590 910 HG21 VAL 24 HG21 VAL 24 -12.766 -4.372 6.258 911 HG22 VAL 24 HG22 VAL 24 -14.403 -3.806 6.590 912 HG23 VAL 24 HG23 VAL 24 -13.064 -3.279 7.611 913 H GLY 25 H GLY 25 -15.419 -1.350 3.142 914 HA2 GLY 25 HA2 GLY 25 -13.565 0.654 2.006 915 HA3 GLY 25 HA3 GLY 25 -14.951 0.037 1.114 916 H ALA 26 H ALA 26 -14.011 1.830 4.008 917 HA ALA 26 HA ALA 26 -16.686 2.765 4.505 918 HB1 ALA 26 HB1 ALA 26 -14.071 3.615 5.734 919 HB2 ALA 26 HB2 ALA 26 -15.164 2.380 6.357 920 HB3 ALA 26 HB3 ALA 26 -15.675 4.067 6.310 921 H GLU 27 H GLU 27 -14.308 3.728 2.330 922 HA GLU 27 HA GLU 27 -14.914 6.550 2.452 923 HB2 GLU 27 HB2 GLU 27 -12.728 5.165 1.568 924 HB3 GLU 27 HB3 GLU 27 -13.531 5.536 0.051 925 HG2 GLU 27 HG2 GLU 27 -12.579 7.476 2.130 926 HG3 GLU 27 HG3 GLU 27 -11.956 7.252 0.495 927 H SER 28 H SER 28 -15.131 4.179 -0.212 928 HA SER 28 HA SER 28 -17.842 4.581 -0.761 929 HB2 SER 28 HB2 SER 28 -17.361 5.769 -3.047 930 HB3 SER 28 HB3 SER 28 -17.521 6.737 -1.584 931 HG SER 28 HG SER 28 -15.358 7.048 -1.524 932 HA PRO 29 HA PRO 29 -17.071 0.798 -2.869 933 HB2 PRO 29 HB2 PRO 29 -19.018 1.022 -4.841 934 HB3 PRO 29 HB3 PRO 29 -19.259 0.375 -3.217 935 HG2 PRO 29 HG2 PRO 29 -19.859 3.093 -4.283 936 HG3 PRO 29 HG3 PRO 29 -20.762 2.120 -3.110 937 HD2 PRO 29 HD2 PRO 29 -19.234 4.186 -2.343 938 HD3 PRO 29 HD3 PRO 29 -19.368 2.714 -1.358 939 H ALA 30 H ALA 30 -17.348 3.728 -4.836 940 HA ALA 30 HA ALA 30 -16.061 2.503 -7.106 941 HB1 ALA 30 HB1 ALA 30 -16.198 4.695 -8.139 942 HB2 ALA 30 HB2 ALA 30 -16.673 5.414 -6.601 943 HB3 ALA 30 HB3 ALA 30 -17.741 4.263 -7.403 944 H HIS 31 H HIS 31 -14.984 3.942 -4.221 945 HA HIS 31 HA HIS 31 -12.536 5.033 -5.273 946 HB2 HIS 31 HB2 HIS 31 -13.922 5.094 -2.743 947 HB3 HIS 31 HB3 HIS 31 -12.228 4.684 -2.504 948 HD1 HIS 31 HD1 HIS 31 -14.453 7.439 -3.705 949 HD2 HIS 31 HD2 HIS 31 -10.422 6.734 -3.027 950 HE1 HIS 31 HE1 HIS 31 -13.352 9.686 -3.837 951 HE2 HIS 31 HE2 HIS 31 -10.984 9.255 -3.088 952 H ILE 32 H ILE 32 -13.271 2.231 -3.164 953 HA ILE 32 HA ILE 32 -10.546 1.360 -3.274 954 HB ILE 32 HB ILE 32 -11.072 -0.504 -1.982 955 HG12 ILE 32 HG12 ILE 32 -12.976 -1.331 -3.356 956 HG13 ILE 32 HG13 ILE 32 -13.215 -1.494 -1.625 957 HG21 ILE 32 HG21 ILE 32 -11.168 1.350 -0.589 958 HG22 ILE 32 HG22 ILE 32 -12.583 0.392 -0.158 959 HG23 ILE 32 HG23 ILE 32 -12.762 1.827 -1.161 960 HD11 ILE 32 HD11 ILE 32 -15.271 -0.824 -2.505 961 HD12 ILE 32 HD12 ILE 32 -14.537 0.420 -3.511 962 HD13 ILE 32 HD13 ILE 32 -14.598 0.622 -1.758 963 H ARG 33 H ARG 33 -13.125 1.113 -5.411 964 HA ARG 33 HA ARG 33 -12.584 -1.395 -6.602 965 HB2 ARG 33 HB2 ARG 33 -14.676 -0.040 -6.929 966 HB3 ARG 33 HB3 ARG 33 -13.748 1.055 -7.947 967 HG2 ARG 33 HG2 ARG 33 -13.641 -0.424 -9.677 968 HG3 ARG 33 HG3 ARG 33 -13.696 -1.835 -8.620 969 HD2 ARG 33 HD2 ARG 33 -15.748 -1.657 -9.908 970 HD3 ARG 33 HD3 ARG 33 -16.073 -1.414 -8.193 971 HE ARG 33 HE ARG 33 -15.638 1.070 -9.512 972 HH11 ARG 33 HH11 ARG 33 -18.012 -1.465 -9.076 973 HH12 ARG 33 HH12 ARG 33 -19.366 -0.425 -9.381 974 HH21 ARG 33 HH21 ARG 33 -17.415 2.445 -9.917 975 HH22 ARG 33 HH22 ARG 33 -19.024 1.795 -9.862 976 H LEU 34 H LEU 34 -11.090 1.707 -6.771 977 HA LEU 34 HA LEU 34 -9.653 1.314 -9.206 978 HB2 LEU 34 HB2 LEU 34 -8.959 3.121 -6.891 979 HB3 LEU 34 HB3 LEU 34 -8.342 3.240 -8.525 980 HG LEU 34 HG LEU 34 -11.254 3.609 -7.829 981 HD11 LEU 34 HD11 LEU 34 -10.768 6.036 -8.133 982 HD12 LEU 34 HD12 LEU 34 -9.049 5.644 -8.097 983 HD13 LEU 34 HD13 LEU 34 -10.056 5.328 -6.683 984 HD21 LEU 34 HD21 LEU 34 -11.300 4.724 -10.037 985 HD22 LEU 34 HD22 LEU 34 -10.888 3.012 -10.134 986 HD23 LEU 34 HD23 LEU 34 -9.625 4.232 -10.287 987 H VAL 35 H VAL 35 -9.068 0.778 -5.811 988 HA VAL 35 HA VAL 35 -6.336 0.130 -5.915 989 HB VAL 35 HB VAL 35 -8.492 -0.619 -3.946 990 HG11 VAL 35 HG11 VAL 35 -5.536 -1.147 -3.829 991 HG12 VAL 35 HG12 VAL 35 -6.856 -2.306 -3.694 992 HG13 VAL 35 HG13 VAL 35 -6.575 -1.135 -2.404 993 HG21 VAL 35 HG21 VAL 35 -8.211 1.634 -3.689 994 HG22 VAL 35 HG22 VAL 35 -6.525 1.597 -4.203 995 HG23 VAL 35 HG23 VAL 35 -6.967 1.037 -2.592 996 H ALA 36 H ALA 36 -9.247 -1.858 -6.143 997 HA ALA 36 HA ALA 36 -8.169 -4.385 -5.985 998 HB1 ALA 36 HB1 ALA 36 -10.562 -3.903 -6.063 999 HB2 ALA 36 HB2 ALA 36 -10.108 -5.153 -7.221 1000 HB3 ALA 36 HB3 ALA 36 -10.425 -3.508 -7.776 1001 H ALA 37 H ALA 37 -8.795 -2.647 -9.046 1002 HA ALA 37 HA ALA 37 -7.428 -4.535 -10.650 1003 HB1 ALA 37 HB1 ALA 37 -9.144 -3.052 -11.547 1004 HB2 ALA 37 HB2 ALA 37 -7.629 -2.873 -12.433 1005 HB3 ALA 37 HB3 ALA 37 -8.107 -1.658 -11.248 1006 H PHE 38 H PHE 38 -6.417 -1.647 -8.967 1007 HA PHE 38 HA PHE 38 -3.950 -1.235 -10.253 1008 HB2 PHE 38 HB2 PHE 38 -4.797 0.545 -8.968 1009 HB3 PHE 38 HB3 PHE 38 -5.059 -0.478 -7.565 1010 HD1 PHE 38 HD1 PHE 38 -2.097 0.307 -9.714 1011 HD2 PHE 38 HD2 PHE 38 -3.771 0.158 -5.805 1012 HE1 PHE 38 HE1 PHE 38 0.046 1.054 -8.765 1013 HE2 PHE 38 HE2 PHE 38 -1.629 0.901 -4.855 1014 HZ PHE 38 HZ PHE 38 0.284 1.350 -6.337 1015 H VAL 39 H VAL 39 -4.722 -2.988 -7.242 1016 HA VAL 39 HA VAL 39 -2.062 -3.830 -6.756 1017 HB VAL 39 HB VAL 39 -4.677 -5.010 -5.801 1018 HG11 VAL 39 HG11 VAL 39 -1.867 -5.537 -4.831 1019 HG12 VAL 39 HG12 VAL 39 -2.914 -6.685 -5.665 1020 HG13 VAL 39 HG13 VAL 39 -3.343 -6.111 -4.054 1021 HG21 VAL 39 HG21 VAL 39 -4.425 -2.775 -5.008 1022 HG22 VAL 39 HG22 VAL 39 -2.739 -3.057 -4.574 1023 HG23 VAL 39 HG23 VAL 39 -4.025 -3.859 -3.675 1024 H ASP 40 H ASP 40 -4.787 -5.275 -8.452 1025 HA ASP 40 HA ASP 40 -3.768 -7.830 -8.901 1026 HB2 ASP 40 HB2 ASP 40 -6.104 -6.933 -9.399 1027 HB3 ASP 40 HB3 ASP 40 -5.436 -6.292 -10.895 1028 H ASP 41 H ASP 41 -3.289 -4.828 -10.707 1029 HA ASP 41 HA ASP 41 -1.756 -5.983 -12.812 1030 HB2 ASP 41 HB2 ASP 41 -2.729 -3.892 -13.316 1031 HB3 ASP 41 HB3 ASP 41 -2.128 -3.155 -11.836 1032 H LYS 42 H LYS 42 -0.887 -4.269 -9.834 1033 HA LYS 42 HA LYS 42 1.876 -4.199 -10.215 1034 HB2 LYS 42 HB2 LYS 42 0.277 -4.353 -7.657 1035 HB3 LYS 42 HB3 LYS 42 2.008 -4.054 -7.710 1036 HG2 LYS 42 HG2 LYS 42 0.943 -2.187 -9.457 1037 HG3 LYS 42 HG3 LYS 42 -0.200 -2.235 -8.116 1038 HD2 LYS 42 HD2 LYS 42 1.407 -0.586 -7.558 1039 HD3 LYS 42 HD3 LYS 42 1.783 -2.000 -6.571 1040 HE2 LYS 42 HE2 LYS 42 3.810 -2.196 -7.475 1041 HE3 LYS 42 HE3 LYS 42 3.157 -2.085 -9.111 1042 HZ1 LYS 42 HZ1 LYS 42 3.215 0.289 -8.988 1043 HZ2 LYS 42 HZ2 LYS 42 4.738 -0.297 -8.552 1044 HZ3 LYS 42 HZ3 LYS 42 3.677 0.265 -7.356 1045 H MET 43 H MET 43 -0.144 -6.706 -8.712 1046 HA MET 43 HA MET 43 1.999 -8.384 -7.956 1047 HB2 MET 43 HB2 MET 43 -0.857 -9.109 -8.641 1048 HB3 MET 43 HB3 MET 43 0.301 -10.198 -7.889 1049 HG2 MET 43 HG2 MET 43 0.437 -8.757 -5.952 1050 HG3 MET 43 HG3 MET 43 -0.662 -7.602 -6.707 1051 HE1 MET 43 HE1 MET 43 -1.772 -11.729 -5.006 1052 HE2 MET 43 HE2 MET 43 -0.203 -10.936 -4.875 1053 HE3 MET 43 HE3 MET 43 -0.725 -11.606 -6.419 1054 H HIS 44 H HIS 44 0.238 -7.971 -10.946 1055 HA HIS 44 HA HIS 44 1.051 -10.302 -12.289 1056 HB2 HIS 44 HB2 HIS 44 -0.745 -8.588 -12.965 1057 HB3 HIS 44 HB3 HIS 44 0.575 -7.645 -13.640 1058 HD1 HIS 44 HD1 HIS 44 -1.876 -9.085 -15.187 1059 HD2 HIS 44 HD2 HIS 44 2.098 -10.313 -15.052 1060 HE1 HIS 44 HE1 HIS 44 -1.540 -10.518 -17.224 1061 HE2 HIS 44 HE2 HIS 44 0.896 -11.157 -17.177 1062 H GLU 45 H GLU 45 2.450 -7.014 -12.357 1063 HA GLU 45 HA GLU 45 4.652 -7.807 -13.983 1064 HB2 GLU 45 HB2 GLU 45 5.600 -5.578 -13.404 1065 HB3 GLU 45 HB3 GLU 45 3.971 -5.511 -14.060 1066 HG2 GLU 45 HG2 GLU 45 3.044 -4.849 -12.055 1067 HG3 GLU 45 HG3 GLU 45 4.338 -5.570 -11.101 1068 H PHE 46 H PHE 46 4.104 -7.668 -10.525 1069 HA PHE 46 HA PHE 46 6.838 -7.859 -9.774 1070 HB2 PHE 46 HB2 PHE 46 4.229 -8.233 -8.372 1071 HB3 PHE 46 HB3 PHE 46 5.692 -8.841 -7.605 1072 HD1 PHE 46 HD2 PHE 46 5.805 -5.878 -9.730 1073 HD2 PHE 46 HD1 PHE 46 5.470 -7.318 -5.743 1074 HE1 PHE 46 HE2 PHE 46 6.316 -3.627 -8.880 1075 HE2 PHE 46 HE1 PHE 46 5.988 -5.077 -4.886 1076 HZ PHE 46 HZ PHE 46 6.409 -3.224 -6.454 1077 H SER 47 H SER 47 4.477 -10.165 -10.818 1078 HA SER 47 HA SER 47 5.825 -12.474 -9.806 1079 HB2 SER 47 HB2 SER 47 3.780 -12.226 -12.030 1080 HB3 SER 47 HB3 SER 47 4.289 -13.734 -11.271 1081 HG SER 47 HG SER 47 3.015 -11.546 -9.968 1082 H GLU 48 H GLU 48 6.591 -10.292 -12.187 1083 HA GLU 48 HA GLU 48 7.856 -12.160 -14.002 1084 HB2 GLU 48 HB2 GLU 48 6.779 -9.938 -14.670 1085 HB3 GLU 48 HB3 GLU 48 8.184 -9.158 -13.955 1086 HG2 GLU 48 HG2 GLU 48 8.464 -9.333 -16.334 1087 HG3 GLU 48 HG3 GLU 48 9.631 -10.374 -15.521 1088 H LYS 49 H LYS 49 8.660 -10.272 -11.223 1089 HA LYS 49 HA LYS 49 11.463 -10.091 -11.603 1090 HB2 LYS 49 HB2 LYS 49 9.835 -10.090 -9.053 1091 HB3 LYS 49 HB3 LYS 49 11.540 -9.670 -9.146 1092 HG2 LYS 49 HG2 LYS 49 10.933 -7.812 -10.682 1093 HG3 LYS 49 HG3 LYS 49 9.233 -8.200 -10.408 1094 HD2 LYS 49 HD2 LYS 49 9.609 -7.853 -7.972 1095 HD3 LYS 49 HD3 LYS 49 11.252 -7.324 -8.340 1096 HE2 LYS 49 HE2 LYS 49 8.691 -6.028 -9.266 1097 HE3 LYS 49 HE3 LYS 49 9.795 -5.407 -8.045 1098 HZ1 LYS 49 HZ1 LYS 49 10.387 -4.239 -9.920 1099 HZ2 LYS 49 HZ2 LYS 49 10.146 -5.542 -10.960 1100 HZ3 LYS 49 HZ3 LYS 49 11.506 -5.506 -9.955 1101 H GLN 50 H GLN 50 9.427 -12.372 -9.817 1102 HA GLN 50 HA GLN 50 9.772 -14.455 -8.979 1103 HB2 GLN 50 HB2 GLN 50 11.690 -14.573 -11.315 1104 HB3 GLN 50 HB3 GLN 50 11.162 -15.971 -10.386 1105 HG2 GLN 50 HG2 GLN 50 8.919 -15.718 -11.136 1106 HG3 GLN 50 HG3 GLN 50 9.269 -14.143 -11.846 1107 HE21 GLN 50 HE21 GLN 50 8.525 -14.813 -13.856 1108 HE22 GLN 50 HE22 GLN 50 9.426 -15.897 -14.859 1109 HA PRO 51 HA PRO 51 13.751 -13.284 -6.862 1110 HB2 PRO 51 HB2 PRO 51 12.699 -12.897 -4.368 1111 HB3 PRO 51 HB3 PRO 51 12.934 -11.614 -5.556 1112 HG2 PRO 51 HG2 PRO 51 10.451 -12.949 -4.689 1113 HG3 PRO 51 HG3 PRO 51 10.687 -11.339 -5.381 1114 HD2 PRO 51 HD2 PRO 51 9.715 -13.606 -6.724 1115 HD3 PRO 51 HD3 PRO 51 10.238 -12.087 -7.468 1116 H MET 52 H MET 52 11.175 -14.934 -5.000 1117 HA MET 52 HA MET 52 13.073 -17.133 -4.530 1118 HB2 MET 52 HB2 MET 52 10.851 -16.009 -2.839 1119 HB3 MET 52 HB3 MET 52 11.474 -17.631 -2.563 1120 HG2 MET 52 HG2 MET 52 13.137 -15.123 -2.521 1121 HG3 MET 52 HG3 MET 52 12.471 -15.914 -1.091 1122 HE1 MET 52 HE1 MET 52 15.554 -15.241 -1.359 1123 HE2 MET 52 HE2 MET 52 16.277 -16.742 -0.780 1124 HE3 MET 52 HE3 MET 52 14.859 -16.078 0.031 1125 H LEU 53 H LEU 53 10.603 -16.379 -6.457 1126 HA LEU 53 HA LEU 53 8.955 -17.448 -7.580 1127 HB2 LEU 53 HB2 LEU 53 11.002 -19.572 -7.102 1128 HB3 LEU 53 HB3 LEU 53 9.485 -19.998 -7.873 1129 HG LEU 53 HG LEU 53 11.204 -17.770 -8.932 1130 HD11 LEU 53 HD11 LEU 53 12.224 -19.344 -10.460 1131 HD12 LEU 53 HD12 LEU 53 11.352 -20.677 -9.702 1132 HD13 LEU 53 HD13 LEU 53 12.579 -19.797 -8.791 1133 HD21 LEU 53 HD21 LEU 53 9.122 -19.563 -10.175 1134 HD22 LEU 53 HD22 LEU 53 10.052 -18.335 -11.035 1135 HD23 LEU 53 HD23 LEU 53 8.927 -17.859 -9.766 1136 H ASP 54 H ASP 54 8.164 -16.918 -5.116 1137 HA ASP 54 HA ASP 54 6.569 -19.269 -4.356 1138 HB2 ASP 54 HB2 ASP 54 8.308 -19.011 -2.683 1139 HB3 ASP 54 HB3 ASP 54 7.943 -17.299 -2.516 1140 H VAL 55 H VAL 55 4.412 -18.859 -4.057 1141 HA VAL 55 HA VAL 55 3.373 -16.425 -5.062 1142 HB VAL 55 HB VAL 55 1.752 -18.453 -3.538 1143 HG11 VAL 55 HG11 VAL 55 1.020 -16.568 -5.766 1144 HG12 VAL 55 HG12 VAL 55 0.641 -16.330 -4.061 1145 HG13 VAL 55 HG13 VAL 55 -0.070 -17.683 -4.944 1146 HG21 VAL 55 HG21 VAL 55 3.053 -19.647 -5.199 1147 HG22 VAL 55 HG22 VAL 55 2.556 -18.496 -6.439 1148 HG23 VAL 55 HG23 VAL 55 1.362 -19.561 -5.696 1149 HA PRO 56 HA PRO 56 1.892 -15.535 -0.448 1150 HB2 PRO 56 HB2 PRO 56 4.159 -16.906 0.935 1151 HB3 PRO 56 HB3 PRO 56 2.484 -16.688 1.461 1152 HG2 PRO 56 HG2 PRO 56 3.272 -19.043 0.555 1153 HG3 PRO 56 HG3 PRO 56 1.692 -18.390 0.084 1154 HD2 PRO 56 HD2 PRO 56 4.237 -18.493 -1.485 1155 HD3 PRO 56 HD3 PRO 56 2.574 -18.787 -2.017 1156 H LYS 57 H LYS 57 5.408 -16.011 -0.907 1157 HA LYS 57 HA LYS 57 6.194 -13.598 0.326 1158 HB2 LYS 57 HB2 LYS 57 7.514 -15.482 -1.593 1159 HB3 LYS 57 HB3 LYS 57 8.282 -13.950 -1.212 1160 HG2 LYS 57 HG2 LYS 57 7.399 -15.443 1.139 1161 HG3 LYS 57 HG3 LYS 57 8.609 -16.280 0.168 1162 HD2 LYS 57 HD2 LYS 57 8.966 -13.407 0.971 1163 HD3 LYS 57 HD3 LYS 57 9.423 -14.727 2.050 1164 HE2 LYS 57 HE2 LYS 57 10.689 -15.607 -0.069 1165 HE3 LYS 57 HE3 LYS 57 10.597 -13.923 -0.577 1166 HZ1 LYS 57 HZ1 LYS 57 11.744 -13.266 1.437 1167 HZ2 LYS 57 HZ2 LYS 57 12.658 -14.428 0.617 1168 HZ3 LYS 57 HZ3 LYS 57 11.770 -14.871 1.987 1169 H LEU 58 H LEU 58 5.033 -14.302 -2.867 1170 HA LEU 58 HA LEU 58 5.947 -11.860 -4.059 1171 HB2 LEU 58 HB2 LEU 58 5.307 -14.147 -5.164 1172 HB3 LEU 58 HB3 LEU 58 3.678 -13.522 -5.110 1173 HG LEU 58 HG LEU 58 4.742 -13.249 -7.313 1174 HD11 LEU 58 HD11 LEU 58 4.198 -10.608 -5.978 1175 HD12 LEU 58 HD12 LEU 58 2.972 -11.712 -6.595 1176 HD13 LEU 58 HD13 LEU 58 4.117 -10.958 -7.704 1177 HD21 LEU 58 HD21 LEU 58 7.047 -12.809 -6.218 1178 HD22 LEU 58 HD22 LEU 58 6.522 -11.124 -6.193 1179 HD23 LEU 58 HD23 LEU 58 6.633 -11.993 -7.722 1180 H ALA 59 H ALA 59 2.864 -13.074 -2.825 1181 HA ALA 59 HA ALA 59 1.236 -10.912 -3.462 1182 HB1 ALA 59 HB1 ALA 59 1.116 -12.920 -1.236 1183 HB2 ALA 59 HB2 ALA 59 0.199 -12.893 -2.742 1184 HB3 ALA 59 HB3 ALA 59 -0.136 -11.707 -1.479 1185 H VAL 60 H VAL 60 3.215 -11.433 -0.563 1186 HA VAL 60 HA VAL 60 2.363 -8.961 0.627 1187 HB VAL 60 HB VAL 60 3.023 -10.876 2.026 1188 HG11 VAL 60 HG11 VAL 60 5.658 -10.463 0.685 1189 HG12 VAL 60 HG12 VAL 60 4.777 -11.959 1.003 1190 HG13 VAL 60 HG13 VAL 60 5.588 -11.117 2.321 1191 HG21 VAL 60 HG21 VAL 60 3.086 -8.638 2.966 1192 HG22 VAL 60 HG22 VAL 60 4.747 -8.433 2.411 1193 HG23 VAL 60 HG23 VAL 60 4.373 -9.636 3.645 1194 H LEU 61 H LEU 61 4.854 -9.917 -1.560 1195 HA LEU 61 HA LEU 61 6.754 -7.901 -1.095 1196 HB2 LEU 61 HB2 LEU 61 7.182 -9.883 -2.491 1197 HB3 LEU 61 HB3 LEU 61 6.040 -9.291 -3.684 1198 HG LEU 61 HG LEU 61 7.551 -7.282 -3.977 1199 HD11 LEU 61 HD11 LEU 61 9.415 -8.999 -2.346 1200 HD12 LEU 61 HD12 LEU 61 8.794 -7.407 -1.913 1201 HD13 LEU 61 HD13 LEU 61 9.898 -7.583 -3.277 1202 HD21 LEU 61 HD21 LEU 61 9.130 -8.493 -5.397 1203 HD22 LEU 61 HD22 LEU 61 7.487 -9.105 -5.577 1204 HD23 LEU 61 HD23 LEU 61 8.664 -10.007 -4.621 1205 H THR 62 H THR 62 3.793 -7.979 -2.978 1206 HA THR 62 HA THR 62 4.122 -5.532 -4.322 1207 HB THR 62 HB THR 62 1.352 -6.045 -3.719 1208 HG1 THR 62 HG1 THR 62 1.693 -8.162 -3.358 1209 HG21 THR 62 HG21 THR 62 1.225 -6.378 -6.143 1210 HG22 THR 62 HG22 THR 62 2.985 -6.426 -6.225 1211 HG23 THR 62 HG23 THR 62 2.165 -4.940 -5.741 1212 H ALA 63 H ALA 63 2.808 -6.340 -1.158 1213 HA ALA 63 HA ALA 63 1.605 -3.871 -0.562 1214 HB1 ALA 63 HB1 ALA 63 1.574 -4.624 1.729 1215 HB2 ALA 63 HB2 ALA 63 2.785 -5.855 1.375 1216 HB3 ALA 63 HB3 ALA 63 1.179 -5.970 0.661 1217 H VAL 64 H VAL 64 4.768 -5.154 0.420 1218 HA VAL 64 HA VAL 64 5.613 -2.861 1.790 1219 HB VAL 64 HB VAL 64 6.646 -5.087 2.063 1220 HG11 VAL 64 HG11 VAL 64 6.793 -5.833 -0.210 1221 HG12 VAL 64 HG12 VAL 64 8.410 -5.794 0.488 1222 HG13 VAL 64 HG13 VAL 64 7.894 -4.518 -0.615 1223 HG21 VAL 64 HG21 VAL 64 9.007 -4.293 2.205 1224 HG22 VAL 64 HG22 VAL 64 7.829 -3.221 2.960 1225 HG23 VAL 64 HG23 VAL 64 8.504 -2.816 1.381 1226 H GLN 65 H GLN 65 5.602 -3.522 -1.636 1227 HA GLN 65 HA GLN 65 7.469 -1.378 -2.202 1228 HB2 GLN 65 HB2 GLN 65 6.075 -3.447 -3.790 1229 HB3 GLN 65 HB3 GLN 65 6.418 -1.936 -4.621 1230 HG2 GLN 65 HG2 GLN 65 8.529 -3.498 -3.142 1231 HG3 GLN 65 HG3 GLN 65 8.171 -3.750 -4.849 1232 HE21 GLN 65 HE21 GLN 65 7.627 -0.911 -5.323 1233 HE22 GLN 65 HE22 GLN 65 9.167 -0.127 -5.309 1234 H ILE 66 H ILE 66 3.969 -1.941 -2.500 1235 HA ILE 66 HA ILE 66 3.364 0.529 -3.732 1236 HB ILE 66 HB ILE 66 1.649 -1.235 -1.970 1237 HG12 ILE 66 HG12 ILE 66 1.508 -0.848 -4.960 1238 HG13 ILE 66 HG13 ILE 66 2.499 -2.098 -4.215 1239 HG21 ILE 66 HG21 ILE 66 -0.281 -0.002 -2.832 1240 HG22 ILE 66 HG22 ILE 66 0.795 1.095 -3.694 1241 HG23 ILE 66 HG23 ILE 66 0.798 1.062 -1.930 1242 HD11 ILE 66 HD11 ILE 66 -0.489 -1.838 -4.213 1243 HD12 ILE 66 HD12 ILE 66 0.362 -2.902 -3.095 1244 HD13 ILE 66 HD13 ILE 66 0.503 -3.156 -4.835 1245 H ALA 67 H ALA 67 3.548 -0.467 -0.351 1246 HA ALA 67 HA ALA 67 2.601 1.945 0.757 1247 HB1 ALA 67 HB1 ALA 67 2.541 -0.053 2.053 1248 HB2 ALA 67 HB2 ALA 67 3.613 1.087 2.865 1249 HB3 ALA 67 HB3 ALA 67 4.288 -0.249 1.930 1250 H SER 68 H SER 68 5.816 0.963 -0.291 1251 HA SER 68 HA SER 68 7.132 3.100 1.099 1252 HB2 SER 68 HB2 SER 68 9.019 2.389 -0.616 1253 HB3 SER 68 HB3 SER 68 8.626 1.379 0.774 1254 HG SER 68 HG SER 68 7.790 -0.089 -0.504 1255 H GLU 69 H GLU 69 6.300 2.473 -2.307 1256 HA GLU 69 HA GLU 69 7.300 4.933 -3.267 1257 HB2 GLU 69 HB2 GLU 69 6.102 4.456 -5.328 1258 HB3 GLU 69 HB3 GLU 69 6.915 3.015 -4.742 1259 HG2 GLU 69 HG2 GLU 69 4.659 2.355 -3.745 1260 HG3 GLU 69 HG3 GLU 69 3.980 3.637 -4.747 1261 H TYR 70 H TYR 70 4.406 4.145 -1.604 1262 HA TYR 70 HA TYR 70 3.109 6.634 -2.409 1263 HB2 TYR 70 HB2 TYR 70 2.217 4.087 -1.314 1264 HB3 TYR 70 HB3 TYR 70 1.523 5.462 -0.466 1265 HD1 TYR 70 HD2 TYR 70 2.293 4.762 -4.061 1266 HD2 TYR 70 HD1 TYR 70 -0.614 5.885 -1.171 1267 HE1 TYR 70 HE2 TYR 70 0.629 5.034 -5.850 1268 HE2 TYR 70 HE1 TYR 70 -2.289 6.158 -2.951 1269 HH TYR 70 HH TYR 70 -1.691 5.132 -6.208 1270 H LEU 71 H LEU 71 4.963 5.321 0.194 1271 HA LEU 71 HA LEU 71 4.078 6.964 2.291 1272 HB2 LEU 71 HB2 LEU 71 5.547 4.922 2.486 1273 HB3 LEU 71 HB3 LEU 71 6.879 5.921 1.932 1274 HG LEU 71 HG LEU 71 6.521 7.410 3.921 1275 HD11 LEU 71 HD11 LEU 71 4.264 7.010 4.507 1276 HD12 LEU 71 HD12 LEU 71 5.249 6.392 5.831 1277 HD13 LEU 71 HD13 LEU 71 4.537 5.276 4.666 1278 HD21 LEU 71 HD21 LEU 71 7.590 5.967 5.519 1279 HD22 LEU 71 HD22 LEU 71 8.242 5.632 3.916 1280 HD23 LEU 71 HD23 LEU 71 7.062 4.536 4.640 1281 H LYS 72 H LYS 72 6.625 7.404 -0.104 1282 HA LYS 72 HA LYS 72 7.594 9.869 0.887 1283 HB2 LYS 72 HB2 LYS 72 8.652 10.122 -1.315 1284 HB3 LYS 72 HB3 LYS 72 8.898 8.504 -0.676 1285 HG2 LYS 72 HG2 LYS 72 7.245 7.599 -2.160 1286 HG3 LYS 72 HG3 LYS 72 6.773 9.213 -2.691 1287 HD2 LYS 72 HD2 LYS 72 8.878 9.549 -3.774 1288 HD3 LYS 72 HD3 LYS 72 9.534 8.067 -3.075 1289 HE2 LYS 72 HE2 LYS 72 7.716 6.830 -4.315 1290 HE3 LYS 72 HE3 LYS 72 7.390 8.336 -5.166 1291 HZ1 LYS 72 HZ1 LYS 72 9.505 8.310 -6.142 1292 HZ2 LYS 72 HZ2 LYS 72 8.943 6.722 -6.283 1293 HZ3 LYS 72 HZ3 LYS 72 10.086 7.112 -5.091 1294 H LEU 73 H LEU 73 4.861 9.018 -1.063 1295 HA LEU 73 HA LEU 73 4.420 11.626 -2.147 1296 HB2 LEU 73 HB2 LEU 73 3.636 9.484 -3.180 1297 HB3 LEU 73 HB3 LEU 73 2.460 9.346 -1.888 1298 HG LEU 73 HG LEU 73 1.450 11.499 -2.648 1299 HD11 LEU 73 HD11 LEU 73 2.047 12.122 -5.045 1300 HD12 LEU 73 HD12 LEU 73 3.529 11.200 -4.793 1301 HD13 LEU 73 HD13 LEU 73 3.180 12.603 -3.784 1302 HD21 LEU 73 HD21 LEU 73 0.514 9.350 -3.320 1303 HD22 LEU 73 HD22 LEU 73 1.598 9.302 -4.710 1304 HD23 LEU 73 HD23 LEU 73 0.348 10.544 -4.606 1305 H LYS 74 H LYS 74 3.009 9.755 0.536 1306 HA LYS 74 HA LYS 74 1.175 11.811 1.260 1307 HB2 LYS 74 HB2 LYS 74 0.728 10.514 3.259 1308 HB3 LYS 74 HB3 LYS 74 0.799 9.449 1.862 1309 HG2 LYS 74 HG2 LYS 74 2.326 8.210 2.860 1310 HG3 LYS 74 HG3 LYS 74 3.396 9.605 3.016 1311 HD2 LYS 74 HD2 LYS 74 3.020 8.712 5.206 1312 HD3 LYS 74 HD3 LYS 74 2.140 10.233 5.086 1313 HE2 LYS 74 HE2 LYS 74 0.112 9.225 5.195 1314 HE3 LYS 74 HE3 LYS 74 0.662 7.790 4.336 1315 HZ1 LYS 74 HZ1 LYS 74 1.425 6.817 6.245 1316 HZ2 LYS 74 HZ2 LYS 74 0.102 7.675 6.856 1317 HZ3 LYS 74 HZ3 LYS 74 1.662 8.287 7.048 1318 H GLU 75 H GLU 75 4.515 11.261 1.883 1319 HA GLU 75 HA GLU 75 4.626 12.954 4.204 1320 HB2 GLU 75 HB2 GLU 75 6.253 11.084 3.698 1321 HB3 GLU 75 HB3 GLU 75 6.929 12.117 2.445 1322 HG2 GLU 75 HG2 GLU 75 7.583 13.755 4.063 1323 HG3 GLU 75 HG3 GLU 75 6.755 12.876 5.347 1324 H GLU 76 H GLU 76 5.305 13.242 0.759 1325 HA GLU 76 HA GLU 76 6.382 15.818 0.711 1326 HB2 GLU 76 HB2 GLU 76 6.407 14.347 -1.242 1327 HB3 GLU 76 HB3 GLU 76 4.653 14.413 -1.343 1328 HG2 GLU 76 HG2 GLU 76 5.517 15.858 -3.011 1329 HG3 GLU 76 HG3 GLU 76 4.848 16.872 -1.734 1330 H TYR 77 H TYR 77 3.112 14.639 0.790 1331 HA TYR 77 HA TYR 77 1.625 16.888 0.257 1332 HB2 TYR 77 HB2 TYR 77 0.580 14.737 0.519 1333 HB3 TYR 77 HB3 TYR 77 1.121 14.614 2.187 1334 HD1 TYR 77 HD2 TYR 77 -0.587 17.395 0.381 1335 HD2 TYR 77 HD1 TYR 77 -0.775 14.521 3.505 1336 HE1 TYR 77 HE2 TYR 77 -2.718 18.353 1.117 1337 HE2 TYR 77 HE1 TYR 77 -2.915 15.465 4.255 1338 HH TYR 77 HH TYR 77 -4.788 17.448 2.425 1339 H GLN 78 H GLN 78 3.310 16.041 3.229 1340 HA GLN 78 HA GLN 78 2.191 18.370 4.583 1341 HB2 GLN 78 HB2 GLN 78 4.199 16.393 5.673 1342 HB3 GLN 78 HB3 GLN 78 3.216 17.525 6.588 1343 HG2 GLN 78 HG2 GLN 78 2.153 15.191 5.008 1344 HG3 GLN 78 HG3 GLN 78 2.421 15.202 6.749 1345 HE21 GLN 78 HE21 GLN 78 0.306 14.856 7.286 1346 HE22 GLN 78 HE22 GLN 78 -0.946 16.021 7.037 1347 H ARG 79 H ARG 79 5.227 17.138 3.334 1348 HA ARG 79 HA ARG 79 7.021 18.996 4.324 1349 HB2 ARG 79 HB2 ARG 79 7.765 17.013 3.185 1350 HB3 ARG 79 HB3 ARG 79 7.010 17.531 1.685 1351 HG2 ARG 79 HG2 ARG 79 8.584 19.545 1.808 1352 HG3 ARG 79 HG3 ARG 79 9.463 18.613 3.020 1353 HD2 ARG 79 HD2 ARG 79 9.947 16.889 1.478 1354 HD3 ARG 79 HD3 ARG 79 8.793 17.515 0.304 1355 HE ARG 79 HE ARG 79 11.455 18.576 0.885 1356 HH11 ARG 79 HH11 ARG 79 8.488 18.728 -0.995 1357 HH12 ARG 79 HH12 ARG 79 9.148 19.856 -2.148 1358 HH21 ARG 79 HH21 ARG 79 12.308 20.040 -0.642 1359 HH22 ARG 79 HH22 ARG 79 11.305 20.609 -1.940 1360 H LEU 80 H LEU 80 5.176 19.197 1.264 1361 HA LEU 80 HA LEU 80 6.340 21.731 0.598 1362 HB2 LEU 80 HB2 LEU 80 5.044 21.679 -1.337 1363 HB3 LEU 80 HB3 LEU 80 5.425 20.001 -1.008 1364 HG LEU 80 HG LEU 80 2.995 20.384 0.289 1365 HD11 LEU 80 HD11 LEU 80 2.819 22.562 -0.934 1366 HD12 LEU 80 HD12 LEU 80 1.509 21.430 -1.255 1367 HD13 LEU 80 HD13 LEU 80 2.796 21.647 -2.442 1368 HD21 LEU 80 HD21 LEU 80 3.662 18.391 -0.932 1369 HD22 LEU 80 HD22 LEU 80 3.525 19.261 -2.461 1370 HD23 LEU 80 HD23 LEU 80 2.090 18.965 -1.481 1371 H ARG 81 H ARG 81 3.753 20.816 2.639 1372 HA ARG 81 HA ARG 81 2.424 23.396 2.335 1373 HB2 ARG 81 HB2 ARG 81 1.668 20.990 3.997 1374 HB3 ARG 81 HB3 ARG 81 0.732 22.477 3.895 1375 HG2 ARG 81 HG2 ARG 81 0.649 22.082 1.391 1376 HG3 ARG 81 HG3 ARG 81 1.261 20.462 1.736 1377 HD2 ARG 81 HD2 ARG 81 -1.334 21.700 2.620 1378 HD3 ARG 81 HD3 ARG 81 -1.095 20.281 1.606 1379 HE ARG 81 HE ARG 81 -0.090 19.247 3.685 1380 HH11 ARG 81 HH11 ARG 81 -2.543 21.751 3.848 1381 HH12 ARG 81 HH12 ARG 81 -3.178 21.205 5.367 1382 HH21 ARG 81 HH21 ARG 81 -0.918 18.539 5.701 1383 HH22 ARG 81 HH22 ARG 81 -2.254 19.389 6.422 1384 H GLU 82 H GLU 82 4.340 21.615 4.696 1385 HA GLU 82 HA GLU 82 3.910 23.367 6.866 1386 HB2 GLU 82 HB2 GLU 82 5.877 22.358 7.882 1387 HB3 GLU 82 HB3 GLU 82 4.861 21.125 7.156 1388 HG2 GLU 82 HG2 GLU 82 6.359 20.953 5.265 1389 HG3 GLU 82 HG3 GLU 82 7.349 22.263 5.907 1390 H GLN 83 H GLN 83 5.922 23.591 4.071 1391 HA GLN 83 HA GLN 83 7.667 25.619 5.086 1392 HB2 GLN 83 HB2 GLN 83 8.355 24.165 3.244 1393 HB3 GLN 83 HB3 GLN 83 7.043 24.776 2.247 1394 HG2 GLN 83 HG2 GLN 83 8.163 27.081 2.624 1395 HG3 GLN 83 HG3 GLN 83 9.574 26.127 3.077 1396 HE21 GLN 83 HE21 GLN 83 10.684 26.978 1.277 1397 HE22 GLN 83 HE22 GLN 83 10.381 26.388 -0.319 1398 H LEU 84 H LEU 84 4.474 25.576 3.857 1399 HA LEU 84 HA LEU 84 4.485 28.320 2.934 1400 HB2 LEU 84 HB2 LEU 84 2.756 26.055 2.663 1401 HB3 LEU 84 HB3 LEU 84 1.829 27.396 3.305 1402 HG LEU 84 HG LEU 84 3.523 27.593 0.809 1403 HD11 LEU 84 HD11 LEU 84 1.407 27.484 -0.447 1404 HD12 LEU 84 HD12 LEU 84 0.558 27.073 1.042 1405 HD13 LEU 84 HD13 LEU 84 1.773 25.974 0.387 1406 HD21 LEU 84 HD21 LEU 84 2.430 29.655 0.408 1407 HD22 LEU 84 HD22 LEU 84 2.965 29.696 2.087 1408 HD23 LEU 84 HD23 LEU 84 1.272 29.380 1.709 1409 H LYS 85 H LYS 85 3.492 26.537 5.784 1410 HA LYS 85 HA LYS 85 2.402 28.971 6.979 1411 HB2 LYS 85 HB2 LYS 85 1.460 27.592 8.671 1412 HB3 LYS 85 HB3 LYS 85 1.180 26.770 7.142 1413 HG2 LYS 85 HG2 LYS 85 2.601 25.058 7.637 1414 HG3 LYS 85 HG3 LYS 85 3.631 26.057 8.659 1415 HD2 LYS 85 HD2 LYS 85 1.756 26.087 10.340 1416 HD3 LYS 85 HD3 LYS 85 0.943 24.880 9.343 1417 HE2 LYS 85 HE2 LYS 85 2.186 23.856 11.190 1418 HE3 LYS 85 HE3 LYS 85 2.815 23.359 9.620 1419 HZ1 LYS 85 HZ1 LYS 85 4.427 24.092 11.499 1420 HZ2 LYS 85 HZ2 LYS 85 4.034 25.663 10.995 1421 HZ3 LYS 85 HZ3 LYS 85 4.726 24.565 9.906 1422 H LYS 86 H LYS 86 2.973 29.233 9.393 1423 HA LYS 86 HA LYS 86 5.887 29.272 9.563 1424 HB2 LYS 86 HB2 LYS 86 3.741 30.641 11.191 1425 HB3 LYS 86 HB3 LYS 86 5.450 30.726 11.582 1426 HG2 LYS 86 HG2 LYS 86 5.875 31.769 9.392 1427 HG3 LYS 86 HG3 LYS 86 4.138 31.740 9.070 1428 HD2 LYS 86 HD2 LYS 86 3.755 33.137 11.047 1429 HD3 LYS 86 HD3 LYS 86 5.492 33.160 11.366 1430 HE2 LYS 86 HE2 LYS 86 4.172 34.219 8.868 1431 HE3 LYS 86 HE3 LYS 86 4.671 35.204 10.241 1432 HZ1 LYS 86 HZ1 LYS 86 6.343 35.293 8.555 1433 HZ2 LYS 86 HZ2 LYS 86 6.441 33.611 8.469 1434 HZ3 LYS 86 HZ3 LYS 86 6.963 34.417 9.859 Start of MODEL 17 1 H1 GLY 1 H1 GLY 1 37.827 -6.087 -9.852 2 H2 GLY 1 H2 GLY 1 37.630 -7.392 -10.903 3 H3 GLY 1 H3 GLY 1 36.324 -6.845 -9.982 4 HA2 GLY 1 HA3 GLY 1 37.682 -5.340 -12.140 5 HA3 GLY 1 HA2 GLY 1 36.108 -6.112 -12.260 6 H SER 2 H SER 2 37.108 -3.240 -12.394 7 HA SER 2 HA SER 2 36.033 -1.874 -10.156 8 HB2 SER 2 HB2 SER 2 36.300 -0.648 -12.887 9 HB3 SER 2 HB3 SER 2 36.576 0.091 -11.308 10 HG SER 2 HG SER 2 38.511 -0.476 -12.546 11 H HIS 3 H HIS 3 34.097 -0.823 -9.900 12 HA HIS 3 HA HIS 3 31.999 -1.368 -11.895 13 HB2 HIS 3 HB2 HIS 3 32.070 -2.011 -8.998 14 HB3 HIS 3 HB3 HIS 3 30.559 -1.353 -9.614 15 HD1 HIS 3 HD1 HIS 3 29.003 -3.216 -10.017 16 HD2 HIS 3 HD2 HIS 3 32.899 -4.209 -11.073 17 HE1 HIS 3 HE1 HIS 3 28.873 -5.539 -10.971 18 HE2 HIS 3 HE2 HIS 3 31.220 -6.068 -11.722 19 H MET 4 H MET 4 33.043 0.916 -12.288 20 HA MET 4 HA MET 4 31.583 2.888 -10.660 21 HB2 MET 4 HB2 MET 4 34.182 3.067 -12.161 22 HB3 MET 4 HB3 MET 4 33.274 4.515 -11.739 23 HG2 MET 4 HG2 MET 4 33.447 4.023 -9.406 24 HG3 MET 4 HG3 MET 4 34.161 2.447 -9.744 25 HE1 MET 4 HE1 MET 4 37.040 4.603 -8.085 26 HE2 MET 4 HE2 MET 4 35.986 3.204 -7.894 27 HE3 MET 4 HE3 MET 4 35.321 4.832 -7.775 28 H THR 5 H THR 5 29.764 2.137 -12.094 29 HA THR 5 HA THR 5 29.806 3.323 -14.757 30 HB THR 5 HB THR 5 27.270 2.356 -14.420 31 HG1 THR 5 HG1 THR 5 27.568 0.321 -13.340 32 HG21 THR 5 HG21 THR 5 28.745 1.887 -16.308 33 HG22 THR 5 HG22 THR 5 28.041 0.395 -15.684 34 HG23 THR 5 HG23 THR 5 29.710 0.812 -15.299 35 H GLU 6 H GLU 6 27.597 3.316 -11.980 36 HA GLU 6 HA GLU 6 27.407 6.101 -11.671 37 HB2 GLU 6 HB2 GLU 6 25.772 5.032 -13.787 38 HB3 GLU 6 HB3 GLU 6 24.731 5.569 -12.474 39 HG2 GLU 6 HG2 GLU 6 26.394 7.677 -12.647 40 HG3 GLU 6 HG3 GLU 6 26.421 7.121 -14.320 41 H GLN 7 H GLN 7 25.079 6.476 -10.431 42 HA GLN 7 HA GLN 7 24.860 4.194 -8.583 43 HB2 GLN 7 HB2 GLN 7 24.196 5.943 -6.847 44 HB3 GLN 7 HB3 GLN 7 25.888 5.886 -7.313 45 HG2 GLN 7 HG2 GLN 7 25.836 7.929 -8.279 46 HG3 GLN 7 HG3 GLN 7 24.162 7.759 -8.809 47 HE21 GLN 7 HE21 GLN 7 22.505 8.302 -7.410 48 HE22 GLN 7 HE22 GLN 7 22.770 9.233 -5.981 49 HA PRO 8 HA PRO 8 20.646 4.746 -10.198 50 HB2 PRO 8 HB2 PRO 8 20.167 2.197 -10.806 51 HB3 PRO 8 HB3 PRO 8 21.234 3.171 -11.819 52 HG2 PRO 8 HG2 PRO 8 21.923 1.121 -9.757 53 HG3 PRO 8 HG3 PRO 8 22.672 1.419 -11.337 54 HD2 PRO 8 HD2 PRO 8 23.633 2.346 -8.888 55 HD3 PRO 8 HD3 PRO 8 24.080 2.988 -10.480 56 H LYS 9 H LYS 9 18.640 3.198 -9.610 57 HA LYS 9 HA LYS 9 18.168 3.434 -6.873 58 HB2 LYS 9 HB2 LYS 9 16.828 1.635 -8.898 59 HB3 LYS 9 HB3 LYS 9 16.206 1.946 -7.286 60 HG2 LYS 9 HG2 LYS 9 16.037 4.347 -7.847 61 HG3 LYS 9 HG3 LYS 9 16.558 3.968 -9.489 62 HD2 LYS 9 HD2 LYS 9 14.170 2.639 -8.240 63 HD3 LYS 9 HD3 LYS 9 14.041 4.198 -9.050 64 HE2 LYS 9 HE2 LYS 9 14.895 3.224 -11.104 65 HE3 LYS 9 HE3 LYS 9 15.105 1.669 -10.303 66 HZ1 LYS 9 HZ1 LYS 9 12.708 1.582 -9.946 67 HZ2 LYS 9 HZ2 LYS 9 13.081 1.708 -11.593 68 HZ3 LYS 9 HZ3 LYS 9 12.522 3.060 -10.748 69 H THR 10 H THR 10 18.574 2.155 -5.148 70 HA THR 10 HA THR 10 19.961 -0.358 -5.711 71 HB THR 10 HB THR 10 21.063 1.547 -4.341 72 HG1 THR 10 HG1 THR 10 21.806 -0.676 -4.574 73 HG21 THR 10 HG21 THR 10 20.671 1.406 -1.922 74 HG22 THR 10 HG22 THR 10 19.354 0.266 -2.200 75 HG23 THR 10 HG23 THR 10 19.216 1.927 -2.775 76 H ARG 11 H ARG 11 19.702 -2.079 -4.057 77 HA ARG 11 HA ARG 11 16.890 -2.244 -3.216 78 HB2 ARG 11 HB2 ARG 11 17.298 -4.792 -3.471 79 HB3 ARG 11 HB3 ARG 11 17.011 -3.831 -4.913 80 HG2 ARG 11 HG2 ARG 11 19.407 -3.772 -5.363 81 HG3 ARG 11 HG3 ARG 11 19.708 -4.713 -3.900 82 HD2 ARG 11 HD2 ARG 11 18.506 -6.593 -4.808 83 HD3 ARG 11 HD3 ARG 11 18.023 -5.650 -6.219 84 HE ARG 11 HE ARG 11 20.858 -5.748 -5.944 85 HH11 ARG 11 HH11 ARG 11 18.099 -7.627 -7.012 86 HH12 ARG 11 HH12 ARG 11 19.016 -8.569 -8.140 87 HH21 ARG 11 HH21 ARG 11 22.068 -7.003 -7.424 88 HH22 ARG 11 HH22 ARG 11 21.268 -8.224 -8.367 89 H VAL 12 H VAL 12 16.532 -2.567 -1.122 90 HA VAL 12 HA VAL 12 18.805 -3.414 0.556 91 HB VAL 12 HB VAL 12 17.942 -1.040 0.858 92 HG11 VAL 12 HG11 VAL 12 15.582 -1.406 0.628 93 HG12 VAL 12 HG12 VAL 12 15.915 -0.782 2.243 94 HG13 VAL 12 HG13 VAL 12 15.576 -2.495 2.015 95 HG21 VAL 12 HG21 VAL 12 19.264 -2.297 2.555 96 HG22 VAL 12 HG22 VAL 12 17.744 -2.758 3.322 97 HG23 VAL 12 HG23 VAL 12 18.207 -1.060 3.228 98 H SER 13 H SER 13 18.289 -4.784 2.378 99 HA SER 13 HA SER 13 15.903 -6.422 1.881 100 HB2 SER 13 HB2 SER 13 18.232 -7.323 3.546 101 HB3 SER 13 HB3 SER 13 17.102 -8.290 2.593 102 HG SER 13 HG SER 13 18.340 -6.627 0.940 103 H VAL 14 H VAL 14 14.356 -6.572 3.381 104 HA VAL 14 HA VAL 14 14.929 -5.633 6.119 105 HB VAL 14 HB VAL 14 12.654 -4.724 6.268 106 HG11 VAL 14 HG11 VAL 14 14.450 -3.211 5.689 107 HG12 VAL 14 HG12 VAL 14 12.969 -2.743 4.851 108 HG13 VAL 14 HG13 VAL 14 14.248 -3.591 3.981 109 HG21 VAL 14 HG21 VAL 14 12.447 -5.309 3.317 110 HG22 VAL 14 HG22 VAL 14 11.256 -4.451 4.290 111 HG23 VAL 14 HG23 VAL 14 11.579 -6.159 4.595 112 H ARG 15 H ARG 15 12.963 -6.386 7.594 113 HA ARG 15 HA ARG 15 12.484 -9.219 6.937 114 HB2 ARG 15 HB2 ARG 15 13.998 -8.895 8.843 115 HB3 ARG 15 HB3 ARG 15 12.786 -7.913 9.649 116 HG2 ARG 15 HG2 ARG 15 11.972 -10.647 8.865 117 HG3 ARG 15 HG3 ARG 15 13.153 -10.504 10.171 118 HD2 ARG 15 HD2 ARG 15 10.410 -9.254 10.051 119 HD3 ARG 15 HD3 ARG 15 10.936 -10.563 11.109 120 HE ARG 15 HE ARG 15 12.620 -8.639 11.827 121 HH11 ARG 15 HH11 ARG 15 9.154 -8.514 11.311 122 HH12 ARG 15 HH12 ARG 15 8.903 -7.255 12.476 123 HH21 ARG 15 HH21 ARG 15 12.286 -6.980 13.345 124 HH22 ARG 15 HH22 ARG 15 10.682 -6.382 13.628 125 H ILE 16 H ILE 16 10.426 -9.818 6.678 126 HA ILE 16 HA ILE 16 8.310 -8.314 8.064 127 HB ILE 16 HB ILE 16 8.036 -9.327 5.232 128 HG12 ILE 16 HG12 ILE 16 8.246 -6.433 6.065 129 HG13 ILE 16 HG13 ILE 16 9.652 -7.363 5.564 130 HG21 ILE 16 HG21 ILE 16 5.945 -8.124 5.235 131 HG22 ILE 16 HG22 ILE 16 6.274 -7.487 6.845 132 HG23 ILE 16 HG23 ILE 16 5.987 -9.212 6.622 133 HD11 ILE 16 HD11 ILE 16 8.822 -6.057 3.724 134 HD12 ILE 16 HD12 ILE 16 7.222 -6.771 3.899 135 HD13 ILE 16 HD13 ILE 16 8.580 -7.772 3.392 136 H TYR 17 H TYR 17 7.274 -9.626 9.352 137 HA TYR 17 HA TYR 17 6.390 -11.458 10.322 138 HB2 TYR 17 HB2 TYR 17 5.322 -11.303 7.763 139 HB3 TYR 17 HB3 TYR 17 5.756 -13.002 7.956 140 HD1 TYR 17 HD1 TYR 17 5.171 -13.821 10.532 141 HD2 TYR 17 HD2 TYR 17 3.118 -10.851 8.285 142 HE1 TYR 17 HE1 TYR 17 3.166 -14.174 11.908 143 HE2 TYR 17 HE2 TYR 17 1.107 -11.199 9.658 144 HH TYR 17 HH TYR 17 0.107 -12.913 11.087 145 H GLY 18 H GLY 18 9.203 -11.570 9.893 146 HA2 GLY 18 HA2 GLY 18 10.693 -13.222 10.657 147 HA3 GLY 18 HA3 GLY 18 9.536 -14.456 10.189 148 H GLN 19 H GLN 19 9.425 -12.840 7.497 149 HA GLN 19 HA GLN 19 11.705 -14.300 6.352 150 HB2 GLN 19 HB2 GLN 19 8.967 -13.947 5.539 151 HB3 GLN 19 HB3 GLN 19 10.037 -13.346 4.281 152 HG2 GLN 19 HG2 GLN 19 10.094 -16.100 5.495 153 HG3 GLN 19 HG3 GLN 19 9.463 -15.670 3.907 154 HE21 GLN 19 HE21 GLN 19 11.552 -13.819 3.237 155 HE22 GLN 19 HE22 GLN 19 12.992 -14.741 2.963 156 H ASP 20 H ASP 20 13.097 -13.319 4.874 157 HA ASP 20 HA ASP 20 13.311 -10.438 5.197 158 HB2 ASP 20 HB2 ASP 20 15.540 -10.632 4.370 159 HB3 ASP 20 HB3 ASP 20 15.301 -11.984 5.472 160 H TYR 21 H TYR 21 13.244 -8.979 3.509 161 HA TYR 21 HA TYR 21 12.560 -10.029 0.860 162 HB2 TYR 21 HB2 TYR 21 10.906 -8.101 2.483 163 HB3 TYR 21 HB3 TYR 21 10.793 -8.167 0.729 164 HD1 TYR 21 HD1 TYR 21 9.939 -10.188 -0.388 165 HD2 TYR 21 HD2 TYR 21 9.933 -9.817 3.851 166 HE1 TYR 21 HE1 TYR 21 8.352 -12.056 -0.231 167 HE2 TYR 21 HE2 TYR 21 8.350 -11.688 4.021 168 HH TYR 21 HH TYR 21 7.766 -13.834 1.667 169 H THR 22 H THR 22 13.293 -8.843 -0.826 170 HA THR 22 HA THR 22 15.005 -6.556 -0.173 171 HB THR 22 HB THR 22 15.863 -6.958 -2.548 172 HG1 THR 22 HG1 THR 22 13.967 -8.341 -3.043 173 HG21 THR 22 HG21 THR 22 16.222 -9.041 -0.391 174 HG22 THR 22 HG22 THR 22 17.209 -7.605 -0.669 175 HG23 THR 22 HG23 THR 22 17.234 -8.933 -1.829 176 H ILE 23 H ILE 23 14.401 -4.550 -0.755 177 HA ILE 23 HA ILE 23 12.456 -4.262 -2.941 178 HB ILE 23 HB ILE 23 11.345 -2.410 -1.766 179 HG12 ILE 23 HG12 ILE 23 13.416 -2.134 -0.168 180 HG13 ILE 23 HG13 ILE 23 11.803 -1.714 0.387 181 HG21 ILE 23 HG21 ILE 23 10.255 -4.499 -1.753 182 HG22 ILE 23 HG22 ILE 23 10.091 -3.826 -0.133 183 HG23 ILE 23 HG23 ILE 23 11.265 -5.106 -0.445 184 HD11 ILE 23 HD11 ILE 23 13.047 -4.393 0.941 185 HD12 ILE 23 HD12 ILE 23 11.662 -3.640 1.732 186 HD13 ILE 23 HD13 ILE 23 13.280 -2.994 1.987 187 H VAL 24 H VAL 24 12.412 -2.108 -3.873 188 HA VAL 24 HA VAL 24 15.121 -1.082 -4.105 189 HB VAL 24 HB VAL 24 12.660 -0.340 -5.704 190 HG11 VAL 24 HG11 VAL 24 14.388 1.367 -5.775 191 HG12 VAL 24 HG12 VAL 24 14.285 0.532 -7.327 192 HG13 VAL 24 HG13 VAL 24 15.593 0.153 -6.208 193 HG21 VAL 24 HG21 VAL 24 13.499 -1.830 -7.423 194 HG22 VAL 24 HG22 VAL 24 13.250 -2.725 -5.925 195 HG23 VAL 24 HG23 VAL 24 14.881 -2.258 -6.413 196 H GLY 25 H GLY 25 15.691 0.471 -2.715 197 HA2 GLY 25 HA2 GLY 25 13.656 2.313 -1.695 198 HA3 GLY 25 HA3 GLY 25 15.270 2.083 -1.036 199 H ALA 26 H ALA 26 13.363 3.677 -3.482 200 HA ALA 26 HA ALA 26 15.713 5.146 -4.419 201 HB1 ALA 26 HB1 ALA 26 12.897 5.223 -5.486 202 HB2 ALA 26 HB2 ALA 26 14.162 4.140 -6.065 203 HB3 ALA 26 HB3 ALA 26 14.343 5.885 -6.250 204 H GLU 27 H GLU 27 13.611 5.499 -1.942 205 HA GLU 27 HA GLU 27 13.289 8.387 -2.303 206 HB2 GLU 27 HB2 GLU 27 11.494 6.586 -1.377 207 HB3 GLU 27 HB3 GLU 27 12.203 7.107 0.140 208 HG2 GLU 27 HG2 GLU 27 10.875 8.845 -1.921 209 HG3 GLU 27 HG3 GLU 27 10.262 8.427 -0.321 210 H SER 28 H SER 28 14.106 6.303 0.484 211 HA SER 28 HA SER 28 16.599 7.525 0.974 212 HB2 SER 28 HB2 SER 28 14.216 8.585 2.474 213 HB3 SER 28 HB3 SER 28 15.774 8.473 3.291 214 HG SER 28 HG SER 28 15.516 9.721 0.765 215 HA PRO 29 HA PRO 29 17.123 3.682 3.077 216 HB2 PRO 29 HB2 PRO 29 18.913 4.508 5.034 217 HB3 PRO 29 HB3 PRO 29 19.343 4.027 3.390 218 HG2 PRO 29 HG2 PRO 29 18.961 6.759 4.532 219 HG3 PRO 29 HG3 PRO 29 20.164 6.186 3.363 220 HD2 PRO 29 HD2 PRO 29 18.041 7.608 2.580 221 HD3 PRO 29 HD3 PRO 29 18.666 6.271 1.590 222 H ALA 30 H ALA 30 16.637 6.515 5.174 223 HA ALA 30 HA ALA 30 15.653 4.861 7.330 224 HB1 ALA 30 HB1 ALA 30 15.400 6.936 8.559 225 HB2 ALA 30 HB2 ALA 30 15.703 7.864 7.090 226 HB3 ALA 30 HB3 ALA 30 16.984 6.871 7.785 227 H HIS 31 H HIS 31 14.249 5.742 4.517 228 HA HIS 31 HA HIS 31 11.639 6.303 5.739 229 HB2 HIS 31 HB2 HIS 31 12.912 7.103 3.238 230 HB3 HIS 31 HB3 HIS 31 11.267 6.518 3.013 231 HD1 HIS 31 HD1 HIS 31 11.698 9.414 2.413 232 HD2 HIS 31 HD2 HIS 31 10.783 8.042 6.248 233 HE1 HIS 31 HE1 HIS 31 10.724 11.385 3.641 234 HE2 HIS 31 HE2 HIS 31 10.239 10.555 5.968 235 H ILE 32 H ILE 32 13.257 3.996 3.594 236 HA ILE 32 HA ILE 32 10.751 2.535 3.304 237 HB ILE 32 HB ILE 32 11.670 1.209 1.667 238 HG12 ILE 32 HG12 ILE 32 13.648 0.453 2.987 239 HG13 ILE 32 HG13 ILE 32 13.980 0.704 1.283 240 HG21 ILE 32 HG21 ILE 32 13.125 2.753 0.226 241 HG22 ILE 32 HG22 ILE 32 12.864 3.940 1.502 242 HG23 ILE 32 HG23 ILE 32 11.489 3.255 0.640 243 HD11 ILE 32 HD11 ILE 32 14.811 2.426 3.597 244 HD12 ILE 32 HD12 ILE 32 14.976 2.918 1.912 245 HD13 ILE 32 HD13 ILE 32 15.834 1.499 2.505 246 H ARG 33 H ARG 33 13.123 2.727 5.554 247 HA ARG 33 HA ARG 33 13.313 -0.050 6.260 248 HB2 ARG 33 HB2 ARG 33 14.708 2.280 6.959 249 HB3 ARG 33 HB3 ARG 33 13.916 1.763 8.442 250 HG2 ARG 33 HG2 ARG 33 14.965 -0.376 8.338 251 HG3 ARG 33 HG3 ARG 33 15.613 -0.036 6.731 252 HD2 ARG 33 HD2 ARG 33 17.335 0.229 8.430 253 HD3 ARG 33 HD3 ARG 33 16.969 1.777 7.671 254 HE ARG 33 HE ARG 33 15.362 1.631 9.909 255 HH11 ARG 33 HH11 ARG 33 18.805 1.559 9.268 256 HH12 ARG 33 HH12 ARG 33 19.230 2.307 10.773 257 HH21 ARG 33 HH21 ARG 33 15.917 2.616 11.883 258 HH22 ARG 33 HH22 ARG 33 17.586 2.913 12.263 259 H LEU 34 H LEU 34 11.375 2.712 7.222 260 HA LEU 34 HA LEU 34 10.122 1.378 9.426 261 HB2 LEU 34 HB2 LEU 34 8.692 3.326 9.566 262 HB3 LEU 34 HB3 LEU 34 10.357 3.825 9.350 263 HG LEU 34 HG LEU 34 9.491 3.814 6.773 264 HD11 LEU 34 HD11 LEU 34 7.184 3.299 7.512 265 HD12 LEU 34 HD12 LEU 34 7.320 4.834 6.655 266 HD13 LEU 34 HD13 LEU 34 7.171 4.816 8.412 267 HD21 LEU 34 HD21 LEU 34 10.753 5.583 7.866 268 HD22 LEU 34 HD22 LEU 34 9.309 6.081 8.753 269 HD23 LEU 34 HD23 LEU 34 9.370 6.245 6.999 270 H VAL 35 H VAL 35 9.723 1.366 6.062 271 HA VAL 35 HA VAL 35 6.977 0.922 5.745 272 HB VAL 35 HB VAL 35 9.301 -0.130 4.114 273 HG11 VAL 35 HG11 VAL 35 6.343 -0.196 3.595 274 HG12 VAL 35 HG12 VAL 35 7.482 -1.540 3.592 275 HG13 VAL 35 HG13 VAL 35 7.540 -0.332 2.308 276 HG21 VAL 35 HG21 VAL 35 7.437 2.121 3.448 277 HG22 VAL 35 HG22 VAL 35 8.970 1.710 2.685 278 HG23 VAL 35 HG23 VAL 35 8.944 2.368 4.323 279 H ALA 36 H ALA 36 9.650 -1.313 6.293 280 HA ALA 36 HA ALA 36 8.307 -3.730 6.101 281 HB1 ALA 36 HB1 ALA 36 10.766 -3.424 6.340 282 HB2 ALA 36 HB2 ALA 36 10.091 -4.695 7.359 283 HB3 ALA 36 HB3 ALA 36 10.514 -3.134 8.062 284 H ALA 37 H ALA 37 8.772 -1.699 8.976 285 HA ALA 37 HA ALA 37 7.409 -3.371 10.786 286 HB1 ALA 37 HB1 ALA 37 7.880 -0.393 10.881 287 HB2 ALA 37 HB2 ALA 37 8.927 -1.645 11.548 288 HB3 ALA 37 HB3 ALA 37 7.323 -1.376 12.233 289 H PHE 38 H PHE 38 6.316 -0.786 8.670 290 HA PHE 38 HA PHE 38 3.729 -0.447 9.715 291 HB2 PHE 38 HB2 PHE 38 4.991 1.018 8.029 292 HB3 PHE 38 HB3 PHE 38 4.460 -0.124 6.803 293 HD1 PHE 38 HD1 PHE 38 1.994 -0.420 6.401 294 HD2 PHE 38 HD2 PHE 38 3.564 2.704 8.831 295 HE1 PHE 38 HE1 PHE 38 -0.122 0.814 6.180 296 HE2 PHE 38 HE2 PHE 38 1.448 3.938 8.617 297 HZ PHE 38 HZ PHE 38 -0.399 2.995 7.290 298 H VAL 39 H VAL 39 4.919 -2.475 7.065 299 HA VAL 39 HA VAL 39 2.368 -3.621 6.490 300 HB VAL 39 HB VAL 39 5.125 -4.575 5.696 301 HG11 VAL 39 HG11 VAL 39 3.448 -6.337 5.485 302 HG12 VAL 39 HG12 VAL 39 3.982 -5.774 3.900 303 HG13 VAL 39 HG13 VAL 39 2.421 -5.257 4.541 304 HG21 VAL 39 HG21 VAL 39 5.174 -2.779 4.389 305 HG22 VAL 39 HG22 VAL 39 3.534 -2.332 4.859 306 HG23 VAL 39 HG23 VAL 39 3.791 -3.444 3.516 307 H ASP 40 H ASP 40 5.222 -4.717 8.287 308 HA ASP 40 HA ASP 40 4.473 -7.335 8.832 309 HB2 ASP 40 HB2 ASP 40 6.687 -6.283 9.368 310 HB3 ASP 40 HB3 ASP 40 5.922 -5.480 10.734 311 H ASP 41 H ASP 41 3.772 -4.393 10.673 312 HA ASP 41 HA ASP 41 2.316 -5.600 12.755 313 HB2 ASP 41 HB2 ASP 41 3.046 -3.405 13.174 314 HB3 ASP 41 HB3 ASP 41 2.444 -2.813 11.629 315 H LYS 42 H LYS 42 1.255 -4.151 9.691 316 HA LYS 42 HA LYS 42 -1.508 -4.417 10.153 317 HB2 LYS 42 HB2 LYS 42 -0.439 -2.963 8.419 318 HB3 LYS 42 HB3 LYS 42 -0.120 -4.408 7.471 319 HG2 LYS 42 HG2 LYS 42 -2.265 -4.617 6.812 320 HG3 LYS 42 HG3 LYS 42 -2.910 -4.016 8.339 321 HD2 LYS 42 HD2 LYS 42 -1.510 -2.205 6.395 322 HD3 LYS 42 HD3 LYS 42 -3.231 -2.562 6.250 323 HE2 LYS 42 HE2 LYS 42 -1.859 -1.331 8.640 324 HE3 LYS 42 HE3 LYS 42 -2.879 -0.488 7.475 325 HZ1 LYS 42 HZ1 LYS 42 -4.700 -2.030 8.164 326 HZ2 LYS 42 HZ2 LYS 42 -4.200 -0.953 9.364 327 HZ3 LYS 42 HZ3 LYS 42 -3.703 -2.570 9.426 328 H MET 43 H MET 43 0.796 -6.559 8.491 329 HA MET 43 HA MET 43 -1.106 -8.466 7.661 330 HB2 MET 43 HB2 MET 43 1.851 -8.660 8.179 331 HB3 MET 43 HB3 MET 43 0.904 -10.044 7.650 332 HG2 MET 43 HG2 MET 43 0.214 -8.743 5.657 333 HG3 MET 43 HG3 MET 43 1.301 -7.456 6.175 334 HE1 MET 43 HE1 MET 43 1.015 -11.170 4.995 335 HE2 MET 43 HE2 MET 43 1.933 -11.366 6.488 336 HE3 MET 43 HE3 MET 43 2.701 -11.680 4.934 337 H HIS 44 H HIS 44 0.847 -8.217 10.592 338 HA HIS 44 HA HIS 44 0.028 -10.700 11.688 339 HB2 HIS 44 HB2 HIS 44 2.070 -9.384 12.356 340 HB3 HIS 44 HB3 HIS 44 0.997 -8.296 13.232 341 HD1 HIS 44 HD1 HIS 44 1.013 -12.107 13.134 342 HD2 HIS 44 HD2 HIS 44 1.386 -8.949 15.820 343 HE1 HIS 44 HE1 HIS 44 1.099 -13.160 15.420 344 HE2 HIS 44 HE2 HIS 44 1.593 -11.245 16.979 345 H GLU 45 H GLU 45 -1.261 -7.425 11.972 346 HA GLU 45 HA GLU 45 -3.063 -8.064 14.075 347 HB2 GLU 45 HB2 GLU 45 -3.847 -5.891 13.911 348 HB3 GLU 45 HB3 GLU 45 -2.194 -5.757 13.344 349 HG2 GLU 45 HG2 GLU 45 -3.008 -5.797 11.015 350 HG3 GLU 45 HG3 GLU 45 -4.663 -5.869 11.615 351 H PHE 46 H PHE 46 -3.295 -8.274 10.585 352 HA PHE 46 HA PHE 46 -6.153 -8.791 10.754 353 HB2 PHE 46 HB2 PHE 46 -4.239 -8.368 8.494 354 HB3 PHE 46 HB3 PHE 46 -5.788 -9.148 8.187 355 HD1 PHE 46 HD1 PHE 46 -7.886 -7.920 9.025 356 HD2 PHE 46 HD2 PHE 46 -4.096 -6.057 8.529 357 HE1 PHE 46 HE1 PHE 46 -8.983 -5.721 8.968 358 HE2 PHE 46 HE2 PHE 46 -5.185 -3.848 8.468 359 HZ PHE 46 HZ PHE 46 -7.632 -3.677 8.689 360 H SER 47 H SER 47 -3.485 -10.590 11.280 361 HA SER 47 HA SER 47 -3.999 -12.953 9.819 362 HB2 SER 47 HB2 SER 47 -2.574 -12.585 12.466 363 HB3 SER 47 HB3 SER 47 -2.528 -14.047 11.485 364 HG SER 47 HG SER 47 -1.866 -11.722 10.140 365 H GLU 48 H GLU 48 -5.460 -11.570 12.612 366 HA GLU 48 HA GLU 48 -6.574 -13.982 13.673 367 HB2 GLU 48 HB2 GLU 48 -7.873 -12.516 15.122 368 HB3 GLU 48 HB3 GLU 48 -6.196 -11.989 15.072 369 HG2 GLU 48 HG2 GLU 48 -6.700 -10.115 13.780 370 HG3 GLU 48 HG3 GLU 48 -8.257 -10.769 13.276 371 H LYS 49 H LYS 49 -7.431 -11.825 11.131 372 HA LYS 49 HA LYS 49 -10.234 -12.290 11.115 373 HB2 LYS 49 HB2 LYS 49 -8.261 -11.173 9.163 374 HB3 LYS 49 HB3 LYS 49 -9.884 -11.568 8.614 375 HG2 LYS 49 HG2 LYS 49 -9.285 -9.731 10.922 376 HG3 LYS 49 HG3 LYS 49 -9.555 -9.191 9.263 377 HD2 LYS 49 HD2 LYS 49 -11.759 -10.583 9.476 378 HD3 LYS 49 HD3 LYS 49 -11.483 -10.399 11.210 379 HE2 LYS 49 HE2 LYS 49 -11.434 -7.968 10.944 380 HE3 LYS 49 HE3 LYS 49 -11.691 -8.148 9.208 381 HZ1 LYS 49 HZ1 LYS 49 -13.813 -9.301 9.782 382 HZ2 LYS 49 HZ2 LYS 49 -13.769 -7.662 10.197 383 HZ3 LYS 49 HZ3 LYS 49 -13.573 -8.841 11.391 384 H GLN 50 H GLN 50 -7.615 -13.542 9.066 385 HA GLN 50 HA GLN 50 -7.428 -15.391 7.757 386 HB2 GLN 50 HB2 GLN 50 -8.233 -16.184 10.321 387 HB3 GLN 50 HB3 GLN 50 -9.229 -17.123 9.220 388 HG2 GLN 50 HG2 GLN 50 -6.778 -17.854 10.050 389 HG3 GLN 50 HG3 GLN 50 -7.518 -18.388 8.549 390 HE21 GLN 50 HE21 GLN 50 -5.138 -16.344 10.006 391 HE22 GLN 50 HE22 GLN 50 -4.290 -15.941 8.552 392 HA PRO 51 HA PRO 51 -11.549 -14.497 5.782 393 HB2 PRO 51 HB2 PRO 51 -10.504 -13.882 3.329 394 HB3 PRO 51 HB3 PRO 51 -10.769 -12.698 4.613 395 HG2 PRO 51 HG2 PRO 51 -8.248 -14.072 3.787 396 HG3 PRO 51 HG3 PRO 51 -8.498 -12.395 4.295 397 HD2 PRO 51 HD2 PRO 51 -7.471 -14.291 5.939 398 HD3 PRO 51 HD3 PRO 51 -8.438 -12.926 6.532 399 H MET 52 H MET 52 -8.779 -16.137 4.224 400 HA MET 52 HA MET 52 -10.681 -18.192 3.304 401 HB2 MET 52 HB2 MET 52 -8.180 -17.206 1.917 402 HB3 MET 52 HB3 MET 52 -9.153 -18.565 1.376 403 HG2 MET 52 HG2 MET 52 -10.117 -15.722 1.610 404 HG3 MET 52 HG3 MET 52 -9.601 -16.504 0.119 405 HE1 MET 52 HE1 MET 52 -11.828 -15.764 -0.986 406 HE2 MET 52 HE2 MET 52 -12.509 -15.070 0.485 407 HE3 MET 52 HE3 MET 52 -13.437 -16.245 -0.447 408 H LEU 53 H LEU 53 -8.678 -17.786 5.652 409 HA LEU 53 HA LEU 53 -7.199 -18.997 6.885 410 HB2 LEU 53 HB2 LEU 53 -9.056 -21.013 5.709 411 HB3 LEU 53 HB3 LEU 53 -7.660 -21.586 6.600 412 HG LEU 53 HG LEU 53 -8.433 -20.214 8.553 413 HD11 LEU 53 HD11 LEU 53 -10.804 -19.527 8.562 414 HD12 LEU 53 HD12 LEU 53 -10.890 -19.884 6.836 415 HD13 LEU 53 HD13 LEU 53 -9.826 -18.602 7.423 416 HD21 LEU 53 HD21 LEU 53 -8.828 -22.580 8.516 417 HD22 LEU 53 HD22 LEU 53 -10.243 -22.371 7.488 418 HD23 LEU 53 HD23 LEU 53 -10.263 -21.775 9.147 419 H ASP 54 H ASP 54 -5.626 -18.107 5.228 420 HA ASP 54 HA ASP 54 -3.770 -20.138 4.538 421 HB2 ASP 54 HB2 ASP 54 -5.474 -20.384 2.708 422 HB3 ASP 54 HB3 ASP 54 -5.112 -18.738 2.216 423 H VAL 55 H VAL 55 -1.745 -19.260 4.087 424 HA VAL 55 HA VAL 55 -1.251 -16.693 5.088 425 HB VAL 55 HB VAL 55 0.599 -18.356 3.381 426 HG11 VAL 55 HG11 VAL 55 1.276 -15.994 3.601 427 HG12 VAL 55 HG12 VAL 55 2.390 -17.093 4.415 428 HG13 VAL 55 HG13 VAL 55 1.224 -16.163 5.357 429 HG21 VAL 55 HG21 VAL 55 0.360 -18.234 6.381 430 HG22 VAL 55 HG22 VAL 55 1.470 -19.238 5.449 431 HG23 VAL 55 HG23 VAL 55 -0.266 -19.537 5.370 432 HA PRO 56 HA PRO 56 -0.307 -15.212 0.504 433 HB2 PRO 56 HB2 PRO 56 -1.849 -16.585 -1.364 434 HB3 PRO 56 HB3 PRO 56 -0.116 -16.787 -1.115 435 HG2 PRO 56 HG2 PRO 56 -2.383 -18.436 -0.112 436 HG3 PRO 56 HG3 PRO 56 -0.771 -18.945 -0.650 437 HD2 PRO 56 HD2 PRO 56 -1.418 -18.840 1.951 438 HD3 PRO 56 HD3 PRO 56 0.208 -18.421 1.376 439 H LYS 57 H LYS 57 -3.428 -16.576 1.389 440 HA LYS 57 HA LYS 57 -4.981 -14.597 0.037 441 HB2 LYS 57 HB2 LYS 57 -5.902 -16.295 2.348 442 HB3 LYS 57 HB3 LYS 57 -6.877 -15.603 1.058 443 HG2 LYS 57 HG2 LYS 57 -4.758 -17.686 0.583 444 HG3 LYS 57 HG3 LYS 57 -6.450 -18.073 0.907 445 HD2 LYS 57 HD2 LYS 57 -7.167 -17.175 -1.107 446 HD3 LYS 57 HD3 LYS 57 -5.728 -16.170 -1.286 447 HE2 LYS 57 HE2 LYS 57 -5.868 -18.160 -2.827 448 HE3 LYS 57 HE3 LYS 57 -4.386 -18.022 -1.879 449 HZ1 LYS 57 HZ1 LYS 57 -6.665 -19.685 -0.975 450 HZ2 LYS 57 HZ2 LYS 57 -5.043 -19.759 -0.476 451 HZ3 LYS 57 HZ3 LYS 57 -5.483 -20.289 -2.023 452 H LEU 58 H LEU 58 -3.489 -14.846 3.160 453 HA LEU 58 HA LEU 58 -4.988 -12.677 4.316 454 HB2 LEU 58 HB2 LEU 58 -4.116 -14.518 5.696 455 HB3 LEU 58 HB3 LEU 58 -2.483 -14.104 5.236 456 HG LEU 58 HG LEU 58 -3.344 -13.432 7.573 457 HD11 LEU 58 HD11 LEU 58 -1.999 -11.365 7.555 458 HD12 LEU 58 HD12 LEU 58 -1.927 -11.460 5.795 459 HD13 LEU 58 HD13 LEU 58 -1.200 -12.731 6.779 460 HD21 LEU 58 HD21 LEU 58 -4.496 -11.373 7.791 461 HD22 LEU 58 HD22 LEU 58 -5.441 -12.385 6.700 462 HD23 LEU 58 HD23 LEU 58 -4.446 -11.080 6.053 463 H ALA 59 H ALA 59 -1.751 -13.194 3.007 464 HA ALA 59 HA ALA 59 -0.696 -10.654 3.512 465 HB1 ALA 59 HB1 ALA 59 -0.047 -12.671 1.373 466 HB2 ALA 59 HB2 ALA 59 0.749 -12.464 2.934 467 HB3 ALA 59 HB3 ALA 59 0.912 -11.225 1.687 468 H VAL 60 H VAL 60 -2.377 -11.897 0.634 469 HA VAL 60 HA VAL 60 -2.139 -9.505 -0.862 470 HB VAL 60 HB VAL 60 -2.650 -11.775 -1.814 471 HG11 VAL 60 HG11 VAL 60 -4.400 -12.405 -0.222 472 HG12 VAL 60 HG12 VAL 60 -4.948 -12.530 -1.895 473 HG13 VAL 60 HG13 VAL 60 -5.453 -11.166 -0.899 474 HG21 VAL 60 HG21 VAL 60 -2.849 -9.764 -3.162 475 HG22 VAL 60 HG22 VAL 60 -4.500 -9.523 -2.589 476 HG23 VAL 60 HG23 VAL 60 -4.106 -10.920 -3.591 477 H LEU 61 H LEU 61 -4.327 -10.531 1.617 478 HA LEU 61 HA LEU 61 -6.479 -8.782 1.084 479 HB2 LEU 61 HB2 LEU 61 -6.635 -10.705 2.603 480 HB3 LEU 61 HB3 LEU 61 -5.515 -9.930 3.709 481 HG LEU 61 HG LEU 61 -7.279 -8.028 3.789 482 HD11 LEU 61 HD11 LEU 61 -8.957 -10.328 2.801 483 HD12 LEU 61 HD12 LEU 61 -8.670 -8.801 1.968 484 HD13 LEU 61 HD13 LEU 61 -9.579 -8.822 3.479 485 HD21 LEU 61 HD21 LEU 61 -6.758 -9.333 5.716 486 HD22 LEU 61 HD22 LEU 61 -7.650 -10.719 5.088 487 HD23 LEU 61 HD23 LEU 61 -8.515 -9.260 5.572 488 H THR 62 H THR 62 -3.681 -8.499 3.269 489 HA THR 62 HA THR 62 -4.277 -5.853 4.064 490 HB THR 62 HB THR 62 -1.740 -5.902 4.694 491 HG1 THR 62 HG1 THR 62 -1.605 -7.939 3.260 492 HG21 THR 62 HG21 THR 62 -3.851 -6.303 6.148 493 HG22 THR 62 HG22 THR 62 -2.289 -6.831 6.750 494 HG23 THR 62 HG23 THR 62 -3.399 -8.005 6.045 495 H ALA 63 H ALA 63 -2.548 -7.191 1.355 496 HA ALA 63 HA ALA 63 -0.982 -4.992 0.625 497 HB1 ALA 63 HB1 ALA 63 -0.700 -7.205 -0.375 498 HB2 ALA 63 HB2 ALA 63 -0.921 -5.967 -1.612 499 HB3 ALA 63 HB3 ALA 63 -2.256 -7.038 -1.190 500 H VAL 64 H VAL 64 -4.267 -5.881 -0.436 501 HA VAL 64 HA VAL 64 -4.605 -3.541 -2.014 502 HB VAL 64 HB VAL 64 -5.886 -5.640 -2.393 503 HG11 VAL 64 HG11 VAL 64 -7.956 -5.974 -1.020 504 HG12 VAL 64 HG12 VAL 64 -7.273 -4.840 0.148 505 HG13 VAL 64 HG13 VAL 64 -6.441 -6.353 -0.205 506 HG21 VAL 64 HG21 VAL 64 -6.681 -3.663 -3.454 507 HG22 VAL 64 HG22 VAL 64 -7.468 -3.114 -1.977 508 HG23 VAL 64 HG23 VAL 64 -8.084 -4.533 -2.829 509 H GLN 65 H GLN 65 -5.145 -4.288 1.333 510 HA GLN 65 HA GLN 65 -6.833 -2.080 1.918 511 HB2 GLN 65 HB2 GLN 65 -5.183 -3.967 3.552 512 HB3 GLN 65 HB3 GLN 65 -5.884 -2.542 4.311 513 HG2 GLN 65 HG2 GLN 65 -8.077 -3.268 3.924 514 HG3 GLN 65 HG3 GLN 65 -7.565 -4.446 2.713 515 HE21 GLN 65 HE21 GLN 65 -8.764 -6.012 3.897 516 HE22 GLN 65 HE22 GLN 65 -8.103 -6.730 5.320 517 H ILE 66 H ILE 66 -3.343 -2.641 2.224 518 HA ILE 66 HA ILE 66 -2.608 -0.228 3.394 519 HB ILE 66 HB ILE 66 -1.117 -2.020 1.477 520 HG12 ILE 66 HG12 ILE 66 -0.672 -1.525 4.421 521 HG13 ILE 66 HG13 ILE 66 -1.736 -2.788 3.816 522 HG21 ILE 66 HG21 ILE 66 -0.338 0.382 1.384 523 HG22 ILE 66 HG22 ILE 66 0.879 -0.809 1.835 524 HG23 ILE 66 HG23 ILE 66 0.135 0.200 3.075 525 HD11 ILE 66 HD11 ILE 66 0.396 -3.725 4.384 526 HD12 ILE 66 HD12 ILE 66 1.230 -2.556 3.362 527 HD13 ILE 66 HD13 ILE 66 0.189 -3.780 2.633 528 H ALA 67 H ALA 67 -2.999 -1.028 -0.044 529 HA ALA 67 HA ALA 67 -2.173 1.438 -1.091 530 HB1 ALA 67 HB1 ALA 67 -4.216 -0.468 -2.229 531 HB2 ALA 67 HB2 ALA 67 -2.473 -0.581 -2.455 532 HB3 ALA 67 HB3 ALA 67 -3.360 0.790 -3.118 533 H SER 68 H SER 68 -5.408 0.269 -0.211 534 HA SER 68 HA SER 68 -6.815 2.594 -0.917 535 HB2 SER 68 HB2 SER 68 -7.549 0.597 1.236 536 HB3 SER 68 HB3 SER 68 -8.648 1.666 0.363 537 HG SER 68 HG SER 68 -7.255 -0.605 -0.584 538 H GLU 69 H GLU 69 -5.204 1.620 2.056 539 HA GLU 69 HA GLU 69 -6.146 3.600 3.783 540 HB2 GLU 69 HB2 GLU 69 -3.615 1.991 3.664 541 HB3 GLU 69 HB3 GLU 69 -3.842 3.215 4.907 542 HG2 GLU 69 HG2 GLU 69 -5.984 1.197 4.520 543 HG3 GLU 69 HG3 GLU 69 -4.482 0.692 5.303 544 H TYR 70 H TYR 70 -3.506 3.649 1.453 545 HA TYR 70 HA TYR 70 -2.683 6.311 2.256 546 HB2 TYR 70 HB2 TYR 70 -1.730 4.354 0.186 547 HB3 TYR 70 HB3 TYR 70 -1.155 6.015 0.196 548 HD1 TYR 70 HD2 TYR 70 -0.309 6.833 2.599 549 HD2 TYR 70 HD1 TYR 70 -0.472 2.782 1.310 550 HE1 TYR 70 HE2 TYR 70 1.402 6.242 4.265 551 HE2 TYR 70 HE1 TYR 70 1.239 2.176 2.968 552 HH TYR 70 HH TYR 70 2.173 4.241 5.489 553 H LEU 71 H LEU 71 -4.564 4.817 -0.292 554 HA LEU 71 HA LEU 71 -4.637 6.947 -2.110 555 HB2 LEU 71 HB2 LEU 71 -6.489 4.674 -1.507 556 HB3 LEU 71 HB3 LEU 71 -6.968 5.907 -2.658 557 HG LEU 71 HG LEU 71 -4.325 4.518 -2.997 558 HD11 LEU 71 HD11 LEU 71 -5.735 2.632 -2.818 559 HD12 LEU 71 HD12 LEU 71 -5.533 2.931 -4.544 560 HD13 LEU 71 HD13 LEU 71 -7.022 3.415 -3.738 561 HD21 LEU 71 HD21 LEU 71 -6.271 5.521 -5.063 562 HD22 LEU 71 HD22 LEU 71 -4.579 5.083 -5.282 563 HD23 LEU 71 HD23 LEU 71 -5.003 6.523 -4.358 564 H LYS 72 H LYS 72 -6.495 6.336 0.811 565 HA LYS 72 HA LYS 72 -8.361 8.458 0.360 566 HB2 LYS 72 HB2 LYS 72 -9.231 7.964 2.507 567 HB3 LYS 72 HB3 LYS 72 -8.745 6.421 1.820 568 HG2 LYS 72 HG2 LYS 72 -6.649 6.549 3.136 569 HG3 LYS 72 HG3 LYS 72 -7.254 8.028 3.886 570 HD2 LYS 72 HD2 LYS 72 -9.309 6.599 4.520 571 HD3 LYS 72 HD3 LYS 72 -8.272 5.217 4.153 572 HE2 LYS 72 HE2 LYS 72 -7.534 7.405 6.089 573 HE3 LYS 72 HE3 LYS 72 -8.327 5.907 6.565 574 HZ1 LYS 72 HZ1 LYS 72 -5.795 5.844 5.047 575 HZ2 LYS 72 HZ2 LYS 72 -6.465 4.656 6.059 576 HZ3 LYS 72 HZ3 LYS 72 -5.791 6.059 6.725 577 H LEU 73 H LEU 73 -5.133 8.363 1.368 578 HA LEU 73 HA LEU 73 -5.271 10.756 2.993 579 HB2 LEU 73 HB2 LEU 73 -3.699 8.948 3.554 580 HB3 LEU 73 HB3 LEU 73 -2.884 9.187 2.022 581 HG LEU 73 HG LEU 73 -2.340 11.525 2.777 582 HD11 LEU 73 HD11 LEU 73 -2.382 11.876 5.249 583 HD12 LEU 73 HD12 LEU 73 -3.431 10.463 5.372 584 HD13 LEU 73 HD13 LEU 73 -3.967 11.885 4.477 585 HD21 LEU 73 HD21 LEU 73 -1.282 9.235 4.425 586 HD22 LEU 73 HD22 LEU 73 -0.506 10.805 4.226 587 HD23 LEU 73 HD23 LEU 73 -0.699 9.735 2.837 588 H LYS 74 H LYS 74 -4.126 9.806 -0.211 589 HA LYS 74 HA LYS 74 -3.141 12.425 -0.821 590 HB2 LYS 74 HB2 LYS 74 -2.716 11.601 -3.030 591 HB3 LYS 74 HB3 LYS 74 -2.279 10.337 -1.892 592 HG2 LYS 74 HG2 LYS 74 -4.332 9.148 -2.370 593 HG3 LYS 74 HG3 LYS 74 -4.860 10.445 -3.442 594 HD2 LYS 74 HD2 LYS 74 -2.252 9.058 -3.929 595 HD3 LYS 74 HD3 LYS 74 -3.758 8.306 -4.444 596 HE2 LYS 74 HE2 LYS 74 -3.069 11.134 -5.185 597 HE3 LYS 74 HE3 LYS 74 -2.517 9.761 -6.147 598 HZ1 LYS 74 HZ1 LYS 74 -5.360 10.337 -5.504 599 HZ2 LYS 74 HZ2 LYS 74 -4.785 9.112 -6.518 600 HZ3 LYS 74 HZ3 LYS 74 -4.604 10.729 -6.961 601 H GLU 75 H GLU 75 -6.188 11.020 -0.696 602 HA GLU 75 HA GLU 75 -7.481 12.473 -2.762 603 HB2 GLU 75 HB2 GLU 75 -8.300 10.364 -1.547 604 HB3 GLU 75 HB3 GLU 75 -8.829 11.450 -0.271 605 HG2 GLU 75 HG2 GLU 75 -10.575 10.785 -1.950 606 HG3 GLU 75 HG3 GLU 75 -10.382 12.518 -1.684 607 H GLU 76 H GLU 76 -7.037 13.018 0.720 608 HA GLU 76 HA GLU 76 -8.552 15.439 0.713 609 HB2 GLU 76 HB2 GLU 76 -7.770 15.768 2.974 610 HB3 GLU 76 HB3 GLU 76 -8.259 14.096 2.758 611 HG2 GLU 76 HG2 GLU 76 -5.915 13.431 2.574 612 HG3 GLU 76 HG3 GLU 76 -5.420 15.114 2.762 613 H TYR 77 H TYR 77 -5.347 14.598 -0.123 614 HA TYR 77 HA TYR 77 -3.978 16.993 0.311 615 HB2 TYR 77 HB2 TYR 77 -2.670 15.110 -0.274 616 HB3 TYR 77 HB3 TYR 77 -3.635 14.776 -1.705 617 HD1 TYR 77 HD2 TYR 77 -2.183 18.066 -0.722 618 HD2 TYR 77 HD1 TYR 77 -1.982 14.738 -3.371 619 HE1 TYR 77 HE2 TYR 77 -0.549 19.276 -2.107 620 HE2 TYR 77 HE1 TYR 77 -0.346 15.941 -4.764 621 HH TYR 77 HH TYR 77 0.391 18.171 -5.229 622 H GLN 78 H GLN 78 -5.650 15.871 -2.635 623 HA GLN 78 HA GLN 78 -5.312 18.384 -3.945 624 HB2 GLN 78 HB2 GLN 78 -6.550 17.467 -5.748 625 HB3 GLN 78 HB3 GLN 78 -5.605 16.142 -5.087 626 HG2 GLN 78 HG2 GLN 78 -7.495 15.166 -4.072 627 HG3 GLN 78 HG3 GLN 78 -8.473 16.611 -4.330 628 HE21 GLN 78 HE21 GLN 78 -9.131 13.944 -5.133 629 HE22 GLN 78 HE22 GLN 78 -9.244 13.961 -6.864 630 H ARG 79 H ARG 79 -7.632 17.086 -1.747 631 HA ARG 79 HA ARG 79 -9.804 18.784 -2.423 632 HB2 ARG 79 HB2 ARG 79 -9.964 16.639 -1.119 633 HB3 ARG 79 HB3 ARG 79 -9.285 17.499 0.257 634 HG2 ARG 79 HG2 ARG 79 -11.179 18.764 0.581 635 HG3 ARG 79 HG3 ARG 79 -11.705 18.598 -1.095 636 HD2 ARG 79 HD2 ARG 79 -13.137 17.319 0.389 637 HD3 ARG 79 HD3 ARG 79 -12.248 16.249 -0.693 638 HE ARG 79 HE ARG 79 -11.424 16.720 2.105 639 HH11 ARG 79 HH11 ARG 79 -12.071 14.551 -0.573 640 HH12 ARG 79 HH12 ARG 79 -11.606 13.128 0.296 641 HH21 ARG 79 HH21 ARG 79 -10.801 14.858 3.247 642 HH22 ARG 79 HH22 ARG 79 -10.852 13.308 2.468 643 H LEU 80 H LEU 80 -7.190 19.037 -0.017 644 HA LEU 80 HA LEU 80 -8.208 21.498 1.042 645 HB2 LEU 80 HB2 LEU 80 -6.247 21.612 2.372 646 HB3 LEU 80 HB3 LEU 80 -6.736 19.932 2.320 647 HG LEU 80 HG LEU 80 -4.939 20.009 0.262 648 HD11 LEU 80 HD11 LEU 80 -2.985 21.244 0.973 649 HD12 LEU 80 HD12 LEU 80 -3.843 21.846 2.391 650 HD13 LEU 80 HD13 LEU 80 -4.345 22.348 0.776 651 HD21 LEU 80 HD21 LEU 80 -4.998 18.325 2.004 652 HD22 LEU 80 HD22 LEU 80 -4.385 19.488 3.183 653 HD23 LEU 80 HD23 LEU 80 -3.366 18.970 1.842 654 H ARG 81 H ARG 81 -6.178 20.599 -1.597 655 HA ARG 81 HA ARG 81 -4.939 23.147 -1.950 656 HB2 ARG 81 HB2 ARG 81 -5.172 20.684 -3.657 657 HB3 ARG 81 HB3 ARG 81 -4.444 22.159 -4.275 658 HG2 ARG 81 HG2 ARG 81 -3.307 21.579 -1.731 659 HG3 ARG 81 HG3 ARG 81 -3.237 20.129 -2.729 660 HD2 ARG 81 HD2 ARG 81 -2.185 22.870 -3.422 661 HD3 ARG 81 HD3 ARG 81 -1.231 21.429 -3.061 662 HE ARG 81 HE ARG 81 -2.888 20.801 -5.200 663 HH11 ARG 81 HH11 ARG 81 -0.255 23.013 -4.529 664 HH12 ARG 81 HH12 ARG 81 0.315 23.026 -6.165 665 HH21 ARG 81 HH21 ARG 81 -2.134 20.822 -7.353 666 HH22 ARG 81 HH22 ARG 81 -0.739 21.770 -7.762 667 H GLU 82 H GLU 82 -7.710 21.481 -3.449 668 HA GLU 82 HA GLU 82 -8.252 23.602 -5.259 669 HB2 GLU 82 HB2 GLU 82 -10.313 22.476 -5.773 670 HB3 GLU 82 HB3 GLU 82 -9.032 21.283 -5.623 671 HG2 GLU 82 HG2 GLU 82 -9.826 20.783 -3.333 672 HG3 GLU 82 HG3 GLU 82 -11.163 21.902 -3.595 673 H GLN 83 H GLN 83 -8.960 23.106 -1.939 674 HA GLN 83 HA GLN 83 -11.181 24.855 -1.720 675 HB2 GLN 83 HB2 GLN 83 -9.260 23.605 0.179 676 HB3 GLN 83 HB3 GLN 83 -10.157 25.010 0.741 677 HG2 GLN 83 HG2 GLN 83 -12.240 23.923 0.391 678 HG3 GLN 83 HG3 GLN 83 -11.466 22.589 -0.464 679 HE21 GLN 83 HE21 GLN 83 -10.374 21.027 0.688 680 HE22 GLN 83 HE22 GLN 83 -10.581 20.823 2.395 681 H LEU 84 H LEU 84 -7.780 25.344 -2.021 682 HA LEU 84 HA LEU 84 -7.906 28.105 -1.104 683 HB2 LEU 84 HB2 LEU 84 -5.855 26.179 -1.344 684 HB3 LEU 84 HB3 LEU 84 -5.471 27.433 -2.501 685 HG LEU 84 HG LEU 84 -4.355 27.790 -0.343 686 HD11 LEU 84 HD11 LEU 84 -6.420 29.824 -1.141 687 HD12 LEU 84 HD12 LEU 84 -4.720 29.748 -1.616 688 HD13 LEU 84 HD13 LEU 84 -5.155 30.133 0.047 689 HD21 LEU 84 HD21 LEU 84 -6.985 28.444 0.918 690 HD22 LEU 84 HD22 LEU 84 -5.434 28.081 1.672 691 HD23 LEU 84 HD23 LEU 84 -6.379 26.787 0.937 692 H LYS 85 H LYS 85 -8.659 26.421 -3.828 693 HA LYS 85 HA LYS 85 -7.971 28.596 -5.665 694 HB2 LYS 85 HB2 LYS 85 -8.868 25.748 -6.108 695 HB3 LYS 85 HB3 LYS 85 -8.788 26.927 -7.410 696 HG2 LYS 85 HG2 LYS 85 -6.424 27.159 -7.150 697 HG3 LYS 85 HG3 LYS 85 -6.439 26.182 -5.681 698 HD2 LYS 85 HD2 LYS 85 -6.942 24.206 -6.894 699 HD3 LYS 85 HD3 LYS 85 -7.342 25.115 -8.350 700 HE2 LYS 85 HE2 LYS 85 -4.618 25.487 -7.282 701 HE3 LYS 85 HE3 LYS 85 -4.977 23.899 -7.953 702 HZ1 LYS 85 HZ1 LYS 85 -5.439 26.451 -9.395 703 HZ2 LYS 85 HZ2 LYS 85 -5.576 24.888 -10.023 704 HZ3 LYS 85 HZ3 LYS 85 -4.060 25.492 -9.581 705 H LYS 86 H LYS 86 -10.717 26.616 -4.590 706 HA LYS 86 HA LYS 86 -12.485 28.863 -5.197 707 HB2 LYS 86 HB2 LYS 86 -12.515 27.262 -7.130 708 HB3 LYS 86 HB3 LYS 86 -13.126 26.032 -6.030 709 HG2 LYS 86 HG2 LYS 86 -15.138 27.224 -5.674 710 HG3 LYS 86 HG3 LYS 86 -14.508 28.655 -6.488 711 HD2 LYS 86 HD2 LYS 86 -14.371 27.317 -8.586 712 HD3 LYS 86 HD3 LYS 86 -15.175 25.996 -7.735 713 HE2 LYS 86 HE2 LYS 86 -16.361 28.751 -7.889 714 HE3 LYS 86 HE3 LYS 86 -16.640 27.546 -9.138 715 HZ1 LYS 86 HZ1 LYS 86 -17.327 27.273 -6.268 716 HZ2 LYS 86 HZ2 LYS 86 -17.551 26.072 -7.435 717 HZ3 LYS 86 HZ3 LYS 86 -18.417 27.519 -7.535 718 H1 GLY 1 H1 GLY 1 -37.015 -9.584 10.136 719 H2 GLY 1 H2 GLY 1 -36.883 -10.387 11.616 720 H3 GLY 1 H3 GLY 1 -35.491 -9.897 10.792 721 HA2 GLY 1 HA3 GLY 1 -37.533 -8.075 11.914 722 HA3 GLY 1 HA2 GLY 1 -35.993 -8.449 12.673 723 H SER 2 H SER 2 -37.143 -5.893 11.615 724 HA SER 2 HA SER 2 -35.507 -5.240 9.339 725 HB2 SER 2 HB2 SER 2 -36.665 -2.998 10.815 726 HB3 SER 2 HB3 SER 2 -36.890 -3.470 9.129 727 HG SER 2 HG SER 2 -38.778 -3.609 10.606 728 H HIS 3 H HIS 3 -33.694 -3.965 9.304 729 HA HIS 3 HA HIS 3 -32.500 -3.323 11.923 730 HB2 HIS 3 HB2 HIS 3 -31.245 -4.490 9.446 731 HB3 HIS 3 HB3 HIS 3 -30.274 -3.607 10.617 732 HD1 HIS 3 HD1 HIS 3 -29.091 -5.192 12.090 733 HD2 HIS 3 HD2 HIS 3 -32.876 -6.574 11.081 734 HE1 HIS 3 HE1 HIS 3 -29.341 -7.389 13.274 735 HE2 HIS 3 HE2 HIS 3 -31.710 -8.112 12.794 736 H MET 4 H MET 4 -32.833 -1.182 12.103 737 HA MET 4 HA MET 4 -32.138 0.537 9.807 738 HB2 MET 4 HB2 MET 4 -34.009 0.994 12.128 739 HB3 MET 4 HB3 MET 4 -33.511 2.274 11.034 740 HG2 MET 4 HG2 MET 4 -34.466 0.947 9.158 741 HG3 MET 4 HG3 MET 4 -35.090 -0.192 10.351 742 HE1 MET 4 HE1 MET 4 -38.360 1.630 9.285 743 HE2 MET 4 HE2 MET 4 -37.606 0.070 9.615 744 HE3 MET 4 HE3 MET 4 -37.017 1.073 8.290 745 H THR 5 H THR 5 -30.236 -0.574 11.700 746 HA THR 5 HA THR 5 -29.476 1.368 13.611 747 HB THR 5 HB THR 5 -27.428 -0.444 12.424 748 HG1 THR 5 HG1 THR 5 -29.624 -1.371 14.006 749 HG21 THR 5 HG21 THR 5 -28.269 0.204 15.255 750 HG22 THR 5 HG22 THR 5 -26.892 0.889 14.396 751 HG23 THR 5 HG23 THR 5 -26.912 -0.827 14.804 752 H GLU 6 H GLU 6 -27.301 2.474 13.523 753 HA GLU 6 HA GLU 6 -27.175 4.321 11.435 754 HB2 GLU 6 HB2 GLU 6 -24.861 3.513 13.198 755 HB3 GLU 6 HB3 GLU 6 -25.103 5.060 12.402 756 HG2 GLU 6 HG2 GLU 6 -26.502 5.812 13.994 757 HG3 GLU 6 HG3 GLU 6 -27.233 4.230 14.247 758 H GLN 7 H GLN 7 -25.796 4.538 9.660 759 HA GLN 7 HA GLN 7 -24.921 2.035 8.520 760 HB2 GLN 7 HB2 GLN 7 -24.346 3.488 6.529 761 HB3 GLN 7 HB3 GLN 7 -26.040 3.455 6.990 762 HG2 GLN 7 HG2 GLN 7 -25.780 5.619 8.104 763 HG3 GLN 7 HG3 GLN 7 -24.074 5.642 7.650 764 HE21 GLN 7 HE21 GLN 7 -24.278 7.520 6.449 765 HE22 GLN 7 HE22 GLN 7 -25.097 7.560 4.927 766 HA PRO 8 HA PRO 8 -20.748 2.952 9.909 767 HB2 PRO 8 HB2 PRO 8 -19.962 0.433 10.216 768 HB3 PRO 8 HB3 PRO 8 -21.158 1.129 11.316 769 HG2 PRO 8 HG2 PRO 8 -21.540 -0.765 9.050 770 HG3 PRO 8 HG3 PRO 8 -22.394 -0.676 10.600 771 HD2 PRO 8 HD2 PRO 8 -23.268 0.383 8.133 772 HD3 PRO 8 HD3 PRO 8 -23.968 0.697 9.732 773 H LYS 9 H LYS 9 -18.566 1.799 9.169 774 HA LYS 9 HA LYS 9 -18.275 2.299 6.398 775 HB2 LYS 9 HB2 LYS 9 -16.448 1.038 8.449 776 HB3 LYS 9 HB3 LYS 9 -15.970 1.269 6.774 777 HG2 LYS 9 HG2 LYS 9 -16.077 3.614 6.954 778 HG3 LYS 9 HG3 LYS 9 -16.930 3.531 8.493 779 HD2 LYS 9 HD2 LYS 9 -14.172 2.399 8.169 780 HD3 LYS 9 HD3 LYS 9 -14.424 4.109 8.515 781 HE2 LYS 9 HE2 LYS 9 -15.862 3.319 10.476 782 HE3 LYS 9 HE3 LYS 9 -15.155 1.730 10.201 783 HZ1 LYS 9 HZ1 LYS 9 -12.953 2.723 10.516 784 HZ2 LYS 9 HZ2 LYS 9 -13.932 2.913 11.880 785 HZ3 LYS 9 HZ3 LYS 9 -13.670 4.221 10.844 786 H THR 10 H THR 10 -19.048 1.021 4.854 787 HA THR 10 HA THR 10 -19.690 -1.729 5.364 788 HB THR 10 HB THR 10 -21.121 -0.201 3.986 789 HG1 THR 10 HG1 THR 10 -21.646 -1.863 2.511 790 HG21 THR 10 HG21 THR 10 -20.557 0.118 1.632 791 HG22 THR 10 HG22 THR 10 -18.993 -0.655 1.888 792 HG23 THR 10 HG23 THR 10 -19.358 0.882 2.672 793 H ARG 11 H ARG 11 -19.158 -3.384 3.666 794 HA ARG 11 HA ARG 11 -16.349 -3.144 2.838 795 HB2 ARG 11 HB2 ARG 11 -16.039 -5.528 3.368 796 HB3 ARG 11 HB3 ARG 11 -16.470 -4.594 4.795 797 HG2 ARG 11 HG2 ARG 11 -18.806 -5.367 4.542 798 HG3 ARG 11 HG3 ARG 11 -18.288 -6.383 3.194 799 HD2 ARG 11 HD2 ARG 11 -16.742 -7.560 4.696 800 HD3 ARG 11 HD3 ARG 11 -17.293 -6.561 6.040 801 HE ARG 11 HE ARG 11 -18.959 -8.522 4.594 802 HH11 ARG 11 HH11 ARG 11 -18.174 -6.713 7.497 803 HH12 ARG 11 HH12 ARG 11 -19.428 -7.450 8.439 804 HH21 ARG 11 HH21 ARG 11 -20.622 -9.476 5.839 805 HH22 ARG 11 HH22 ARG 11 -20.821 -9.006 7.498 806 H VAL 12 H VAL 12 -15.785 -4.135 0.892 807 HA VAL 12 HA VAL 12 -18.014 -5.229 -0.684 808 HB VAL 12 HB VAL 12 -17.592 -2.796 -1.219 809 HG11 VAL 12 HG11 VAL 12 -15.645 -2.297 -2.661 810 HG12 VAL 12 HG12 VAL 12 -15.000 -3.892 -2.279 811 HG13 VAL 12 HG13 VAL 12 -15.207 -2.699 -1.000 812 HG21 VAL 12 HG21 VAL 12 -18.713 -4.312 -2.782 813 HG22 VAL 12 HG22 VAL 12 -17.149 -4.745 -3.476 814 HG23 VAL 12 HG23 VAL 12 -17.756 -3.094 -3.626 815 H SER 13 H SER 13 -17.421 -6.738 -2.285 816 HA SER 13 HA SER 13 -14.795 -7.942 -1.842 817 HB2 SER 13 HB2 SER 13 -17.239 -9.045 -3.250 818 HB3 SER 13 HB3 SER 13 -15.748 -9.933 -2.941 819 HG SER 13 HG SER 13 -17.188 -10.447 -1.335 820 H VAL 14 H VAL 14 -13.227 -7.804 -3.328 821 HA VAL 14 HA VAL 14 -13.986 -7.061 -6.080 822 HB VAL 14 HB VAL 14 -11.961 -5.746 -6.310 823 HG11 VAL 14 HG11 VAL 14 -13.935 -4.563 -5.605 824 HG12 VAL 14 HG12 VAL 14 -12.525 -3.874 -4.799 825 HG13 VAL 14 HG13 VAL 14 -13.608 -4.953 -3.916 826 HG21 VAL 14 HG21 VAL 14 -11.470 -6.294 -3.383 827 HG22 VAL 14 HG22 VAL 14 -10.511 -5.240 -4.421 828 HG23 VAL 14 HG23 VAL 14 -10.548 -6.977 -4.724 829 H ARG 15 H ARG 15 -12.301 -7.661 -7.696 830 HA ARG 15 HA ARG 15 -11.317 -10.337 -7.079 831 HB2 ARG 15 HB2 ARG 15 -12.705 -10.149 -9.060 832 HB3 ARG 15 HB3 ARG 15 -11.670 -8.886 -9.708 833 HG2 ARG 15 HG2 ARG 15 -10.386 -11.481 -9.100 834 HG3 ARG 15 HG3 ARG 15 -11.501 -11.439 -10.463 835 HD2 ARG 15 HD2 ARG 15 -9.193 -9.531 -10.100 836 HD3 ARG 15 HD3 ARG 15 -9.116 -10.999 -11.070 837 HE ARG 15 HE ARG 15 -11.299 -9.500 -11.949 838 HH11 ARG 15 HH11 ARG 15 -7.794 -9.201 -11.847 839 HH12 ARG 15 HH12 ARG 15 -7.723 -8.298 -13.331 840 HH21 ARG 15 HH21 ARG 15 -11.181 -8.313 -13.874 841 HH22 ARG 15 HH22 ARG 15 -9.641 -7.797 -14.482 842 H ILE 16 H ILE 16 -9.225 -10.777 -6.782 843 HA ILE 16 HA ILE 16 -7.212 -8.957 -7.909 844 HB ILE 16 HB ILE 16 -6.966 -10.118 -5.130 845 HG12 ILE 16 HG12 ILE 16 -7.578 -7.235 -5.821 846 HG13 ILE 16 HG13 ILE 16 -8.813 -8.393 -5.336 847 HG21 ILE 16 HG21 ILE 16 -4.891 -9.635 -6.395 848 HG22 ILE 16 HG22 ILE 16 -5.058 -8.668 -4.931 849 HG23 ILE 16 HG23 ILE 16 -5.390 -7.947 -6.504 850 HD11 ILE 16 HD11 ILE 16 -6.538 -7.310 -3.709 851 HD12 ILE 16 HD12 ILE 16 -7.465 -8.730 -3.225 852 HD13 ILE 16 HD13 ILE 16 -8.271 -7.172 -3.410 853 H TYR 17 H TYR 17 -6.135 -10.145 -9.305 854 HA TYR 17 HA TYR 17 -4.861 -11.754 -10.231 855 HB2 TYR 17 HB2 TYR 17 -3.947 -11.655 -7.704 856 HB3 TYR 17 HB3 TYR 17 -4.493 -13.329 -7.749 857 HD1 TYR 17 HD1 TYR 17 -2.397 -10.899 -9.640 858 HD2 TYR 17 HD2 TYR 17 -3.087 -14.970 -8.628 859 HE1 TYR 17 HE1 TYR 17 -0.313 -11.529 -10.784 860 HE2 TYR 17 HE2 TYR 17 -1.006 -15.615 -9.766 861 HH TYR 17 HH TYR 17 1.376 -13.450 -10.661 862 H GLY 18 H GLY 18 -7.839 -12.192 -9.459 863 HA2 GLY 18 HA2 GLY 18 -8.992 -13.894 -10.824 864 HA3 GLY 18 HA3 GLY 18 -7.831 -15.051 -10.199 865 H GLN 19 H GLN 19 -8.016 -13.896 -7.472 866 HA GLN 19 HA GLN 19 -10.468 -15.303 -6.704 867 HB2 GLN 19 HB2 GLN 19 -7.829 -14.961 -5.543 868 HB3 GLN 19 HB3 GLN 19 -9.089 -14.568 -4.386 869 HG2 GLN 19 HG2 GLN 19 -8.440 -16.882 -4.184 870 HG3 GLN 19 HG3 GLN 19 -10.105 -16.765 -4.755 871 HE21 GLN 19 HE21 GLN 19 -10.618 -17.500 -6.777 872 HE22 GLN 19 HE22 GLN 19 -9.512 -18.372 -7.780 873 H ASP 20 H ASP 20 -11.809 -14.379 -4.977 874 HA ASP 20 HA ASP 20 -11.918 -11.453 -5.218 875 HB2 ASP 20 HB2 ASP 20 -14.265 -11.533 -4.828 876 HB3 ASP 20 HB3 ASP 20 -13.919 -12.792 -6.004 877 H TYR 21 H TYR 21 -11.839 -10.180 -3.465 878 HA TYR 21 HA TYR 21 -11.775 -11.467 -0.820 879 HB2 TYR 21 HB2 TYR 21 -9.822 -9.364 -1.798 880 HB3 TYR 21 HB3 TYR 21 -9.876 -10.041 -0.174 881 HD1 TYR 21 HD2 TYR 21 -9.266 -12.426 0.188 882 HD2 TYR 21 HD1 TYR 21 -8.750 -10.527 -3.584 883 HE1 TYR 21 HE2 TYR 21 -7.752 -14.235 -0.510 884 HE2 TYR 21 HE1 TYR 21 -7.237 -12.329 -4.291 885 HH TYR 21 HH TYR 21 -5.763 -14.012 -3.237 886 H THR 22 H THR 22 -12.666 -10.292 0.836 887 HA THR 22 HA THR 22 -14.194 -7.934 0.022 888 HB THR 22 HB THR 22 -14.503 -9.342 2.662 889 HG1 THR 22 HG1 THR 22 -15.460 -10.154 0.106 890 HG21 THR 22 HG21 THR 22 -16.453 -7.917 0.844 891 HG22 THR 22 HG22 THR 22 -15.696 -7.226 2.281 892 HG23 THR 22 HG23 THR 22 -16.812 -8.581 2.439 893 H ILE 23 H ILE 23 -13.608 -5.955 0.640 894 HA ILE 23 HA ILE 23 -11.988 -5.660 3.074 895 HB ILE 23 HB ILE 23 -10.659 -3.879 2.047 896 HG12 ILE 23 HG12 ILE 23 -12.454 -3.537 0.176 897 HG13 ILE 23 HG13 ILE 23 -10.762 -3.216 -0.159 898 HG21 ILE 23 HG21 ILE 23 -10.473 -6.598 0.786 899 HG22 ILE 23 HG22 ILE 23 -9.624 -5.988 2.204 900 HG23 ILE 23 HG23 ILE 23 -9.236 -5.353 0.607 901 HD11 ILE 23 HD11 ILE 23 -10.547 -5.128 -1.481 902 HD12 ILE 23 HD12 ILE 23 -12.118 -4.457 -1.913 903 HD13 ILE 23 HD13 ILE 23 -12.022 -5.851 -0.841 904 H VAL 24 H VAL 24 -12.000 -3.400 3.893 905 HA VAL 24 HA VAL 24 -14.710 -2.430 3.908 906 HB VAL 24 HB VAL 24 -12.265 -1.351 5.329 907 HG11 VAL 24 HG11 VAL 24 -13.893 -0.260 6.820 908 HG12 VAL 24 HG12 VAL 24 -15.199 -0.802 5.764 909 HG13 VAL 24 HG13 VAL 24 -13.990 0.333 5.161 910 HG21 VAL 24 HG21 VAL 24 -12.743 -3.643 5.990 911 HG22 VAL 24 HG22 VAL 24 -14.425 -3.220 6.311 912 HG23 VAL 24 HG23 VAL 24 -13.138 -2.527 7.297 913 H GLY 25 H GLY 25 -15.484 -0.939 2.551 914 HA2 GLY 25 HA2 GLY 25 -13.584 0.771 1.096 915 HA3 GLY 25 HA3 GLY 25 -15.244 0.436 0.618 916 H ALA 26 H ALA 26 -13.348 1.984 3.185 917 HA ALA 26 HA ALA 26 -15.594 3.594 4.018 918 HB1 ALA 26 HB1 ALA 26 -12.724 3.713 4.919 919 HB2 ALA 26 HB2 ALA 26 -13.981 2.704 5.637 920 HB3 ALA 26 HB3 ALA 26 -14.111 4.461 5.713 921 H GLU 27 H GLU 27 -13.339 3.921 1.552 922 HA GLU 27 HA GLU 27 -13.144 6.815 1.765 923 HB2 GLU 27 HB2 GLU 27 -11.346 5.086 0.850 924 HB3 GLU 27 HB3 GLU 27 -12.195 5.356 -0.662 925 HG2 GLU 27 HG2 GLU 27 -10.909 7.478 1.042 926 HG3 GLU 27 HG3 GLU 27 -10.258 6.808 -0.453 927 H SER 28 H SER 28 -14.158 4.608 -0.853 928 HA SER 28 HA SER 28 -16.649 5.810 -1.295 929 HB2 SER 28 HB2 SER 28 -14.333 6.942 -2.800 930 HB3 SER 28 HB3 SER 28 -15.829 6.668 -3.695 931 HG SER 28 HG SER 28 -15.685 8.105 -1.244 932 HA PRO 29 HA PRO 29 -17.163 1.919 -3.302 933 HB2 PRO 29 HB2 PRO 29 -19.091 2.665 -5.159 934 HB3 PRO 29 HB3 PRO 29 -19.408 2.189 -3.489 935 HG2 PRO 29 HG2 PRO 29 -19.198 4.919 -4.680 936 HG3 PRO 29 HG3 PRO 29 -20.299 4.321 -3.424 937 HD2 PRO 29 HD2 PRO 29 -18.168 5.827 -2.811 938 HD3 PRO 29 HD3 PRO 29 -18.696 4.500 -1.755 939 H ALA 30 H ALA 30 -16.868 4.755 -5.437 940 HA ALA 30 HA ALA 30 -15.897 3.061 -7.593 941 HB1 ALA 30 HB1 ALA 30 -15.954 5.062 -8.958 942 HB2 ALA 30 HB2 ALA 30 -16.262 6.055 -7.535 943 HB3 ALA 30 HB3 ALA 30 -17.472 4.891 -8.077 944 H HIS 31 H HIS 31 -14.451 4.113 -4.926 945 HA HIS 31 HA HIS 31 -11.986 4.967 -6.285 946 HB2 HIS 31 HB2 HIS 31 -13.269 5.877 -3.931 947 HB3 HIS 31 HB3 HIS 31 -11.758 5.128 -3.432 948 HD1 HIS 31 HD1 HIS 31 -12.737 7.533 -6.238 949 HD2 HIS 31 HD2 HIS 31 -9.829 7.003 -3.320 950 HE1 HIS 31 HE1 HIS 31 -11.168 9.468 -6.490 951 HE2 HIS 31 HE2 HIS 31 -9.601 9.285 -4.533 952 H ILE 32 H ILE 32 -13.171 2.678 -3.830 953 HA ILE 32 HA ILE 32 -10.581 1.391 -3.734 954 HB ILE 32 HB ILE 32 -11.274 0.092 -1.981 955 HG12 ILE 32 HG12 ILE 32 -13.201 -0.993 -3.055 956 HG13 ILE 32 HG13 ILE 32 -13.553 -0.534 -1.396 957 HG21 ILE 32 HG21 ILE 32 -11.292 2.434 -1.347 958 HG22 ILE 32 HG22 ILE 32 -12.443 1.502 -0.394 959 HG23 ILE 32 HG23 ILE 32 -13.014 2.536 -1.697 960 HD11 ILE 32 HD11 ILE 32 -15.452 -0.136 -2.819 961 HD12 ILE 32 HD12 ILE 32 -14.488 0.881 -3.882 962 HD13 ILE 32 HD13 ILE 32 -14.823 1.398 -2.230 963 H ARG 33 H ARG 33 -13.136 1.263 -5.804 964 HA ARG 33 HA ARG 33 -13.083 -1.553 -6.381 965 HB2 ARG 33 HB2 ARG 33 -14.960 0.291 -6.761 966 HB3 ARG 33 HB3 ARG 33 -14.169 0.428 -8.324 967 HG2 ARG 33 HG2 ARG 33 -14.599 -1.864 -8.821 968 HG3 ARG 33 HG3 ARG 33 -15.183 -2.162 -7.183 969 HD2 ARG 33 HD2 ARG 33 -17.013 -1.918 -8.826 970 HD3 ARG 33 HD3 ARG 33 -17.077 -0.709 -7.545 971 HE ARG 33 HE ARG 33 -15.849 -0.066 -10.135 972 HH11 ARG 33 HH11 ARG 33 -18.327 0.512 -7.725 973 HH12 ARG 33 HH12 ARG 33 -18.846 2.007 -8.434 974 HH21 ARG 33 HH21 ARG 33 -16.523 1.896 -11.065 975 HH22 ARG 33 HH22 ARG 33 -17.823 2.792 -10.346 976 H LEU 34 H LEU 34 -11.362 1.269 -7.409 977 HA LEU 34 HA LEU 34 -10.336 -0.033 -9.796 978 HB2 LEU 34 HB2 LEU 34 -9.214 2.044 -10.271 979 HB3 LEU 34 HB3 LEU 34 -10.882 2.368 -9.853 980 HG LEU 34 HG LEU 34 -9.694 2.706 -7.437 981 HD11 LEU 34 HD11 LEU 34 -7.447 2.372 -8.294 982 HD12 LEU 34 HD12 LEU 34 -7.667 4.049 -7.793 983 HD13 LEU 34 HD13 LEU 34 -7.701 3.628 -9.506 984 HD21 LEU 34 HD21 LEU 34 -9.862 5.111 -7.896 985 HD22 LEU 34 HD22 LEU 34 -11.270 4.227 -8.489 986 HD23 LEU 34 HD23 LEU 34 -10.023 4.762 -9.617 987 H VAL 35 H VAL 35 -9.567 0.249 -6.519 988 HA VAL 35 HA VAL 35 -6.753 0.161 -6.546 989 HB VAL 35 HB VAL 35 -8.592 -1.087 -4.498 990 HG11 VAL 35 HG11 VAL 35 -6.267 -1.755 -4.255 991 HG12 VAL 35 HG12 VAL 35 -6.742 -0.672 -2.946 992 HG13 VAL 35 HG13 VAL 35 -5.765 -0.063 -4.284 993 HG21 VAL 35 HG21 VAL 35 -9.162 1.257 -4.976 994 HG22 VAL 35 HG22 VAL 35 -7.502 1.717 -4.600 995 HG23 VAL 35 HG23 VAL 35 -8.533 1.033 -3.345 996 H ALA 36 H ALA 36 -9.212 -2.309 -6.785 997 HA ALA 36 HA ALA 36 -7.725 -4.614 -6.411 998 HB1 ALA 36 HB1 ALA 36 -10.201 -4.434 -6.705 999 HB2 ALA 36 HB2 ALA 36 -9.447 -5.774 -7.569 1000 HB3 ALA 36 HB3 ALA 36 -9.923 -4.317 -8.440 1001 H ALA 37 H ALA 37 -8.209 -2.756 -9.392 1002 HA ALA 37 HA ALA 37 -6.728 -4.477 -11.076 1003 HB1 ALA 37 HB1 ALA 37 -8.357 -2.841 -11.925 1004 HB2 ALA 37 HB2 ALA 37 -6.778 -2.653 -12.686 1005 HB3 ALA 37 HB3 ALA 37 -7.289 -1.532 -11.425 1006 H PHE 38 H PHE 38 -5.890 -1.729 -9.080 1007 HA PHE 38 HA PHE 38 -3.292 -1.249 -10.032 1008 HB2 PHE 38 HB2 PHE 38 -4.607 0.267 -8.539 1009 HB3 PHE 38 HB3 PHE 38 -4.330 -0.853 -7.214 1010 HD1 PHE 38 HD2 PHE 38 -2.126 -1.058 -6.200 1011 HD2 PHE 38 HD1 PHE 38 -2.859 1.709 -9.351 1012 HE1 PHE 38 HE2 PHE 38 -0.026 0.103 -5.664 1013 HE2 PHE 38 HE1 PHE 38 -0.755 2.872 -8.821 1014 HZ PHE 38 HZ PHE 38 0.662 2.069 -6.976 1015 H VAL 39 H VAL 39 -4.537 -3.432 -7.560 1016 HA VAL 39 HA VAL 39 -1.919 -4.346 -6.774 1017 HB VAL 39 HB VAL 39 -4.613 -5.566 -6.138 1018 HG11 VAL 39 HG11 VAL 39 -3.460 -6.637 -4.280 1019 HG12 VAL 39 HG12 VAL 39 -1.935 -5.911 -4.789 1020 HG13 VAL 39 HG13 VAL 39 -2.734 -7.104 -5.816 1021 HG21 VAL 39 HG21 VAL 39 -2.956 -3.639 -4.516 1022 HG22 VAL 39 HG22 VAL 39 -4.484 -4.374 -4.035 1023 HG23 VAL 39 HG23 VAL 39 -4.442 -3.237 -5.379 1024 H ASP 40 H ASP 40 -4.631 -5.655 -8.633 1025 HA ASP 40 HA ASP 40 -3.740 -8.198 -9.218 1026 HB2 ASP 40 HB2 ASP 40 -5.948 -7.044 -9.852 1027 HB3 ASP 40 HB3 ASP 40 -5.094 -6.444 -11.268 1028 H ASP 41 H ASP 41 -3.072 -5.210 -10.993 1029 HA ASP 41 HA ASP 41 -1.419 -6.391 -12.962 1030 HB2 ASP 41 HB2 ASP 41 -2.503 -4.213 -13.286 1031 HB3 ASP 41 HB3 ASP 41 -1.514 -3.527 -12.001 1032 H LYS 42 H LYS 42 -0.654 -4.618 -9.978 1033 HA LYS 42 HA LYS 42 2.131 -4.677 -10.250 1034 HB2 LYS 42 HB2 LYS 42 0.675 -3.331 -8.612 1035 HB3 LYS 42 HB3 LYS 42 0.725 -4.759 -7.591 1036 HG2 LYS 42 HG2 LYS 42 2.875 -4.439 -7.002 1037 HG3 LYS 42 HG3 LYS 42 3.327 -3.782 -8.575 1038 HD2 LYS 42 HD2 LYS 42 1.653 -2.270 -6.578 1039 HD3 LYS 42 HD3 LYS 42 3.412 -2.168 -6.629 1040 HE2 LYS 42 HE2 LYS 42 1.608 -1.532 -8.961 1041 HE3 LYS 42 HE3 LYS 42 2.237 -0.329 -7.836 1042 HZ1 LYS 42 HZ1 LYS 42 4.476 -0.916 -8.496 1043 HZ2 LYS 42 HZ2 LYS 42 3.571 -0.476 -9.853 1044 HZ3 LYS 42 HZ3 LYS 42 3.894 -2.113 -9.552 1045 H MET 43 H MET 43 -0.100 -7.029 -8.853 1046 HA MET 43 HA MET 43 1.860 -8.708 -7.709 1047 HB2 MET 43 HB2 MET 43 -0.981 -9.109 -8.573 1048 HB3 MET 43 HB3 MET 43 -0.015 -10.487 -8.059 1049 HG2 MET 43 HG2 MET 43 0.402 -9.345 -5.913 1050 HG3 MET 43 HG3 MET 43 -0.658 -8.038 -6.437 1051 HE1 MET 43 HE1 MET 43 -0.364 -11.629 -5.048 1052 HE2 MET 43 HE2 MET 43 -0.860 -12.002 -6.699 1053 HE3 MET 43 HE3 MET 43 -1.957 -12.324 -5.359 1054 H HIS 44 H HIS 44 0.297 -8.733 -10.883 1055 HA HIS 44 HA HIS 44 1.626 -11.087 -11.765 1056 HB2 HIS 44 HB2 HIS 44 -0.473 -10.316 -12.780 1057 HB3 HIS 44 HB3 HIS 44 0.347 -8.892 -13.405 1058 HD1 HIS 44 HD1 HIS 44 1.466 -9.119 -15.643 1059 HD2 HIS 44 HD2 HIS 44 0.477 -12.794 -13.966 1060 HE1 HIS 44 HE1 HIS 44 1.964 -10.833 -17.419 1061 HE2 HIS 44 HE2 HIS 44 1.500 -13.059 -16.321 1062 H GLU 45 H GLU 45 2.364 -7.639 -12.023 1063 HA GLU 45 HA GLU 45 4.459 -7.906 -13.901 1064 HB2 GLU 45 HB2 GLU 45 4.825 -5.652 -13.624 1065 HB3 GLU 45 HB3 GLU 45 3.172 -5.784 -13.046 1066 HG2 GLU 45 HG2 GLU 45 3.981 -5.819 -10.734 1067 HG3 GLU 45 HG3 GLU 45 5.641 -5.693 -11.314 1068 H PHE 46 H PHE 46 4.351 -8.507 -10.479 1069 HA PHE 46 HA PHE 46 7.275 -8.578 -10.387 1070 HB2 PHE 46 HB2 PHE 46 5.172 -8.469 -8.251 1071 HB3 PHE 46 HB3 PHE 46 6.828 -8.942 -7.874 1072 HD1 PHE 46 HD1 PHE 46 8.580 -7.267 -9.212 1073 HD2 PHE 46 HD2 PHE 46 4.716 -6.282 -7.718 1074 HE1 PHE 46 HE1 PHE 46 9.234 -4.900 -9.094 1075 HE2 PHE 46 HE2 PHE 46 5.367 -3.913 -7.597 1076 HZ PHE 46 HZ PHE 46 7.626 -3.219 -8.283 1077 H SER 47 H SER 47 4.874 -10.671 -11.122 1078 HA SER 47 HA SER 47 5.657 -12.979 -9.648 1079 HB2 SER 47 HB2 SER 47 4.159 -12.782 -12.276 1080 HB3 SER 47 HB3 SER 47 4.277 -14.225 -11.271 1081 HG SER 47 HG SER 47 3.339 -11.874 -10.070 1082 H GLU 48 H GLU 48 6.953 -11.352 -12.352 1083 HA GLU 48 HA GLU 48 8.296 -13.567 -13.557 1084 HB2 GLU 48 HB2 GLU 48 9.495 -11.847 -14.846 1085 HB3 GLU 48 HB3 GLU 48 7.756 -11.590 -14.863 1086 HG2 GLU 48 HG2 GLU 48 7.878 -9.697 -13.582 1087 HG3 GLU 48 HG3 GLU 48 9.386 -10.183 -12.808 1088 H LYS 49 H LYS 49 8.945 -11.576 -10.842 1089 HA LYS 49 HA LYS 49 11.809 -11.891 -10.931 1090 HB2 LYS 49 HB2 LYS 49 10.131 -10.960 -8.600 1091 HB3 LYS 49 HB3 LYS 49 11.854 -10.721 -8.825 1092 HG2 LYS 49 HG2 LYS 49 9.663 -9.510 -10.497 1093 HG3 LYS 49 HG3 LYS 49 10.622 -8.679 -9.273 1094 HD2 LYS 49 HD2 LYS 49 12.664 -9.230 -10.626 1095 HD3 LYS 49 HD3 LYS 49 11.586 -9.832 -11.885 1096 HE2 LYS 49 HE2 LYS 49 10.479 -7.539 -11.816 1097 HE3 LYS 49 HE3 LYS 49 11.869 -7.017 -10.866 1098 HZ1 LYS 49 HZ1 LYS 49 13.285 -7.818 -12.725 1099 HZ2 LYS 49 HZ2 LYS 49 12.292 -6.510 -13.133 1100 HZ3 LYS 49 HZ3 LYS 49 11.878 -8.075 -13.637 1101 H GLN 50 H GLN 50 9.299 -12.989 -8.673 1102 HA GLN 50 HA GLN 50 9.264 -14.652 -7.120 1103 HB2 GLN 50 HB2 GLN 50 9.449 -15.684 -9.709 1104 HB3 GLN 50 HB3 GLN 50 10.556 -16.657 -8.753 1105 HG2 GLN 50 HG2 GLN 50 8.514 -17.781 -8.641 1106 HG3 GLN 50 HG3 GLN 50 8.641 -16.925 -7.104 1107 HE21 GLN 50 HE21 GLN 50 6.942 -17.206 -10.079 1108 HE22 GLN 50 HE22 GLN 50 5.670 -16.096 -9.701 1109 HA PRO 51 HA PRO 51 13.864 -14.283 -6.121 1110 HB2 PRO 51 HB2 PRO 51 12.864 -13.173 -3.591 1111 HB3 PRO 51 HB3 PRO 51 14.081 -12.536 -4.694 1112 HG2 PRO 51 HG2 PRO 51 11.650 -11.412 -4.435 1113 HG3 PRO 51 HG3 PRO 51 12.531 -11.419 -5.974 1114 HD2 PRO 51 HD2 PRO 51 10.259 -13.136 -5.075 1115 HD3 PRO 51 HD3 PRO 51 10.571 -12.429 -6.674 1116 H MET 52 H MET 52 11.132 -15.186 -4.050 1117 HA MET 52 HA MET 52 12.853 -17.155 -2.722 1118 HB2 MET 52 HB2 MET 52 10.126 -16.162 -1.883 1119 HB3 MET 52 HB3 MET 52 11.175 -17.225 -0.958 1120 HG2 MET 52 HG2 MET 52 11.765 -14.367 -1.702 1121 HG3 MET 52 HG3 MET 52 11.246 -14.946 -0.118 1122 HE1 MET 52 HE1 MET 52 13.846 -13.139 -0.676 1123 HE2 MET 52 HE2 MET 52 15.014 -13.904 0.401 1124 HE3 MET 52 HE3 MET 52 13.357 -13.648 0.941 1125 H LEU 53 H LEU 53 10.913 -17.091 -5.300 1126 HA LEU 53 HA LEU 53 9.509 -18.524 -6.403 1127 HB2 LEU 53 HB2 LEU 53 11.322 -20.547 -5.085 1128 HB3 LEU 53 HB3 LEU 53 10.354 -20.813 -6.525 1129 HG LEU 53 HG LEU 53 12.476 -18.685 -6.443 1130 HD11 LEU 53 HD11 LEU 53 14.017 -20.287 -7.452 1131 HD12 LEU 53 HD12 LEU 53 12.836 -21.575 -7.220 1132 HD13 LEU 53 HD13 LEU 53 13.553 -20.774 -5.822 1133 HD21 LEU 53 HD21 LEU 53 11.564 -20.279 -8.807 1134 HD22 LEU 53 HD22 LEU 53 12.317 -18.683 -8.760 1135 HD23 LEU 53 HD23 LEU 53 10.644 -18.884 -8.249 1136 H ASP 54 H ASP 54 7.858 -17.811 -4.734 1137 HA ASP 54 HA ASP 54 6.436 -20.125 -3.811 1138 HB2 ASP 54 HB2 ASP 54 7.641 -19.996 -1.833 1139 HB3 ASP 54 HB3 ASP 54 7.796 -18.250 -1.912 1140 H VAL 55 H VAL 55 4.227 -19.541 -3.088 1141 HA VAL 55 HA VAL 55 3.199 -17.419 -4.696 1142 HB VAL 55 HB VAL 55 1.658 -19.121 -2.742 1143 HG11 VAL 55 HG11 VAL 55 0.741 -17.570 -5.161 1144 HG12 VAL 55 HG12 VAL 55 0.499 -17.090 -3.482 1145 HG13 VAL 55 HG13 VAL 55 -0.273 -18.547 -4.100 1146 HG21 VAL 55 HG21 VAL 55 2.847 -20.533 -4.320 1147 HG22 VAL 55 HG22 VAL 55 2.225 -19.582 -5.670 1148 HG23 VAL 55 HG23 VAL 55 1.119 -20.532 -4.678 1149 HA PRO 56 HA PRO 56 1.512 -15.467 -0.481 1150 HB2 PRO 56 HB2 PRO 56 3.270 -16.182 1.613 1151 HB3 PRO 56 HB3 PRO 56 1.574 -16.632 1.436 1152 HG2 PRO 56 HG2 PRO 56 4.023 -18.169 0.769 1153 HG3 PRO 56 HG3 PRO 56 2.438 -18.750 1.308 1154 HD2 PRO 56 HD2 PRO 56 3.236 -19.014 -1.231 1155 HD3 PRO 56 HD3 PRO 56 1.543 -18.668 -0.830 1156 H LYS 57 H LYS 57 5.005 -16.142 -0.792 1157 HA LYS 57 HA LYS 57 5.908 -13.702 0.252 1158 HB2 LYS 57 HB2 LYS 57 8.027 -14.205 -0.708 1159 HB3 LYS 57 HB3 LYS 57 7.307 -15.736 -0.239 1160 HG2 LYS 57 HG2 LYS 57 8.015 -16.347 -2.288 1161 HG3 LYS 57 HG3 LYS 57 6.479 -15.630 -2.779 1162 HD2 LYS 57 HD2 LYS 57 7.820 -13.443 -3.003 1163 HD3 LYS 57 HD3 LYS 57 9.247 -14.481 -2.965 1164 HE2 LYS 57 HE2 LYS 57 8.524 -13.980 -5.256 1165 HE3 LYS 57 HE3 LYS 57 8.445 -15.704 -4.895 1166 HZ1 LYS 57 HZ1 LYS 57 6.495 -14.822 -6.115 1167 HZ2 LYS 57 HZ2 LYS 57 6.109 -13.879 -4.763 1168 HZ3 LYS 57 HZ3 LYS 57 6.091 -15.569 -4.648 1169 H LEU 58 H LEU 58 4.319 -14.323 -2.735 1170 HA LEU 58 HA LEU 58 5.420 -12.076 -4.148 1171 HB2 LEU 58 HB2 LEU 58 4.347 -14.174 -5.173 1172 HB3 LEU 58 HB3 LEU 58 2.805 -13.464 -4.755 1173 HG LEU 58 HG LEU 58 3.546 -13.215 -7.161 1174 HD11 LEU 58 HD11 LEU 58 2.749 -10.908 -7.355 1175 HD12 LEU 58 HD12 LEU 58 2.926 -10.712 -5.611 1176 HD13 LEU 58 HD13 LEU 58 1.765 -11.871 -6.256 1177 HD21 LEU 58 HD21 LEU 58 5.945 -12.613 -6.469 1178 HD22 LEU 58 HD22 LEU 58 5.309 -10.983 -6.212 1179 HD23 LEU 58 HD23 LEU 58 5.209 -11.731 -7.802 1180 H ALA 59 H ALA 59 2.448 -12.766 -2.381 1181 HA ALA 59 HA ALA 59 1.193 -10.278 -2.804 1182 HB1 ALA 59 HB1 ALA 59 0.848 -12.255 -0.554 1183 HB2 ALA 59 HB2 ALA 59 -0.034 -12.245 -2.081 1184 HB3 ALA 59 HB3 ALA 59 -0.251 -10.927 -0.929 1185 H VAL 60 H VAL 60 3.533 -11.398 -0.442 1186 HA VAL 60 HA VAL 60 3.297 -9.084 1.250 1187 HB VAL 60 HB VAL 60 5.610 -11.043 1.106 1188 HG11 VAL 60 HG11 VAL 60 6.124 -10.295 3.360 1189 HG12 VAL 60 HG12 VAL 60 4.765 -9.171 3.315 1190 HG13 VAL 60 HG13 VAL 60 6.138 -8.936 2.235 1191 HG21 VAL 60 HG21 VAL 60 4.577 -12.170 3.025 1192 HG22 VAL 60 HG22 VAL 60 3.555 -12.252 1.595 1193 HG23 VAL 60 HG23 VAL 60 3.173 -11.113 2.886 1194 H LEU 61 H LEU 61 5.334 -10.130 -1.401 1195 HA LEU 61 HA LEU 61 7.276 -8.109 -1.311 1196 HB2 LEU 61 HB2 LEU 61 7.472 -10.187 -2.631 1197 HB3 LEU 61 HB3 LEU 61 6.216 -9.612 -3.707 1198 HG LEU 61 HG LEU 61 7.721 -7.683 -4.299 1199 HD11 LEU 61 HD11 LEU 61 9.707 -9.314 -2.729 1200 HD12 LEU 61 HD12 LEU 61 9.187 -7.662 -2.398 1201 HD13 LEU 61 HD13 LEU 61 10.137 -8.015 -3.839 1202 HD21 LEU 61 HD21 LEU 61 7.460 -9.658 -5.730 1203 HD22 LEU 61 HD22 LEU 61 8.781 -10.450 -4.869 1204 HD23 LEU 61 HD23 LEU 61 9.093 -8.996 -5.817 1205 H THR 62 H THR 62 4.066 -8.226 -2.765 1206 HA THR 62 HA THR 62 4.365 -5.720 -4.120 1207 HB THR 62 HB THR 62 1.713 -5.969 -4.062 1208 HG1 THR 62 HG1 THR 62 1.452 -7.729 -2.773 1209 HG21 THR 62 HG21 THR 62 1.816 -7.135 -6.126 1210 HG22 THR 62 HG22 THR 62 3.373 -7.855 -5.716 1211 HG23 THR 62 HG23 THR 62 3.255 -6.125 -6.032 1212 H ALA 63 H ALA 63 2.915 -6.807 -1.095 1213 HA ALA 63 HA ALA 63 1.630 -4.456 -0.336 1214 HB1 ALA 63 HB1 ALA 63 1.724 -5.346 1.941 1215 HB2 ALA 63 HB2 ALA 63 2.906 -6.547 1.419 1216 HB3 ALA 63 HB3 ALA 63 1.264 -6.585 0.774 1217 H VAL 64 H VAL 64 4.913 -5.550 0.485 1218 HA VAL 64 HA VAL 64 5.582 -3.291 2.017 1219 HB VAL 64 HB VAL 64 6.818 -5.399 2.180 1220 HG11 VAL 64 HG11 VAL 64 7.695 -4.720 -0.603 1221 HG12 VAL 64 HG12 VAL 64 6.992 -6.222 -0.002 1222 HG13 VAL 64 HG13 VAL 64 8.640 -5.779 0.442 1223 HG21 VAL 64 HG21 VAL 64 8.452 -2.974 1.466 1224 HG22 VAL 64 HG22 VAL 64 9.129 -4.434 2.184 1225 HG23 VAL 64 HG23 VAL 64 7.928 -3.495 3.069 1226 H GLN 65 H GLN 65 5.731 -3.840 -1.442 1227 HA GLN 65 HA GLN 65 7.330 -1.483 -1.895 1228 HB2 GLN 65 HB2 GLN 65 5.923 -3.394 -3.753 1229 HB3 GLN 65 HB3 GLN 65 6.759 -1.957 -4.329 1230 HG2 GLN 65 HG2 GLN 65 8.845 -2.776 -3.315 1231 HG3 GLN 65 HG3 GLN 65 7.999 -4.224 -2.774 1232 HE21 GLN 65 HE21 GLN 65 7.318 -5.737 -4.301 1233 HE22 GLN 65 HE22 GLN 65 8.015 -5.798 -5.885 1234 H ILE 66 H ILE 66 3.929 -2.377 -2.158 1235 HA ILE 66 HA ILE 66 2.933 -0.135 -3.461 1236 HB ILE 66 HB ILE 66 1.734 -2.029 -1.474 1237 HG12 ILE 66 HG12 ILE 66 0.989 -1.395 -4.336 1238 HG13 ILE 66 HG13 ILE 66 2.142 -2.643 -3.878 1239 HG21 ILE 66 HG21 ILE 66 0.785 0.311 -1.162 1240 HG22 ILE 66 HG22 ILE 66 -0.366 -0.981 -1.488 1241 HG23 ILE 66 HG23 ILE 66 0.101 0.129 -2.777 1242 HD11 ILE 66 HD11 ILE 66 -0.797 -2.558 -3.252 1243 HD12 ILE 66 HD12 ILE 66 0.326 -3.732 -2.565 1244 HD13 ILE 66 HD13 ILE 66 0.051 -3.687 -4.307 1245 H ALA 67 H ALA 67 3.499 -0.617 0.012 1246 HA ALA 67 HA ALA 67 2.422 1.801 0.917 1247 HB1 ALA 67 HB1 ALA 67 4.011 1.479 2.862 1248 HB2 ALA 67 HB2 ALA 67 4.600 0.045 2.020 1249 HB3 ALA 67 HB3 ALA 67 2.917 0.138 2.526 1250 H SER 68 H SER 68 5.711 0.988 -0.125 1251 HA SER 68 HA SER 68 6.853 3.516 0.389 1252 HB2 SER 68 HB2 SER 68 8.043 1.282 -0.020 1253 HB3 SER 68 HB3 SER 68 7.795 1.594 -1.739 1254 HG SER 68 HG SER 68 9.471 2.828 -1.647 1255 H GLU 69 H GLU 69 5.160 2.168 -2.374 1256 HA GLU 69 HA GLU 69 5.810 4.113 -4.288 1257 HB2 GLU 69 HB2 GLU 69 3.350 2.381 -4.004 1258 HB3 GLU 69 HB3 GLU 69 3.679 3.381 -5.411 1259 HG2 GLU 69 HG2 GLU 69 5.890 1.624 -4.674 1260 HG3 GLU 69 HG3 GLU 69 4.412 0.768 -5.107 1261 H TYR 70 H TYR 70 3.436 4.113 -1.713 1262 HA TYR 70 HA TYR 70 2.291 6.610 -2.704 1263 HB2 TYR 70 HB2 TYR 70 1.473 4.676 -0.557 1264 HB3 TYR 70 HB3 TYR 70 0.768 6.285 -0.654 1265 HD1 TYR 70 HD2 TYR 70 -0.458 6.948 -2.753 1266 HD2 TYR 70 HD1 TYR 70 0.743 2.942 -1.987 1267 HE1 TYR 70 HE2 TYR 70 -2.059 6.151 -4.440 1268 HE2 TYR 70 HE1 TYR 70 -0.854 2.135 -3.672 1269 HH TYR 70 HH TYR 70 -2.988 2.953 -4.724 1270 H LEU 71 H LEU 71 4.349 5.424 -0.133 1271 HA LEU 71 HA LEU 71 4.202 7.667 1.568 1272 HB2 LEU 71 HB2 LEU 71 6.152 5.456 1.155 1273 HB3 LEU 71 HB3 LEU 71 6.670 6.843 2.100 1274 HG LEU 71 HG LEU 71 4.086 5.482 2.795 1275 HD11 LEU 71 HD11 LEU 71 6.827 4.514 3.582 1276 HD12 LEU 71 HD12 LEU 71 5.582 3.617 2.706 1277 HD13 LEU 71 HD13 LEU 71 5.330 4.056 4.395 1278 HD21 LEU 71 HD21 LEU 71 4.970 7.667 3.820 1279 HD22 LEU 71 HD22 LEU 71 6.129 6.638 4.662 1280 HD23 LEU 71 HD23 LEU 71 4.398 6.404 4.907 1281 H LYS 72 H LYS 72 6.155 6.983 -1.274 1282 HA LYS 72 HA LYS 72 7.836 9.269 -1.040 1283 HB2 LYS 72 HB2 LYS 72 8.598 8.742 -3.262 1284 HB3 LYS 72 HB3 LYS 72 8.417 7.243 -2.365 1285 HG2 LYS 72 HG2 LYS 72 6.180 6.960 -3.475 1286 HG3 LYS 72 HG3 LYS 72 6.594 8.339 -4.494 1287 HD2 LYS 72 HD2 LYS 72 8.580 7.137 -5.296 1288 HD3 LYS 72 HD3 LYS 72 8.139 5.754 -4.293 1289 HE2 LYS 72 HE2 LYS 72 5.978 5.644 -5.537 1290 HE3 LYS 72 HE3 LYS 72 6.593 6.888 -6.618 1291 HZ1 LYS 72 HZ1 LYS 72 6.883 4.221 -6.968 1292 HZ2 LYS 72 HZ2 LYS 72 8.376 4.658 -6.296 1293 HZ3 LYS 72 HZ3 LYS 72 7.835 5.413 -7.708 1294 H LEU 73 H LEU 73 4.609 8.856 -2.002 1295 HA LEU 73 HA LEU 73 4.518 11.174 -3.739 1296 HB2 LEU 73 HB2 LEU 73 3.091 9.288 -4.249 1297 HB3 LEU 73 HB3 LEU 73 2.359 9.365 -2.659 1298 HG LEU 73 HG LEU 73 1.483 11.651 -3.282 1299 HD11 LEU 73 HD11 LEU 73 2.374 10.776 -6.028 1300 HD12 LEU 73 HD12 LEU 73 2.982 12.155 -5.115 1301 HD13 LEU 73 HD13 LEU 73 1.314 12.143 -5.684 1302 HD21 LEU 73 HD21 LEU 73 0.049 9.702 -3.263 1303 HD22 LEU 73 HD22 LEU 73 0.577 9.264 -4.887 1304 HD23 LEU 73 HD23 LEU 73 -0.361 10.735 -4.632 1305 H LYS 74 H LYS 74 3.370 10.277 -0.486 1306 HA LYS 74 HA LYS 74 2.201 12.828 0.001 1307 HB2 LYS 74 HB2 LYS 74 1.832 12.094 2.246 1308 HB3 LYS 74 HB3 LYS 74 1.536 10.726 1.185 1309 HG2 LYS 74 HG2 LYS 74 3.733 9.817 1.728 1310 HG3 LYS 74 HG3 LYS 74 4.050 11.198 2.775 1311 HD2 LYS 74 HD2 LYS 74 1.637 9.475 3.199 1312 HD3 LYS 74 HD3 LYS 74 3.207 8.989 3.828 1313 HE2 LYS 74 HE2 LYS 74 1.913 11.644 4.409 1314 HE3 LYS 74 HE3 LYS 74 1.768 10.229 5.450 1315 HZ1 LYS 74 HZ1 LYS 74 4.048 10.287 5.933 1316 HZ2 LYS 74 HZ2 LYS 74 3.546 11.896 6.034 1317 HZ3 LYS 74 HZ3 LYS 74 4.390 11.361 4.676 1318 H GLU 75 H GLU 75 5.378 11.643 0.081 1319 HA GLU 75 HA GLU 75 6.520 13.333 2.024 1320 HB2 GLU 75 HB2 GLU 75 7.601 11.294 1.139 1321 HB3 GLU 75 HB3 GLU 75 7.802 12.088 -0.416 1322 HG2 GLU 75 HG2 GLU 75 9.849 12.049 0.964 1323 HG3 GLU 75 HG3 GLU 75 9.328 13.669 0.507 1324 H GLU 76 H GLU 76 6.063 13.684 -1.484 1325 HA GLU 76 HA GLU 76 7.386 16.218 -1.567 1326 HB2 GLU 76 HB2 GLU 76 6.724 16.359 -3.853 1327 HB3 GLU 76 HB3 GLU 76 7.172 14.690 -3.541 1328 HG2 GLU 76 HG2 GLU 76 4.853 14.038 -3.446 1329 HG3 GLU 76 HG3 GLU 76 4.343 15.719 -3.610 1330 H TYR 77 H TYR 77 4.178 15.128 -0.923 1331 HA TYR 77 HA TYR 77 2.716 17.466 -1.390 1332 HB2 TYR 77 HB2 TYR 77 1.356 15.639 -1.014 1333 HB3 TYR 77 HB3 TYR 77 2.362 15.023 0.284 1334 HD1 TYR 77 HD2 TYR 77 0.664 18.348 -0.045 1335 HD2 TYR 77 HD1 TYR 77 0.936 14.663 2.062 1336 HE1 TYR 77 HE2 TYR 77 -0.962 19.177 1.605 1337 HE2 TYR 77 HE1 TYR 77 -0.689 15.483 3.715 1338 HH TYR 77 HH TYR 77 -1.766 17.296 4.489 1339 H GLN 78 H GLN 78 4.168 16.301 1.658 1340 HA GLN 78 HA GLN 78 3.604 18.737 3.030 1341 HB2 GLN 78 HB2 GLN 78 4.980 17.828 4.841 1342 HB3 GLN 78 HB3 GLN 78 3.824 16.640 4.252 1343 HG2 GLN 78 HG2 GLN 78 5.542 15.460 3.073 1344 HG3 GLN 78 HG3 GLN 78 6.717 16.726 3.427 1345 HE21 GLN 78 HE21 GLN 78 7.682 16.794 5.408 1346 HE22 GLN 78 HE22 GLN 78 7.515 15.542 6.583 1347 H ARG 79 H ARG 79 6.053 17.756 0.882 1348 HA ARG 79 HA ARG 79 8.116 19.494 1.834 1349 HB2 ARG 79 HB2 ARG 79 8.221 17.354 0.287 1350 HB3 ARG 79 HB3 ARG 79 8.030 18.543 -0.995 1351 HG2 ARG 79 HG2 ARG 79 10.030 19.691 -0.281 1352 HG3 ARG 79 HG3 ARG 79 10.196 18.593 1.093 1353 HD2 ARG 79 HD2 ARG 79 11.695 17.848 -0.612 1354 HD3 ARG 79 HD3 ARG 79 10.355 16.706 -0.543 1355 HE ARG 79 HE ARG 79 10.048 18.821 -2.488 1356 HH11 ARG 79 HH11 ARG 79 11.163 15.554 -1.884 1357 HH12 ARG 79 HH12 ARG 79 11.151 15.103 -3.558 1358 HH21 ARG 79 HH21 ARG 79 10.026 18.217 -4.700 1359 HH22 ARG 79 HH22 ARG 79 10.518 16.613 -5.156 1360 H LEU 80 H LEU 80 5.960 19.614 -1.029 1361 HA LEU 80 HA LEU 80 6.785 22.196 -1.823 1362 HB2 LEU 80 HB2 LEU 80 4.951 22.191 -3.345 1363 HB3 LEU 80 HB3 LEU 80 5.617 20.573 -3.294 1364 HG LEU 80 HG LEU 80 3.611 20.411 -1.421 1365 HD11 LEU 80 HD11 LEU 80 2.812 22.662 -2.050 1366 HD12 LEU 80 HD12 LEU 80 1.624 21.397 -2.367 1367 HD13 LEU 80 HD13 LEU 80 2.554 22.087 -3.698 1368 HD21 LEU 80 HD21 LEU 80 3.543 19.792 -4.371 1369 HD22 LEU 80 HD22 LEU 80 2.356 19.219 -3.202 1370 HD23 LEU 80 HD23 LEU 80 4.041 18.719 -3.062 1371 H ARG 81 H ARG 81 4.329 21.074 0.400 1372 HA ARG 81 HA ARG 81 2.977 23.545 0.692 1373 HB2 ARG 81 HB2 ARG 81 3.165 21.078 2.414 1374 HB3 ARG 81 HB3 ARG 81 2.243 22.487 2.919 1375 HG2 ARG 81 HG2 ARG 81 1.674 21.475 0.210 1376 HG3 ARG 81 HG3 ARG 81 1.193 20.437 1.554 1377 HD2 ARG 81 HD2 ARG 81 0.444 23.341 1.241 1378 HD3 ARG 81 HD3 ARG 81 -0.600 21.974 0.854 1379 HE ARG 81 HE ARG 81 -0.082 21.431 3.377 1380 HH11 ARG 81 HH11 ARG 81 -0.850 24.513 1.912 1381 HH12 ARG 81 HH12 ARG 81 -1.581 25.156 3.347 1382 HH21 ARG 81 HH21 ARG 81 -1.027 22.263 5.265 1383 HH22 ARG 81 HH22 ARG 81 -1.673 23.874 5.271 1384 H GLU 82 H GLU 82 5.831 22.158 2.160 1385 HA GLU 82 HA GLU 82 5.992 24.165 4.212 1386 HB2 GLU 82 HB2 GLU 82 7.512 22.803 5.147 1387 HB3 GLU 82 HB3 GLU 82 7.043 21.645 3.918 1388 HG2 GLU 82 HG2 GLU 82 9.206 21.570 3.416 1389 HG3 GLU 82 HG3 GLU 82 8.946 23.121 2.621 1390 H GLN 83 H GLN 83 7.210 23.685 1.001 1391 HA GLN 83 HA GLN 83 9.235 25.685 1.080 1392 HB2 GLN 83 HB2 GLN 83 8.562 23.724 -0.708 1393 HB3 GLN 83 HB3 GLN 83 7.986 25.163 -1.533 1394 HG2 GLN 83 HG2 GLN 83 10.178 26.159 -1.412 1395 HG3 GLN 83 HG3 GLN 83 10.780 24.781 -0.488 1396 HE21 GLN 83 HE21 GLN 83 12.340 24.290 -2.020 1397 HE22 GLN 83 HE22 GLN 83 11.943 23.598 -3.553 1398 H LEU 84 H LEU 84 5.853 25.815 0.932 1399 HA LEU 84 HA LEU 84 5.734 28.389 -0.385 1400 HB2 LEU 84 HB2 LEU 84 3.830 26.326 0.376 1401 HB3 LEU 84 HB3 LEU 84 3.256 27.927 0.788 1402 HG LEU 84 HG LEU 84 2.444 27.226 -1.413 1403 HD11 LEU 84 HD11 LEU 84 2.841 29.221 -2.548 1404 HD12 LEU 84 HD12 LEU 84 4.478 29.369 -1.917 1405 HD13 LEU 84 HD13 LEU 84 3.097 29.648 -0.856 1406 HD21 LEU 84 HD21 LEU 84 4.152 27.127 -3.288 1407 HD22 LEU 84 HD22 LEU 84 4.104 25.739 -2.203 1408 HD23 LEU 84 HD23 LEU 84 5.377 26.949 -2.034 1409 H LYS 85 H LYS 85 6.254 27.270 2.773 1410 HA LYS 85 HA LYS 85 5.341 29.833 3.877 1411 HB2 LYS 85 HB2 LYS 85 5.341 28.814 6.067 1412 HB3 LYS 85 HB3 LYS 85 4.409 27.822 4.959 1413 HG2 LYS 85 HG2 LYS 85 6.291 26.273 4.763 1414 HG3 LYS 85 HG3 LYS 85 7.227 27.279 5.868 1415 HD2 LYS 85 HD2 LYS 85 5.762 26.799 7.677 1416 HD3 LYS 85 HD3 LYS 85 4.574 26.054 6.609 1417 HE2 LYS 85 HE2 LYS 85 5.813 24.368 7.849 1418 HE3 LYS 85 HE3 LYS 85 6.138 24.239 6.123 1419 HZ1 LYS 85 HZ1 LYS 85 8.291 24.795 6.398 1420 HZ2 LYS 85 HZ2 LYS 85 8.035 24.245 7.977 1421 HZ3 LYS 85 HZ3 LYS 85 7.973 25.901 7.645 1422 H LYS 86 H LYS 86 8.121 28.066 3.037 1423 HA LYS 86 HA LYS 86 9.814 30.233 3.830 1424 HB2 LYS 86 HB2 LYS 86 11.388 28.813 5.155 1425 HB3 LYS 86 HB3 LYS 86 9.852 29.118 5.950 1426 HG2 LYS 86 HG2 LYS 86 9.324 26.952 6.014 1427 HG3 LYS 86 HG3 LYS 86 9.883 26.667 4.365 1428 HD2 LYS 86 HD2 LYS 86 11.763 27.029 6.689 1429 HD3 LYS 86 HD3 LYS 86 11.132 25.453 6.209 1430 HE2 LYS 86 HE2 LYS 86 12.763 27.329 4.494 1431 HE3 LYS 86 HE3 LYS 86 13.332 25.836 5.237 1432 HZ1 LYS 86 HZ1 LYS 86 11.307 26.119 3.087 1433 HZ2 LYS 86 HZ2 LYS 86 11.605 24.658 3.905 1434 HZ3 LYS 86 HZ3 LYS 86 12.828 25.380 2.977 Start of MODEL 18 1 H1 GLY 1 H1 GLY 1 29.434 -4.302 -16.955 2 H2 GLY 1 H2 GLY 1 28.467 -3.037 -17.512 3 H3 GLY 1 H3 GLY 1 28.782 -3.191 -15.861 4 HA2 GLY 1 HA3 GLY 1 31.125 -2.744 -16.235 5 HA3 GLY 1 HA2 GLY 1 30.790 -2.585 -17.956 6 H SER 2 H SER 2 30.311 -1.163 -14.793 7 HA SER 2 HA SER 2 30.127 1.464 -15.989 8 HB2 SER 2 HB2 SER 2 28.049 1.829 -14.363 9 HB3 SER 2 HB3 SER 2 27.830 1.251 -16.016 10 HG SER 2 HG SER 2 28.130 -0.474 -13.777 11 H HIS 3 H HIS 3 30.179 3.178 -14.280 12 HA HIS 3 HA HIS 3 31.627 2.194 -11.907 13 HB2 HIS 3 HB2 HIS 3 32.753 3.705 -13.777 14 HB3 HIS 3 HB3 HIS 3 31.959 4.998 -12.883 15 HD1 HIS 3 HD1 HIS 3 33.204 5.880 -10.904 16 HD2 HIS 3 HD2 HIS 3 34.540 2.119 -12.062 17 HE1 HIS 3 HE1 HIS 3 35.202 5.394 -9.461 18 HE2 HIS 3 HE2 HIS 3 36.090 3.193 -10.297 19 H MET 4 H MET 4 30.987 2.913 -9.915 20 HA MET 4 HA MET 4 28.395 4.167 -9.778 21 HB2 MET 4 HB2 MET 4 29.088 2.268 -8.293 22 HB3 MET 4 HB3 MET 4 30.211 3.364 -7.497 23 HG2 MET 4 HG2 MET 4 28.396 4.743 -6.731 24 HG3 MET 4 HG3 MET 4 27.233 3.774 -7.634 25 HE1 MET 4 HE1 MET 4 27.937 0.798 -7.144 26 HE2 MET 4 HE2 MET 4 26.335 1.512 -6.959 27 HE3 MET 4 HE3 MET 4 26.995 0.485 -5.685 28 H THR 5 H THR 5 29.158 6.170 -10.784 29 HA THR 5 HA THR 5 30.903 7.913 -9.321 30 HB THR 5 HB THR 5 28.997 8.616 -11.562 31 HG1 THR 5 HG1 THR 5 31.760 7.972 -11.800 32 HG21 THR 5 HG21 THR 5 30.632 10.429 -11.998 33 HG22 THR 5 HG22 THR 5 31.482 9.976 -10.523 34 HG23 THR 5 HG23 THR 5 29.831 10.583 -10.435 35 H GLU 6 H GLU 6 27.404 7.614 -9.750 36 HA GLU 6 HA GLU 6 27.047 9.584 -7.591 37 HB2 GLU 6 HB2 GLU 6 25.050 8.980 -9.776 38 HB3 GLU 6 HB3 GLU 6 24.971 10.272 -8.588 39 HG2 GLU 6 HG2 GLU 6 27.071 11.197 -9.629 40 HG3 GLU 6 HG3 GLU 6 26.840 10.021 -10.922 41 H GLN 7 H GLN 7 24.566 9.236 -6.816 42 HA GLN 7 HA GLN 7 24.475 6.438 -5.939 43 HB2 GLN 7 HB2 GLN 7 24.017 8.975 -4.620 44 HB3 GLN 7 HB3 GLN 7 22.627 7.912 -4.436 45 HG2 GLN 7 HG2 GLN 7 24.068 6.172 -3.525 46 HG3 GLN 7 HG3 GLN 7 25.473 7.216 -3.740 47 HE21 GLN 7 HE21 GLN 7 24.339 6.025 -1.310 48 HE22 GLN 7 HE22 GLN 7 24.022 7.352 -0.247 49 HA PRO 8 HA PRO 8 20.850 6.439 -8.639 50 HB2 PRO 8 HB2 PRO 8 21.025 3.878 -9.396 51 HB3 PRO 8 HB3 PRO 8 22.143 5.091 -10.029 52 HG2 PRO 8 HG2 PRO 8 22.566 3.047 -7.894 53 HG3 PRO 8 HG3 PRO 8 23.678 3.589 -9.164 54 HD2 PRO 8 HD2 PRO 8 23.697 4.461 -6.523 55 HD3 PRO 8 HD3 PRO 8 24.449 5.310 -7.888 56 H LYS 9 H LYS 9 19.048 4.534 -8.753 57 HA LYS 9 HA LYS 9 17.859 4.479 -6.169 58 HB2 LYS 9 HB2 LYS 9 17.067 2.922 -8.638 59 HB3 LYS 9 HB3 LYS 9 16.060 3.214 -7.228 60 HG2 LYS 9 HG2 LYS 9 16.192 5.661 -7.732 61 HG3 LYS 9 HG3 LYS 9 17.015 5.248 -9.236 62 HD2 LYS 9 HD2 LYS 9 15.028 3.798 -9.791 63 HD3 LYS 9 HD3 LYS 9 14.214 4.525 -8.407 64 HE2 LYS 9 HE2 LYS 9 15.318 6.031 -10.773 65 HE3 LYS 9 HE3 LYS 9 13.624 5.621 -10.523 66 HZ1 LYS 9 HZ1 LYS 9 15.285 7.449 -8.883 67 HZ2 LYS 9 HZ2 LYS 9 13.747 6.924 -8.420 68 HZ3 LYS 9 HZ3 LYS 9 13.938 7.846 -9.822 69 H THR 10 H THR 10 19.241 3.395 -4.805 70 HA THR 10 HA THR 10 20.270 0.802 -5.383 71 HB THR 10 HB THR 10 21.352 2.499 -3.863 72 HG1 THR 10 HG1 THR 10 21.145 0.274 -2.247 73 HG21 THR 10 HG21 THR 10 19.231 1.547 -1.933 74 HG22 THR 10 HG22 THR 10 19.408 3.183 -2.568 75 HG23 THR 10 HG23 THR 10 20.643 2.512 -1.503 76 H ARG 11 H ARG 11 19.839 -1.112 -4.149 77 HA ARG 11 HA ARG 11 16.998 -1.377 -3.520 78 HB2 ARG 11 HB2 ARG 11 17.473 -3.853 -3.655 79 HB3 ARG 11 HB3 ARG 11 17.632 -2.966 -5.162 80 HG2 ARG 11 HG2 ARG 11 19.999 -3.046 -5.059 81 HG3 ARG 11 HG3 ARG 11 19.973 -3.649 -3.400 82 HD2 ARG 11 HD2 ARG 11 19.366 -5.768 -4.044 83 HD3 ARG 11 HD3 ARG 11 18.576 -5.206 -5.515 84 HE ARG 11 HE ARG 11 21.509 -5.288 -5.192 85 HH11 ARG 11 HH11 ARG 11 18.611 -5.854 -7.073 86 HH12 ARG 11 HH12 ARG 11 19.475 -6.313 -8.503 87 HH21 ARG 11 HH21 ARG 11 22.650 -5.918 -7.082 88 HH22 ARG 11 HH22 ARG 11 21.761 -6.352 -8.510 89 H VAL 12 H VAL 12 16.295 -2.162 -1.588 90 HA VAL 12 HA VAL 12 18.344 -2.375 0.516 91 HB VAL 12 HB VAL 12 16.968 -0.326 0.721 92 HG11 VAL 12 HG11 VAL 12 14.573 -0.635 1.472 93 HG12 VAL 12 HG12 VAL 12 14.695 -2.285 0.860 94 HG13 VAL 12 HG13 VAL 12 14.900 -0.920 -0.238 95 HG21 VAL 12 HG21 VAL 12 16.232 -0.690 3.079 96 HG22 VAL 12 HG22 VAL 12 17.881 -1.213 2.740 97 HG23 VAL 12 HG23 VAL 12 16.589 -2.405 2.867 98 H SER 13 H SER 13 18.139 -4.020 2.008 99 HA SER 13 HA SER 13 16.170 -6.090 1.315 100 HB2 SER 13 HB2 SER 13 18.768 -6.464 2.823 101 HB3 SER 13 HB3 SER 13 17.730 -7.725 2.153 102 HG SER 13 HG SER 13 18.802 -5.746 0.464 103 H VAL 14 H VAL 14 14.462 -5.763 2.617 104 HA VAL 14 HA VAL 14 14.961 -5.183 5.455 105 HB VAL 14 HB VAL 14 12.604 -4.538 5.609 106 HG11 VAL 14 HG11 VAL 14 14.073 -3.160 3.369 107 HG12 VAL 14 HG12 VAL 14 14.232 -2.820 5.092 108 HG13 VAL 14 HG13 VAL 14 12.709 -2.489 4.263 109 HG21 VAL 14 HG21 VAL 14 12.348 -4.733 2.630 110 HG22 VAL 14 HG22 VAL 14 11.084 -4.571 3.850 111 HG23 VAL 14 HG23 VAL 14 11.944 -6.100 3.668 112 H ARG 15 H ARG 15 13.194 -6.181 6.926 113 HA ARG 15 HA ARG 15 12.702 -8.949 6.078 114 HB2 ARG 15 HB2 ARG 15 14.602 -8.391 7.871 115 HB3 ARG 15 HB3 ARG 15 13.221 -8.397 8.960 116 HG2 ARG 15 HG2 ARG 15 12.651 -10.672 8.018 117 HG3 ARG 15 HG3 ARG 15 14.238 -10.649 7.246 118 HD2 ARG 15 HD2 ARG 15 14.630 -11.776 9.235 119 HD3 ARG 15 HD3 ARG 15 15.133 -10.127 9.604 120 HE ARG 15 HE ARG 15 12.622 -10.059 10.447 121 HH11 ARG 15 HH11 ARG 15 15.048 -12.536 10.903 122 HH12 ARG 15 HH12 ARG 15 14.421 -13.056 12.432 123 HH21 ARG 15 HH21 ARG 15 11.767 -10.761 12.455 124 HH22 ARG 15 HH22 ARG 15 12.555 -12.044 13.315 125 H ILE 16 H ILE 16 10.619 -9.415 6.091 126 HA ILE 16 HA ILE 16 8.880 -8.153 8.104 127 HB ILE 16 HB ILE 16 8.103 -8.621 5.214 128 HG12 ILE 16 HG12 ILE 16 8.379 -5.943 6.551 129 HG13 ILE 16 HG13 ILE 16 9.738 -6.704 5.732 130 HG21 ILE 16 HG21 ILE 16 6.308 -8.849 6.948 131 HG22 ILE 16 HG22 ILE 16 6.023 -7.607 5.730 132 HG23 ILE 16 HG23 ILE 16 6.575 -7.150 7.342 133 HD11 ILE 16 HD11 ILE 16 8.466 -6.746 3.656 134 HD12 ILE 16 HD12 ILE 16 8.618 -5.108 4.292 135 HD13 ILE 16 HD13 ILE 16 7.102 -5.987 4.476 136 H TYR 17 H TYR 17 7.623 -9.571 9.176 137 HA TYR 17 HA TYR 17 6.660 -11.509 9.846 138 HB2 TYR 17 HB2 TYR 17 6.013 -11.247 7.127 139 HB3 TYR 17 HB3 TYR 17 6.480 -12.931 7.341 140 HD1 TYR 17 HD1 TYR 17 4.613 -10.512 9.498 141 HD2 TYR 17 HD2 TYR 17 4.599 -14.252 7.481 142 HE1 TYR 17 HE1 TYR 17 2.395 -11.001 10.437 143 HE2 TYR 17 HE2 TYR 17 2.379 -14.755 8.413 144 HH TYR 17 HH TYR 17 0.451 -12.388 9.957 145 H GLY 18 H GLY 18 9.594 -11.318 9.545 146 HA2 GLY 18 HA2 GLY 18 11.258 -12.779 10.258 147 HA3 GLY 18 HA3 GLY 18 10.141 -14.115 10.038 148 H GLN 19 H GLN 19 10.125 -12.292 7.249 149 HA GLN 19 HA GLN 19 12.245 -13.961 6.065 150 HB2 GLN 19 HB2 GLN 19 9.436 -13.602 5.287 151 HB3 GLN 19 HB3 GLN 19 10.570 -13.397 3.959 152 HG2 GLN 19 HG2 GLN 19 11.564 -15.610 4.590 153 HG3 GLN 19 HG3 GLN 19 10.226 -15.807 5.720 154 HE21 GLN 19 HE21 GLN 19 8.332 -14.464 3.927 155 HE22 GLN 19 HE22 GLN 19 7.977 -15.609 2.683 156 H ASP 20 H ASP 20 13.496 -13.035 4.438 157 HA ASP 20 HA ASP 20 13.703 -10.147 4.609 158 HB2 ASP 20 HB2 ASP 20 15.826 -10.371 3.563 159 HB3 ASP 20 HB3 ASP 20 15.695 -11.736 4.667 160 H TYR 21 H TYR 21 13.513 -8.722 2.896 161 HA TYR 21 HA TYR 21 12.558 -9.778 0.332 162 HB2 TYR 21 HB2 TYR 21 11.150 -7.600 1.893 163 HB3 TYR 21 HB3 TYR 21 10.740 -8.110 0.257 164 HD1 TYR 21 HD1 TYR 21 9.894 -10.466 -0.106 165 HD2 TYR 21 HD2 TYR 21 10.341 -8.759 3.763 166 HE1 TYR 21 HE1 TYR 21 8.429 -12.197 0.827 167 HE2 TYR 21 HE2 TYR 21 8.883 -10.505 4.702 168 HH TYR 21 HH TYR 21 7.153 -12.026 3.996 169 H THR 22 H THR 22 13.643 -8.876 -1.295 170 HA THR 22 HA THR 22 15.225 -6.484 -0.804 171 HB THR 22 HB THR 22 15.286 -7.846 -3.446 172 HG1 THR 22 HG1 THR 22 16.398 -9.018 -1.087 173 HG21 THR 22 HG21 THR 22 16.802 -6.002 -2.946 174 HG22 THR 22 HG22 THR 22 17.707 -7.502 -3.151 175 HG23 THR 22 HG23 THR 22 17.411 -6.865 -1.533 176 H ILE 23 H ILE 23 14.357 -4.568 -1.252 177 HA ILE 23 HA ILE 23 12.658 -4.316 -3.643 178 HB ILE 23 HB ILE 23 11.344 -2.555 -2.387 179 HG12 ILE 23 HG12 ILE 23 12.609 -3.903 0.011 180 HG13 ILE 23 HG13 ILE 23 12.954 -2.264 -0.531 181 HG21 ILE 23 HG21 ILE 23 9.814 -4.151 -1.437 182 HG22 ILE 23 HG22 ILE 23 11.090 -5.359 -1.304 183 HG23 ILE 23 HG23 ILE 23 10.522 -4.849 -2.893 184 HD11 ILE 23 HD11 ILE 23 10.521 -3.358 0.783 185 HD12 ILE 23 HD12 ILE 23 10.401 -1.918 -0.232 186 HD13 ILE 23 HD13 ILE 23 11.465 -1.922 1.178 187 H VAL 24 H VAL 24 12.317 -1.782 -3.995 188 HA VAL 24 HA VAL 24 15.030 -0.709 -4.181 189 HB VAL 24 HB VAL 24 12.489 0.143 -5.579 190 HG11 VAL 24 HG11 VAL 24 13.950 1.550 -6.975 191 HG12 VAL 24 HG12 VAL 24 15.318 1.133 -5.939 192 HG13 VAL 24 HG13 VAL 24 13.962 2.050 -5.284 193 HG21 VAL 24 HG21 VAL 24 13.610 -0.763 -7.592 194 HG22 VAL 24 HG22 VAL 24 13.268 -1.996 -6.378 195 HG23 VAL 24 HG23 VAL 24 14.907 -1.369 -6.560 196 H GLY 25 H GLY 25 15.697 0.980 -3.005 197 HA2 GLY 25 HA2 GLY 25 13.647 2.607 -1.626 198 HA3 GLY 25 HA3 GLY 25 15.113 2.068 -0.817 199 H ALA 26 H ALA 26 13.815 4.169 -3.299 200 HA ALA 26 HA ALA 26 16.404 5.534 -3.515 201 HB1 ALA 26 HB1 ALA 26 15.347 4.745 -5.598 202 HB2 ALA 26 HB2 ALA 26 15.595 6.490 -5.569 203 HB3 ALA 26 HB3 ALA 26 13.987 5.823 -5.285 204 H GLU 27 H GLU 27 13.964 5.820 -1.498 205 HA GLU 27 HA GLU 27 13.693 8.718 -1.789 206 HB2 GLU 27 HB2 GLU 27 11.589 7.489 -1.650 207 HB3 GLU 27 HB3 GLU 27 12.051 6.805 -0.105 208 HG2 GLU 27 HG2 GLU 27 12.220 9.678 -0.041 209 HG3 GLU 27 HG3 GLU 27 10.626 9.148 -0.577 210 H SER 28 H SER 28 13.535 6.889 1.278 211 HA SER 28 HA SER 28 16.010 8.181 2.123 212 HB2 SER 28 HB2 SER 28 13.502 8.278 3.810 213 HB3 SER 28 HB3 SER 28 15.046 9.058 4.146 214 HG SER 28 HG SER 28 12.977 9.830 2.473 215 HA PRO 29 HA PRO 29 16.914 4.021 3.441 216 HB2 PRO 29 HB2 PRO 29 18.607 5.544 5.373 217 HB3 PRO 29 HB3 PRO 29 19.028 4.167 4.347 218 HG2 PRO 29 HG2 PRO 29 19.788 6.621 3.676 219 HG3 PRO 29 HG3 PRO 29 19.225 5.479 2.441 220 HD2 PRO 29 HD2 PRO 29 17.836 7.834 3.627 221 HD3 PRO 29 HD3 PRO 29 17.751 7.180 1.981 222 H ALA 30 H ALA 30 16.466 6.495 5.994 223 HA ALA 30 HA ALA 30 15.774 4.567 7.981 224 HB1 ALA 30 HB1 ALA 30 15.188 6.475 9.368 225 HB2 ALA 30 HB2 ALA 30 15.243 7.539 7.963 226 HB3 ALA 30 HB3 ALA 30 16.719 6.766 8.543 227 H HIS 31 H HIS 31 13.951 6.547 5.737 228 HA HIS 31 HA HIS 31 11.397 6.083 6.895 229 HB2 HIS 31 HB2 HIS 31 12.176 7.928 5.233 230 HB3 HIS 31 HB3 HIS 31 11.796 6.740 3.994 231 HD1 HIS 31 HD1 HIS 31 9.687 7.535 2.983 232 HD2 HIS 31 HD2 HIS 31 9.608 7.753 7.141 233 HE1 HIS 31 HE1 HIS 31 7.358 8.296 3.588 234 HE2 HIS 31 HE2 HIS 31 7.452 8.694 6.074 235 H ILE 32 H ILE 32 13.159 4.572 4.197 236 HA ILE 32 HA ILE 32 11.065 2.787 3.493 237 HB ILE 32 HB ILE 32 12.695 1.577 2.161 238 HG12 ILE 32 HG12 ILE 32 14.776 3.296 3.542 239 HG13 ILE 32 HG13 ILE 32 14.568 1.564 3.746 240 HG21 ILE 32 HG21 ILE 32 13.269 4.527 1.950 241 HG22 ILE 32 HG22 ILE 32 11.768 3.775 1.412 242 HG23 ILE 32 HG23 ILE 32 13.296 3.328 0.655 243 HD11 ILE 32 HD11 ILE 32 16.403 1.843 2.322 244 HD12 ILE 32 HD12 ILE 32 15.571 3.047 1.344 245 HD13 ILE 32 HD13 ILE 32 15.069 1.358 1.278 246 H ARG 33 H ARG 33 13.389 2.777 6.006 247 HA ARG 33 HA ARG 33 13.338 -0.049 6.507 248 HB2 ARG 33 HB2 ARG 33 15.044 1.905 7.251 249 HB3 ARG 33 HB3 ARG 33 14.042 1.832 8.695 250 HG2 ARG 33 HG2 ARG 33 15.765 0.364 9.170 251 HG3 ARG 33 HG3 ARG 33 14.477 -0.703 8.607 252 HD2 ARG 33 HD2 ARG 33 15.538 -0.505 6.300 253 HD3 ARG 33 HD3 ARG 33 16.927 0.207 7.120 254 HE ARG 33 HE ARG 33 16.304 -2.197 8.398 255 HH11 ARG 33 HH11 ARG 33 17.584 -1.051 5.346 256 HH12 ARG 33 HH12 ARG 33 18.421 -2.531 4.998 257 HH21 ARG 33 HH21 ARG 33 17.411 -4.142 7.942 258 HH22 ARG 33 HH22 ARG 33 18.317 -4.291 6.468 259 H LEU 34 H LEU 34 11.398 2.661 7.261 260 HA LEU 34 HA LEU 34 10.073 1.496 9.544 261 HB2 LEU 34 HB2 LEU 34 10.432 3.965 9.187 262 HB3 LEU 34 HB3 LEU 34 9.246 3.889 7.901 263 HG LEU 34 HG LEU 34 7.705 2.893 9.780 264 HD11 LEU 34 HD11 LEU 34 9.448 2.742 11.475 265 HD12 LEU 34 HD12 LEU 34 8.175 3.858 11.972 266 HD13 LEU 34 HD13 LEU 34 9.712 4.481 11.370 267 HD21 LEU 34 HD21 LEU 34 8.439 5.798 9.479 268 HD22 LEU 34 HD22 LEU 34 7.020 5.222 10.354 269 HD23 LEU 34 HD23 LEU 34 7.175 4.914 8.625 270 H VAL 35 H VAL 35 9.634 1.662 6.110 271 HA VAL 35 HA VAL 35 6.904 1.130 5.863 272 HB VAL 35 HB VAL 35 9.083 0.091 4.041 273 HG11 VAL 35 HG11 VAL 35 7.315 0.286 2.310 274 HG12 VAL 35 HG12 VAL 35 6.159 0.660 3.589 275 HG13 VAL 35 HG13 VAL 35 6.961 -0.910 3.556 276 HG21 VAL 35 HG21 VAL 35 9.165 2.581 4.553 277 HG22 VAL 35 HG22 VAL 35 7.619 2.695 3.715 278 HG23 VAL 35 HG23 VAL 35 9.044 2.126 2.854 279 H ALA 36 H ALA 36 9.645 -1.063 6.208 280 HA ALA 36 HA ALA 36 8.322 -3.490 5.865 281 HB1 ALA 36 HB1 ALA 36 10.194 -4.498 7.018 282 HB2 ALA 36 HB2 ALA 36 10.661 -2.929 7.677 283 HB3 ALA 36 HB3 ALA 36 10.762 -3.220 5.941 284 H ALA 37 H ALA 37 8.791 -1.558 8.792 285 HA ALA 37 HA ALA 37 7.640 -3.421 10.580 286 HB1 ALA 37 HB1 ALA 37 7.917 -0.433 10.857 287 HB2 ALA 37 HB2 ALA 37 9.118 -1.634 11.328 288 HB3 ALA 37 HB3 ALA 37 7.567 -1.565 12.163 289 H PHE 38 H PHE 38 6.308 -0.806 8.643 290 HA PHE 38 HA PHE 38 3.757 -0.712 9.851 291 HB2 PHE 38 HB2 PHE 38 4.821 0.975 8.235 292 HB3 PHE 38 HB3 PHE 38 4.295 -0.103 6.948 293 HD1 PHE 38 HD2 PHE 38 3.192 2.167 9.602 294 HD2 PHE 38 HD1 PHE 38 1.986 -0.271 6.328 295 HE1 PHE 38 HE2 PHE 38 0.980 3.242 9.623 296 HE2 PHE 38 HE1 PHE 38 -0.229 0.802 6.341 297 HZ PHE 38 HZ PHE 38 -0.735 2.558 7.993 298 H VAL 39 H VAL 39 4.999 -2.493 7.050 299 HA VAL 39 HA VAL 39 2.517 -3.743 6.429 300 HB VAL 39 HB VAL 39 5.309 -4.625 5.675 301 HG11 VAL 39 HG11 VAL 39 3.641 -6.391 5.390 302 HG12 VAL 39 HG12 VAL 39 4.222 -5.805 3.834 303 HG13 VAL 39 HG13 VAL 39 2.642 -5.302 4.432 304 HG21 VAL 39 HG21 VAL 39 3.669 -3.314 3.649 305 HG22 VAL 39 HG22 VAL 39 5.356 -3.047 4.090 306 HG23 VAL 39 HG23 VAL 39 4.072 -2.267 5.009 307 H ASP 40 H ASP 40 5.398 -4.771 8.220 308 HA ASP 40 HA ASP 40 4.655 -7.403 8.764 309 HB2 ASP 40 HB2 ASP 40 6.900 -6.509 9.221 310 HB3 ASP 40 HB3 ASP 40 6.244 -5.499 10.501 311 H ASP 41 H ASP 41 3.814 -4.405 10.381 312 HA ASP 41 HA ASP 41 2.523 -5.535 12.629 313 HB2 ASP 41 HB2 ASP 41 3.308 -3.150 12.383 314 HB3 ASP 41 HB3 ASP 41 1.920 -2.870 11.337 315 H LYS 42 H LYS 42 1.271 -4.271 9.558 316 HA LYS 42 HA LYS 42 -1.440 -4.755 10.034 317 HB2 LYS 42 HB2 LYS 42 0.193 -4.482 7.531 318 HB3 LYS 42 HB3 LYS 42 -1.520 -4.867 7.444 319 HG2 LYS 42 HG2 LYS 42 -1.122 -2.645 9.208 320 HG3 LYS 42 HG3 LYS 42 -0.327 -2.339 7.662 321 HD2 LYS 42 HD2 LYS 42 -2.577 -1.521 7.527 322 HD3 LYS 42 HD3 LYS 42 -2.452 -2.964 6.521 323 HE2 LYS 42 HE2 LYS 42 -4.461 -3.257 7.666 324 HE3 LYS 42 HE3 LYS 42 -3.310 -4.234 8.575 325 HZ1 LYS 42 HZ1 LYS 42 -4.484 -3.078 10.192 326 HZ2 LYS 42 HZ2 LYS 42 -4.490 -1.630 9.307 327 HZ3 LYS 42 HZ3 LYS 42 -3.061 -2.170 10.025 328 H MET 43 H MET 43 1.045 -6.810 8.582 329 HA MET 43 HA MET 43 -0.734 -8.935 7.917 330 HB2 MET 43 HB2 MET 43 2.258 -8.738 8.147 331 HB3 MET 43 HB3 MET 43 1.456 -10.255 7.767 332 HG2 MET 43 HG2 MET 43 0.397 -9.117 5.817 333 HG3 MET 43 HG3 MET 43 1.407 -7.714 6.167 334 HE1 MET 43 HE1 MET 43 1.247 -11.406 5.020 335 HE2 MET 43 HE2 MET 43 2.318 -11.597 6.409 336 HE3 MET 43 HE3 MET 43 2.941 -11.835 4.779 337 H HIS 44 H HIS 44 0.443 -7.898 10.893 338 HA HIS 44 HA HIS 44 0.415 -10.582 12.049 339 HB2 HIS 44 HB2 HIS 44 1.614 -8.007 12.787 340 HB3 HIS 44 HB3 HIS 44 0.912 -8.884 14.142 341 HD1 HIS 44 HD1 HIS 44 3.944 -8.647 12.185 342 HD2 HIS 44 HD2 HIS 44 1.978 -11.648 14.292 343 HE1 HIS 44 HE1 HIS 44 5.659 -10.452 12.560 344 HE2 HIS 44 HE2 HIS 44 4.429 -12.287 13.773 345 H GLU 45 H GLU 45 -1.625 -7.830 11.737 346 HA GLU 45 HA GLU 45 -3.258 -8.684 14.009 347 HB2 GLU 45 HB2 GLU 45 -4.593 -6.600 13.499 348 HB3 GLU 45 HB3 GLU 45 -2.938 -6.339 14.023 349 HG2 GLU 45 HG2 GLU 45 -2.239 -5.673 11.903 350 HG3 GLU 45 HG3 GLU 45 -3.618 -6.426 11.109 351 H PHE 46 H PHE 46 -3.373 -8.489 10.499 352 HA PHE 46 HA PHE 46 -6.172 -9.181 10.413 353 HB2 PHE 46 HB2 PHE 46 -4.122 -8.418 8.446 354 HB3 PHE 46 HB3 PHE 46 -5.332 -9.555 7.860 355 HD1 PHE 46 HD2 PHE 46 -7.794 -8.938 8.247 356 HD2 PHE 46 HD1 PHE 46 -4.593 -6.145 8.508 357 HE1 PHE 46 HE2 PHE 46 -9.387 -7.089 7.921 358 HE2 PHE 46 HE1 PHE 46 -6.180 -4.293 8.186 359 HZ PHE 46 HZ PHE 46 -8.578 -4.760 7.890 360 H SER 47 H SER 47 -3.271 -10.916 10.682 361 HA SER 47 HA SER 47 -3.995 -13.277 9.292 362 HB2 SER 47 HB2 SER 47 -2.252 -14.214 11.085 363 HB3 SER 47 HB3 SER 47 -1.736 -13.245 9.705 364 HG SER 47 HG SER 47 -1.472 -12.701 12.304 365 H GLU 48 H GLU 48 -4.818 -11.961 12.353 366 HA GLU 48 HA GLU 48 -5.651 -14.439 13.552 367 HB2 GLU 48 HB2 GLU 48 -6.379 -11.657 14.458 368 HB3 GLU 48 HB3 GLU 48 -6.356 -13.125 15.419 369 HG2 GLU 48 HG2 GLU 48 -3.903 -11.844 14.229 370 HG3 GLU 48 HG3 GLU 48 -4.479 -11.569 15.866 371 H LYS 49 H LYS 49 -6.950 -12.340 11.270 372 HA LYS 49 HA LYS 49 -9.724 -12.630 11.963 373 HB2 LYS 49 HB2 LYS 49 -8.325 -11.639 9.478 374 HB3 LYS 49 HB3 LYS 49 -10.076 -11.715 9.619 375 HG2 LYS 49 HG2 LYS 49 -8.315 -10.165 11.504 376 HG3 LYS 49 HG3 LYS 49 -9.071 -9.474 10.068 377 HD2 LYS 49 HD2 LYS 49 -11.275 -10.361 11.052 378 HD3 LYS 49 HD3 LYS 49 -10.375 -10.533 12.557 379 HE2 LYS 49 HE2 LYS 49 -10.577 -7.961 10.998 380 HE3 LYS 49 HE3 LYS 49 -11.647 -8.392 12.331 381 HZ1 LYS 49 HZ1 LYS 49 -9.701 -8.537 13.773 382 HZ2 LYS 49 HZ2 LYS 49 -9.858 -6.995 13.102 383 HZ3 LYS 49 HZ3 LYS 49 -8.701 -8.067 12.494 384 H GLN 50 H GLN 50 -7.416 -14.263 9.933 385 HA GLN 50 HA GLN 50 -7.500 -16.107 8.597 386 HB2 GLN 50 HB2 GLN 50 -9.501 -16.932 10.702 387 HB3 GLN 50 HB3 GLN 50 -8.699 -18.024 9.582 388 HG2 GLN 50 HG2 GLN 50 -6.706 -17.906 10.677 389 HG3 GLN 50 HG3 GLN 50 -7.012 -16.280 11.289 390 HE21 GLN 50 HE21 GLN 50 -6.075 -18.604 12.718 391 HE22 GLN 50 HE22 GLN 50 -7.221 -18.893 13.982 392 HA PRO 51 HA PRO 51 -11.490 -14.899 6.488 393 HB2 PRO 51 HB2 PRO 51 -9.849 -14.285 4.164 394 HB3 PRO 51 HB3 PRO 51 -10.944 -13.228 5.058 395 HG2 PRO 51 HG2 PRO 51 -8.237 -12.940 5.084 396 HG3 PRO 51 HG3 PRO 51 -9.281 -12.454 6.428 397 HD2 PRO 51 HD2 PRO 51 -7.585 -14.899 6.132 398 HD3 PRO 51 HD3 PRO 51 -7.880 -13.894 7.570 399 H MET 52 H MET 52 -8.851 -15.996 4.377 400 HA MET 52 HA MET 52 -10.563 -18.193 3.460 401 HB2 MET 52 HB2 MET 52 -7.937 -17.326 2.254 402 HB3 MET 52 HB3 MET 52 -9.189 -18.313 1.513 403 HG2 MET 52 HG2 MET 52 -9.354 -15.377 2.158 404 HG3 MET 52 HG3 MET 52 -9.203 -16.103 0.558 405 HE1 MET 52 HE1 MET 52 -12.664 -17.783 0.028 406 HE2 MET 52 HE2 MET 52 -11.230 -18.567 0.687 407 HE3 MET 52 HE3 MET 52 -11.073 -17.433 -0.654 408 H LEU 53 H LEU 53 -8.378 -17.698 5.779 409 HA LEU 53 HA LEU 53 -6.929 -18.944 7.005 410 HB2 LEU 53 HB2 LEU 53 -8.715 -21.049 5.819 411 HB3 LEU 53 HB3 LEU 53 -7.402 -21.476 6.899 412 HG LEU 53 HG LEU 53 -9.275 -19.385 7.848 413 HD11 LEU 53 HD11 LEU 53 -10.023 -22.297 7.689 414 HD12 LEU 53 HD12 LEU 53 -10.836 -20.958 6.882 415 HD13 LEU 53 HD13 LEU 53 -10.872 -21.080 8.642 416 HD21 LEU 53 HD21 LEU 53 -8.893 -20.518 9.975 417 HD22 LEU 53 HD22 LEU 53 -7.366 -20.112 9.185 418 HD23 LEU 53 HD23 LEU 53 -7.966 -21.771 9.148 419 H ASP 54 H ASP 54 -5.889 -18.060 4.632 420 HA ASP 54 HA ASP 54 -3.966 -20.173 4.005 421 HB2 ASP 54 HB2 ASP 54 -5.652 -20.059 2.178 422 HB3 ASP 54 HB3 ASP 54 -5.245 -18.364 1.944 423 H VAL 55 H VAL 55 -1.883 -19.424 3.595 424 HA VAL 55 HA VAL 55 -1.167 -17.045 4.928 425 HB VAL 55 HB VAL 55 0.607 -18.671 3.113 426 HG11 VAL 55 HG11 VAL 55 1.250 -16.847 5.423 427 HG12 VAL 55 HG12 VAL 55 1.542 -16.503 3.718 428 HG13 VAL 55 HG13 VAL 55 2.415 -17.813 4.519 429 HG21 VAL 55 HG21 VAL 55 1.303 -19.779 5.263 430 HG22 VAL 55 HG22 VAL 55 -0.309 -20.200 4.679 431 HG23 VAL 55 HG23 VAL 55 -0.121 -19.051 6.006 432 HA PRO 56 HA PRO 56 0.149 -15.164 0.651 433 HB2 PRO 56 HB2 PRO 56 -1.148 -16.215 -1.543 434 HB3 PRO 56 HB3 PRO 56 0.499 -16.623 -1.055 435 HG2 PRO 56 HG2 PRO 56 -2.045 -18.107 -0.578 436 HG3 PRO 56 HG3 PRO 56 -0.436 -18.733 -0.982 437 HD2 PRO 56 HD2 PRO 56 -1.414 -18.829 1.524 438 HD3 PRO 56 HD3 PRO 56 0.312 -18.571 1.200 439 H LYS 57 H LYS 57 -3.104 -16.406 1.149 440 HA LYS 57 HA LYS 57 -4.415 -14.245 -0.184 441 HB2 LYS 57 HB2 LYS 57 -5.573 -16.093 1.904 442 HB3 LYS 57 HB3 LYS 57 -6.470 -15.106 0.761 443 HG2 LYS 57 HG2 LYS 57 -4.798 -17.535 0.192 444 HG3 LYS 57 HG3 LYS 57 -6.535 -17.330 -0.033 445 HD2 LYS 57 HD2 LYS 57 -6.009 -15.568 -1.742 446 HD3 LYS 57 HD3 LYS 57 -4.312 -16.033 -1.603 447 HE2 LYS 57 HE2 LYS 57 -6.567 -17.869 -2.389 448 HE3 LYS 57 HE3 LYS 57 -5.426 -17.121 -3.502 449 HZ1 LYS 57 HZ1 LYS 57 -3.708 -18.449 -2.770 450 HZ2 LYS 57 HZ2 LYS 57 -5.012 -19.519 -2.682 451 HZ3 LYS 57 HZ3 LYS 57 -4.429 -18.783 -1.272 452 H LEU 58 H LEU 58 -2.979 -14.655 2.873 453 HA LEU 58 HA LEU 58 -4.501 -12.625 4.219 454 HB2 LEU 58 HB2 LEU 58 -3.470 -14.533 5.410 455 HB3 LEU 58 HB3 LEU 58 -1.884 -13.953 4.964 456 HG LEU 58 HG LEU 58 -2.768 -13.543 7.359 457 HD11 LEU 58 HD11 LEU 58 -0.685 -12.627 6.487 458 HD12 LEU 58 HD12 LEU 58 -1.510 -11.480 7.546 459 HD13 LEU 58 HD13 LEU 58 -1.572 -11.268 5.795 460 HD21 LEU 58 HD21 LEU 58 -4.936 -12.570 6.595 461 HD22 LEU 58 HD22 LEU 58 -4.037 -11.160 6.023 462 HD23 LEU 58 HD23 LEU 58 -4.039 -11.573 7.736 463 H ALA 59 H ALA 59 -1.308 -12.891 2.734 464 HA ALA 59 HA ALA 59 -0.346 -10.338 3.373 465 HB1 ALA 59 HB1 ALA 59 0.307 -12.073 0.996 466 HB2 ALA 59 HB2 ALA 59 1.113 -12.094 2.563 467 HB3 ALA 59 HB3 ALA 59 1.237 -10.674 1.525 468 H VAL 60 H VAL 60 -2.120 -11.469 0.508 469 HA VAL 60 HA VAL 60 -2.104 -8.952 -0.797 470 HB VAL 60 HB VAL 60 -2.526 -11.096 -1.984 471 HG11 VAL 60 HG11 VAL 60 -4.539 -12.265 -1.868 472 HG12 VAL 60 HG12 VAL 60 -5.365 -10.946 -1.042 473 HG13 VAL 60 HG13 VAL 60 -4.163 -11.906 -0.183 474 HG21 VAL 60 HG21 VAL 60 -3.064 -8.977 -3.049 475 HG22 VAL 60 HG22 VAL 60 -4.665 -8.993 -2.310 476 HG23 VAL 60 HG23 VAL 60 -4.235 -10.214 -3.508 477 H LEU 61 H LEU 61 -4.159 -10.362 1.641 478 HA LEU 61 HA LEU 61 -6.378 -8.638 1.361 479 HB2 LEU 61 HB2 LEU 61 -6.371 -10.756 2.670 480 HB3 LEU 61 HB3 LEU 61 -5.358 -9.975 3.870 481 HG LEU 61 HG LEU 61 -7.280 -8.250 4.046 482 HD11 LEU 61 HD11 LEU 61 -8.526 -8.970 2.095 483 HD12 LEU 61 HD12 LEU 61 -9.493 -9.187 3.555 484 HD13 LEU 61 HD13 LEU 61 -8.724 -10.578 2.791 485 HD21 LEU 61 HD21 LEU 61 -6.739 -9.664 5.874 486 HD22 LEU 61 HD22 LEU 61 -7.435 -11.072 5.076 487 HD23 LEU 61 HD23 LEU 61 -8.484 -9.771 5.640 488 H THR 62 H THR 62 -3.438 -8.466 3.341 489 HA THR 62 HA THR 62 -4.153 -5.981 4.536 490 HB THR 62 HB THR 62 -1.568 -5.948 4.995 491 HG1 THR 62 HG1 THR 62 -1.209 -7.691 3.420 492 HG21 THR 62 HG21 THR 62 -1.899 -7.312 6.936 493 HG22 THR 62 HG22 THR 62 -3.250 -8.152 6.180 494 HG23 THR 62 HG23 THR 62 -3.405 -6.451 6.623 495 H ALA 63 H ALA 63 -2.470 -6.939 1.646 496 HA ALA 63 HA ALA 63 -1.177 -4.518 1.040 497 HB1 ALA 63 HB1 ALA 63 -0.693 -6.687 -0.051 498 HB2 ALA 63 HB2 ALA 63 -0.959 -5.379 -1.201 499 HB3 ALA 63 HB3 ALA 63 -2.229 -6.565 -0.909 500 H VAL 64 H VAL 64 -4.358 -5.784 0.083 501 HA VAL 64 HA VAL 64 -5.028 -3.524 -1.490 502 HB VAL 64 HB VAL 64 -6.068 -5.797 -1.711 503 HG11 VAL 64 HG11 VAL 64 -7.583 -4.923 0.737 504 HG12 VAL 64 HG12 VAL 64 -6.556 -6.346 0.560 505 HG13 VAL 64 HG13 VAL 64 -8.078 -6.243 -0.321 506 HG21 VAL 64 HG21 VAL 64 -7.010 -3.984 -2.923 507 HG22 VAL 64 HG22 VAL 64 -7.837 -3.376 -1.491 508 HG23 VAL 64 HG23 VAL 64 -8.344 -4.900 -2.223 509 H GLN 65 H GLN 65 -5.336 -4.236 1.911 510 HA GLN 65 HA GLN 65 -7.214 -2.152 2.469 511 HB2 GLN 65 HB2 GLN 65 -6.583 -4.264 3.889 512 HB3 GLN 65 HB3 GLN 65 -5.310 -3.231 4.527 513 HG2 GLN 65 HG2 GLN 65 -7.833 -1.838 4.569 514 HG3 GLN 65 HG3 GLN 65 -7.969 -3.387 5.403 515 HE21 GLN 65 HE21 GLN 65 -8.223 -2.337 7.375 516 HE22 GLN 65 HE22 GLN 65 -6.898 -1.593 8.196 517 H ILE 66 H ILE 66 -3.698 -2.466 2.623 518 HA ILE 66 HA ILE 66 -3.163 0.084 3.716 519 HB ILE 66 HB ILE 66 -1.469 -1.725 1.980 520 HG12 ILE 66 HG12 ILE 66 -1.166 -1.049 4.911 521 HG13 ILE 66 HG13 ILE 66 -2.114 -2.418 4.343 522 HG21 ILE 66 HG21 ILE 66 0.413 -0.326 2.350 523 HG22 ILE 66 HG22 ILE 66 -0.474 0.680 3.496 524 HG23 ILE 66 HG23 ILE 66 -0.885 0.723 1.783 525 HD11 ILE 66 HD11 ILE 66 -0.143 -3.399 3.340 526 HD12 ILE 66 HD12 ILE 66 0.126 -3.077 5.053 527 HD13 ILE 66 HD13 ILE 66 0.825 -2.011 3.835 528 H ALA 67 H ALA 67 -3.456 -1.104 0.410 529 HA ALA 67 HA ALA 67 -2.701 1.244 -0.925 530 HB1 ALA 67 HB1 ALA 67 -3.717 0.263 -2.884 531 HB2 ALA 67 HB2 ALA 67 -4.606 -0.883 -1.881 532 HB3 ALA 67 HB3 ALA 67 -2.850 -0.977 -1.977 533 H SER 68 H SER 68 -5.901 0.134 0.182 534 HA SER 68 HA SER 68 -7.302 2.275 -1.062 535 HB2 SER 68 HB2 SER 68 -9.106 1.511 0.706 536 HB3 SER 68 HB3 SER 68 -8.711 0.497 -0.681 537 HG SER 68 HG SER 68 -7.599 -0.856 0.597 538 H GLU 69 H GLU 69 -6.319 1.693 2.319 539 HA GLU 69 HA GLU 69 -7.402 4.082 3.334 540 HB2 GLU 69 HB2 GLU 69 -5.309 2.181 4.319 541 HB3 GLU 69 HB3 GLU 69 -5.626 3.679 5.186 542 HG2 GLU 69 HG2 GLU 69 -7.734 1.631 4.534 543 HG3 GLU 69 HG3 GLU 69 -6.850 1.695 6.057 544 H TYR 70 H TYR 70 -4.506 3.524 1.536 545 HA TYR 70 HA TYR 70 -3.409 6.113 2.322 546 HB2 TYR 70 HB2 TYR 70 -2.336 3.694 1.013 547 HB3 TYR 70 HB3 TYR 70 -1.691 5.223 0.424 548 HD1 TYR 70 HD1 TYR 70 -0.406 6.682 1.902 549 HD2 TYR 70 HD2 TYR 70 -1.855 2.917 3.253 550 HE1 TYR 70 HE1 TYR 70 1.119 6.791 3.825 551 HE2 TYR 70 HE2 TYR 70 -0.333 3.017 5.183 552 HH TYR 70 HH TYR 70 1.635 4.087 5.923 553 H LEU 71 H LEU 71 -5.079 4.584 -0.316 554 HA LEU 71 HA LEU 71 -4.508 6.525 -2.302 555 HB2 LEU 71 HB2 LEU 71 -6.344 4.254 -2.016 556 HB3 LEU 71 HB3 LEU 71 -6.965 5.549 -3.020 557 HG LEU 71 HG LEU 71 -4.231 4.365 -3.485 558 HD11 LEU 71 HD11 LEU 71 -5.279 3.011 -5.288 559 HD12 LEU 71 HD12 LEU 71 -6.859 3.408 -4.616 560 HD13 LEU 71 HD13 LEU 71 -5.697 2.482 -3.660 561 HD21 LEU 71 HD21 LEU 71 -4.454 5.281 -5.689 562 HD22 LEU 71 HD22 LEU 71 -4.786 6.555 -4.516 563 HD23 LEU 71 HD23 LEU 71 -6.115 5.772 -5.371 564 H LYS 72 H LYS 72 -6.896 6.305 0.235 565 HA LYS 72 HA LYS 72 -8.493 8.488 -0.687 566 HB2 LYS 72 HB2 LYS 72 -9.651 8.298 1.411 567 HB3 LYS 72 HB3 LYS 72 -9.302 6.676 0.833 568 HG2 LYS 72 HG2 LYS 72 -7.177 6.931 2.344 569 HG3 LYS 72 HG3 LYS 72 -8.164 8.149 3.151 570 HD2 LYS 72 HD2 LYS 72 -9.097 5.330 2.629 571 HD3 LYS 72 HD3 LYS 72 -8.291 5.826 4.116 572 HE2 LYS 72 HE2 LYS 72 -10.061 7.440 4.553 573 HE3 LYS 72 HE3 LYS 72 -10.857 6.991 3.046 574 HZ1 LYS 72 HZ1 LYS 72 -10.316 4.738 4.749 575 HZ2 LYS 72 HZ2 LYS 72 -11.764 5.209 3.987 576 HZ3 LYS 72 HZ3 LYS 72 -11.332 5.888 5.475 577 H LEU 73 H LEU 73 -5.573 8.186 1.099 578 HA LEU 73 HA LEU 73 -5.705 10.752 2.371 579 HB2 LEU 73 HB2 LEU 73 -4.440 8.849 3.319 580 HB3 LEU 73 HB3 LEU 73 -3.349 8.909 1.949 581 HG LEU 73 HG LEU 73 -2.639 11.178 2.645 582 HD11 LEU 73 HD11 LEU 73 -4.550 10.643 4.901 583 HD12 LEU 73 HD12 LEU 73 -4.484 12.037 3.822 584 HD13 LEU 73 HD13 LEU 73 -3.228 11.802 5.036 585 HD21 LEU 73 HD21 LEU 73 -2.372 9.045 4.763 586 HD22 LEU 73 HD22 LEU 73 -1.336 10.459 4.589 587 HD23 LEU 73 HD23 LEU 73 -1.355 9.222 3.333 588 H LYS 74 H LYS 74 -4.206 9.387 -0.516 589 HA LYS 74 HA LYS 74 -2.786 11.763 -1.196 590 HB2 LYS 74 HB2 LYS 74 -1.902 10.549 -2.873 591 HB3 LYS 74 HB3 LYS 74 -2.651 9.189 -2.055 592 HG2 LYS 74 HG2 LYS 74 -4.552 9.290 -3.546 593 HG3 LYS 74 HG3 LYS 74 -3.896 10.735 -4.323 594 HD2 LYS 74 HD2 LYS 74 -1.855 9.329 -4.889 595 HD3 LYS 74 HD3 LYS 74 -2.803 7.928 -4.389 596 HE2 LYS 74 HE2 LYS 74 -2.965 8.163 -6.770 597 HE3 LYS 74 HE3 LYS 74 -4.527 8.555 -6.049 598 HZ1 LYS 74 HZ1 LYS 74 -2.504 10.554 -6.906 599 HZ2 LYS 74 HZ2 LYS 74 -4.051 10.887 -6.309 600 HZ3 LYS 74 HZ3 LYS 74 -3.871 10.117 -7.801 601 H GLU 75 H GLU 75 -6.030 10.699 -1.577 602 HA GLU 75 HA GLU 75 -6.755 12.431 -3.724 603 HB2 GLU 75 HB2 GLU 75 -8.035 10.390 -3.047 604 HB3 GLU 75 HB3 GLU 75 -8.522 11.229 -1.583 605 HG2 GLU 75 HG2 GLU 75 -10.337 11.427 -3.037 606 HG3 GLU 75 HG3 GLU 75 -9.527 12.991 -3.099 607 H GLU 76 H GLU 76 -6.519 12.691 -0.262 608 HA GLU 76 HA GLU 76 -7.972 15.098 0.074 609 HB2 GLU 76 HB2 GLU 76 -7.356 13.483 1.897 610 HB3 GLU 76 HB3 GLU 76 -5.695 14.047 1.768 611 HG2 GLU 76 HG2 GLU 76 -6.709 15.152 3.609 612 HG3 GLU 76 HG3 GLU 76 -6.504 16.334 2.318 613 H TYR 77 H TYR 77 -4.723 14.334 -0.890 614 HA TYR 77 HA TYR 77 -3.484 16.799 -0.431 615 HB2 TYR 77 HB2 TYR 77 -2.183 14.824 -0.948 616 HB3 TYR 77 HB3 TYR 77 -2.937 14.696 -2.532 617 HD1 TYR 77 HD2 TYR 77 -1.580 17.719 -0.845 618 HD2 TYR 77 HD1 TYR 77 -1.134 14.920 -4.020 619 HE1 TYR 77 HE2 TYR 77 0.213 19.092 -1.775 620 HE2 TYR 77 HE1 TYR 77 0.670 16.290 -4.974 621 HH TYR 77 HH TYR 77 2.414 18.221 -3.628 622 H GLN 78 H GLN 78 -4.921 15.542 -3.438 623 HA GLN 78 HA GLN 78 -4.639 18.012 -4.821 624 HB2 GLN 78 HB2 GLN 78 -6.049 16.974 -6.550 625 HB3 GLN 78 HB3 GLN 78 -4.746 15.911 -6.042 626 HG2 GLN 78 HG2 GLN 78 -6.276 14.330 -5.786 627 HG3 GLN 78 HG3 GLN 78 -6.858 15.227 -4.385 628 HE21 GLN 78 HE21 GLN 78 -8.333 13.539 -6.211 629 HE22 GLN 78 HE22 GLN 78 -9.570 14.534 -6.901 630 H ARG 79 H ARG 79 -6.897 16.833 -2.555 631 HA ARG 79 HA ARG 79 -9.160 18.358 -3.418 632 HB2 ARG 79 HB2 ARG 79 -9.041 16.253 -1.856 633 HB3 ARG 79 HB3 ARG 79 -8.770 17.440 -0.589 634 HG2 ARG 79 HG2 ARG 79 -11.090 16.949 -0.624 635 HG3 ARG 79 HG3 ARG 79 -10.884 18.566 -1.310 636 HD2 ARG 79 HD2 ARG 79 -10.674 16.687 -3.422 637 HD3 ARG 79 HD3 ARG 79 -12.104 16.274 -2.476 638 HE ARG 79 HE ARG 79 -11.877 19.075 -3.136 639 HH11 ARG 79 HH11 ARG 79 -13.030 15.946 -4.190 640 HH12 ARG 79 HH12 ARG 79 -14.253 16.603 -5.231 641 HH21 ARG 79 HH21 ARG 79 -13.461 19.961 -4.501 642 HH22 ARG 79 HH22 ARG 79 -14.507 18.901 -5.403 643 H LEU 80 H LEU 80 -6.812 18.656 -0.785 644 HA LEU 80 HA LEU 80 -7.666 21.066 0.290 645 HB2 LEU 80 HB2 LEU 80 -6.045 19.708 1.412 646 HB3 LEU 80 HB3 LEU 80 -4.919 19.852 0.074 647 HG LEU 80 HG LEU 80 -4.967 22.390 0.613 648 HD11 LEU 80 HD11 LEU 80 -5.885 21.258 3.243 649 HD12 LEU 80 HD12 LEU 80 -6.852 22.263 2.165 650 HD13 LEU 80 HD13 LEU 80 -5.407 22.927 2.927 651 HD21 LEU 80 HD21 LEU 80 -3.616 20.354 2.372 652 HD22 LEU 80 HD22 LEU 80 -3.196 22.067 2.322 653 HD23 LEU 80 HD23 LEU 80 -2.990 21.068 0.884 654 H ARG 81 H ARG 81 -5.519 20.451 -2.442 655 HA ARG 81 HA ARG 81 -4.716 23.159 -2.776 656 HB2 ARG 81 HB2 ARG 81 -4.667 20.920 -4.801 657 HB3 ARG 81 HB3 ARG 81 -3.756 22.421 -4.888 658 HG2 ARG 81 HG2 ARG 81 -2.714 21.689 -2.659 659 HG3 ARG 81 HG3 ARG 81 -3.365 20.097 -3.043 660 HD2 ARG 81 HD2 ARG 81 -1.069 20.255 -3.790 661 HD3 ARG 81 HD3 ARG 81 -2.152 20.131 -5.178 662 HE ARG 81 HE ARG 81 -1.827 22.810 -4.839 663 HH11 ARG 81 HH11 ARG 81 0.423 20.141 -5.207 664 HH12 ARG 81 HH12 ARG 81 1.608 21.100 -6.033 665 HH21 ARG 81 HH21 ARG 81 -0.264 24.066 -5.897 666 HH22 ARG 81 HH22 ARG 81 1.224 23.336 -6.418 667 H GLU 82 H GLU 82 -7.294 21.184 -4.209 668 HA GLU 82 HA GLU 82 -8.015 23.228 -6.071 669 HB2 GLU 82 HB2 GLU 82 -9.674 21.800 -6.852 670 HB3 GLU 82 HB3 GLU 82 -8.416 20.709 -6.301 671 HG2 GLU 82 HG2 GLU 82 -10.189 19.663 -5.386 672 HG3 GLU 82 HG3 GLU 82 -9.861 20.795 -4.075 673 H GLN 83 H GLN 83 -8.955 22.409 -2.819 674 HA GLN 83 HA GLN 83 -11.358 23.936 -2.750 675 HB2 GLN 83 HB2 GLN 83 -9.561 22.943 -0.534 676 HB3 GLN 83 HB3 GLN 83 -11.099 23.745 -0.256 677 HG2 GLN 83 HG2 GLN 83 -12.311 21.968 -1.223 678 HG3 GLN 83 HG3 GLN 83 -10.851 21.251 -1.902 679 HE21 GLN 83 HE21 GLN 83 -12.814 20.002 -0.217 680 HE22 GLN 83 HE22 GLN 83 -11.988 19.481 1.210 681 H LEU 84 H LEU 84 -8.072 24.823 -2.685 682 HA LEU 84 HA LEU 84 -8.567 27.299 -1.238 683 HB2 LEU 84 HB2 LEU 84 -6.233 25.703 -1.882 684 HB3 LEU 84 HB3 LEU 84 -5.976 27.389 -2.266 685 HG LEU 84 HG LEU 84 -5.173 26.835 -0.018 686 HD11 LEU 84 HD11 LEU 84 -6.088 29.107 -0.574 687 HD12 LEU 84 HD12 LEU 84 -6.104 28.688 1.135 688 HD13 LEU 84 HD13 LEU 84 -7.593 28.617 0.201 689 HD21 LEU 84 HD21 LEU 84 -8.059 26.200 0.598 690 HD22 LEU 84 HD22 LEU 84 -6.748 26.292 1.771 691 HD23 LEU 84 HD23 LEU 84 -6.732 25.041 0.530 692 H LYS 85 H LYS 85 -8.492 26.208 -4.470 693 HA LYS 85 HA LYS 85 -8.143 28.965 -5.426 694 HB2 LYS 85 HB2 LYS 85 -7.583 28.066 -7.588 695 HB3 LYS 85 HB3 LYS 85 -6.593 27.273 -6.372 696 HG2 LYS 85 HG2 LYS 85 -8.051 25.327 -6.440 697 HG3 LYS 85 HG3 LYS 85 -9.061 26.115 -7.648 698 HD2 LYS 85 HD2 LYS 85 -6.126 25.650 -8.074 699 HD3 LYS 85 HD3 LYS 85 -7.335 24.433 -8.482 700 HE2 LYS 85 HE2 LYS 85 -8.464 26.134 -9.905 701 HE3 LYS 85 HE3 LYS 85 -7.118 27.224 -9.591 702 HZ1 LYS 85 HZ1 LYS 85 -6.681 26.182 -11.634 703 HZ2 LYS 85 HZ2 LYS 85 -7.056 24.646 -11.034 704 HZ3 LYS 85 HZ3 LYS 85 -5.655 25.439 -10.516 705 H LYS 86 H LYS 86 -9.449 29.553 -7.340 706 HA LYS 86 HA LYS 86 -12.199 28.567 -7.024 707 HB2 LYS 86 HB2 LYS 86 -11.855 30.943 -6.444 708 HB3 LYS 86 HB3 LYS 86 -11.233 31.242 -8.060 709 HG2 LYS 86 HG2 LYS 86 -13.372 30.739 -9.035 710 HG3 LYS 86 HG3 LYS 86 -14.014 30.267 -7.461 711 HD2 LYS 86 HD2 LYS 86 -12.946 33.020 -8.041 712 HD3 LYS 86 HD3 LYS 86 -14.642 32.578 -8.252 713 HE2 LYS 86 HE2 LYS 86 -14.553 31.784 -5.828 714 HE3 LYS 86 HE3 LYS 86 -13.033 32.669 -5.718 715 HZ1 LYS 86 HZ1 LYS 86 -14.271 34.668 -6.470 716 HZ2 LYS 86 HZ2 LYS 86 -14.776 34.075 -4.969 717 HZ3 LYS 86 HZ3 LYS 86 -15.708 33.781 -6.347 718 H1 GLY 1 H1 GLY 1 -29.648 -5.951 17.655 719 H2 GLY 1 H2 GLY 1 -29.058 -7.245 16.743 720 H3 GLY 1 H3 GLY 1 -30.593 -6.614 16.424 721 HA2 GLY 1 HA3 GLY 1 -28.047 -5.146 16.080 722 HA3 GLY 1 HA2 GLY 1 -28.957 -5.898 14.776 723 H SER 2 H SER 2 -28.231 -3.054 15.380 724 HA SER 2 HA SER 2 -30.767 -1.790 15.935 725 HB2 SER 2 HB2 SER 2 -28.740 -0.004 14.906 726 HB3 SER 2 HB3 SER 2 -29.465 -0.056 16.516 727 HG SER 2 HG SER 2 -27.910 -1.493 17.170 728 H HIS 3 H HIS 3 -31.358 0.092 14.400 729 HA HIS 3 HA HIS 3 -31.637 -1.047 11.735 730 HB2 HIS 3 HB2 HIS 3 -33.706 -0.298 12.610 731 HB3 HIS 3 HB3 HIS 3 -33.007 1.200 13.207 732 HD1 HIS 3 HD1 HIS 3 -33.290 3.210 11.757 733 HD2 HIS 3 HD2 HIS 3 -33.910 -0.342 9.676 734 HE1 HIS 3 HE1 HIS 3 -34.082 3.893 9.465 735 HE2 HIS 3 HE2 HIS 3 -34.458 1.730 8.228 736 H MET 4 H MET 4 -30.562 -0.326 10.006 737 HA MET 4 HA MET 4 -28.595 1.750 10.361 738 HB2 MET 4 HB2 MET 4 -29.246 -0.203 8.192 739 HB3 MET 4 HB3 MET 4 -28.253 1.198 7.814 740 HG2 MET 4 HG2 MET 4 -27.671 -0.924 9.865 741 HG3 MET 4 HG3 MET 4 -26.856 -0.691 8.318 742 HE1 MET 4 HE1 MET 4 -24.174 0.288 11.058 743 HE2 MET 4 HE2 MET 4 -24.511 -0.762 9.684 744 HE3 MET 4 HE3 MET 4 -25.418 -0.954 11.182 745 H THR 5 H THR 5 -28.968 3.809 10.040 746 HA THR 5 HA THR 5 -30.927 4.613 8.001 747 HB THR 5 HB THR 5 -31.964 4.894 10.212 748 HG1 THR 5 HG1 THR 5 -31.230 7.207 8.751 749 HG21 THR 5 HG21 THR 5 -29.598 6.673 10.813 750 HG22 THR 5 HG22 THR 5 -29.979 5.138 11.589 751 HG23 THR 5 HG23 THR 5 -31.039 6.529 11.818 752 H GLU 6 H GLU 6 -27.986 4.327 8.086 753 HA GLU 6 HA GLU 6 -27.319 6.902 6.963 754 HB2 GLU 6 HB2 GLU 6 -25.277 7.147 8.355 755 HB3 GLU 6 HB3 GLU 6 -26.756 7.300 9.292 756 HG2 GLU 6 HG2 GLU 6 -26.497 5.119 10.208 757 HG3 GLU 6 HG3 GLU 6 -25.176 4.748 9.102 758 H GLN 7 H GLN 7 -24.952 6.795 6.165 759 HA GLN 7 HA GLN 7 -24.464 4.088 5.129 760 HB2 GLN 7 HB2 GLN 7 -24.152 6.794 3.905 761 HB3 GLN 7 HB3 GLN 7 -23.068 5.508 3.394 762 HG2 GLN 7 HG2 GLN 7 -25.328 4.180 3.121 763 HG3 GLN 7 HG3 GLN 7 -25.990 5.808 2.975 764 HE21 GLN 7 HE21 GLN 7 -25.655 3.584 1.035 765 HE22 GLN 7 HE22 GLN 7 -24.802 4.270 -0.302 766 HA PRO 8 HA PRO 8 -20.774 4.913 7.652 767 HB2 PRO 8 HB2 PRO 8 -20.862 2.326 8.757 768 HB3 PRO 8 HB3 PRO 8 -21.463 3.801 9.510 769 HG2 PRO 8 HG2 PRO 8 -23.003 1.610 8.634 770 HG3 PRO 8 HG3 PRO 8 -23.605 3.192 9.154 771 HD2 PRO 8 HD2 PRO 8 -23.181 2.132 6.406 772 HD3 PRO 8 HD3 PRO 8 -24.382 3.299 7.000 773 H LYS 9 H LYS 9 -18.908 3.082 8.069 774 HA LYS 9 HA LYS 9 -17.729 2.604 5.573 775 HB2 LYS 9 HB2 LYS 9 -16.126 1.138 6.880 776 HB3 LYS 9 HB3 LYS 9 -16.268 2.797 7.431 777 HG2 LYS 9 HG2 LYS 9 -17.386 2.198 9.366 778 HG3 LYS 9 HG3 LYS 9 -17.920 0.655 8.705 779 HD2 LYS 9 HD2 LYS 9 -15.749 -0.282 8.938 780 HD3 LYS 9 HD3 LYS 9 -15.035 1.294 9.285 781 HE2 LYS 9 HE2 LYS 9 -17.041 -0.143 11.015 782 HE3 LYS 9 HE3 LYS 9 -15.309 -0.052 11.315 783 HZ1 LYS 9 HZ1 LYS 9 -16.464 1.570 12.637 784 HZ2 LYS 9 HZ2 LYS 9 -17.204 2.231 11.269 785 HZ3 LYS 9 HZ3 LYS 9 -15.533 2.368 11.473 786 H THR 10 H THR 10 -19.087 1.474 4.243 787 HA THR 10 HA THR 10 -20.258 -1.016 5.009 788 HB THR 10 HB THR 10 -21.158 0.686 3.303 789 HG1 THR 10 HG1 THR 10 -22.447 -0.937 2.957 790 HG21 THR 10 HG21 THR 10 -19.132 0.846 1.920 791 HG22 THR 10 HG22 THR 10 -20.522 0.310 0.977 792 HG23 THR 10 HG23 THR 10 -19.300 -0.854 1.486 793 H ARG 11 H ARG 11 -19.945 -2.988 3.631 794 HA ARG 11 HA ARG 11 -17.071 -3.462 3.319 795 HB2 ARG 11 HB2 ARG 11 -19.217 -5.583 3.398 796 HB3 ARG 11 HB3 ARG 11 -17.493 -5.766 3.694 797 HG2 ARG 11 HG2 ARG 11 -17.856 -4.216 5.694 798 HG3 ARG 11 HG3 ARG 11 -19.574 -4.555 5.472 799 HD2 ARG 11 HD2 ARG 11 -18.304 -7.042 5.367 800 HD3 ARG 11 HD3 ARG 11 -17.524 -6.175 6.689 801 HE ARG 11 HE ARG 11 -20.199 -7.204 6.623 802 HH11 ARG 11 HH11 ARG 11 -18.160 -4.740 8.052 803 HH12 ARG 11 HH12 ARG 11 -19.135 -4.578 9.473 804 HH21 ARG 11 HH21 ARG 11 -21.471 -7.003 8.489 805 HH22 ARG 11 HH22 ARG 11 -21.002 -5.902 9.741 806 H VAL 12 H VAL 12 -16.207 -4.008 1.383 807 HA VAL 12 HA VAL 12 -18.085 -4.310 -0.864 808 HB VAL 12 HB VAL 12 -16.985 -2.070 -0.820 809 HG11 VAL 12 HG11 VAL 12 -14.497 -3.727 -1.117 810 HG12 VAL 12 HG12 VAL 12 -14.858 -2.507 0.104 811 HG13 VAL 12 HG13 VAL 12 -14.574 -2.026 -1.570 812 HG21 VAL 12 HG21 VAL 12 -16.266 -3.832 -3.156 813 HG22 VAL 12 HG22 VAL 12 -16.315 -2.070 -3.178 814 HG23 VAL 12 HG23 VAL 12 -17.796 -2.990 -2.913 815 H SER 13 H SER 13 -17.531 -5.735 -2.481 816 HA SER 13 HA SER 13 -15.543 -7.733 -1.764 817 HB2 SER 13 HB2 SER 13 -17.028 -8.242 -4.214 818 HB3 SER 13 HB3 SER 13 -16.982 -9.182 -2.718 819 HG SER 13 HG SER 13 -18.513 -7.659 -1.850 820 H VAL 14 H VAL 14 -13.595 -7.805 -2.719 821 HA VAL 14 HA VAL 14 -13.252 -6.449 -5.312 822 HB VAL 14 HB VAL 14 -10.869 -5.940 -4.536 823 HG11 VAL 14 HG11 VAL 14 -11.524 -3.847 -3.473 824 HG12 VAL 14 HG12 VAL 14 -13.142 -4.490 -3.188 825 HG13 VAL 14 HG13 VAL 14 -12.577 -4.220 -4.838 826 HG21 VAL 14 HG21 VAL 14 -10.909 -7.381 -2.529 827 HG22 VAL 14 HG22 VAL 14 -12.090 -6.293 -1.802 828 HG23 VAL 14 HG23 VAL 14 -10.467 -5.714 -2.167 829 H ARG 15 H ARG 15 -12.626 -7.824 -6.822 830 HA ARG 15 HA ARG 15 -11.470 -10.371 -6.036 831 HB2 ARG 15 HB2 ARG 15 -13.434 -9.949 -7.742 832 HB3 ARG 15 HB3 ARG 15 -12.109 -9.713 -8.874 833 HG2 ARG 15 HG2 ARG 15 -11.313 -11.910 -8.555 834 HG3 ARG 15 HG3 ARG 15 -12.340 -12.157 -7.143 835 HD2 ARG 15 HD2 ARG 15 -13.425 -13.320 -8.855 836 HD3 ARG 15 HD3 ARG 15 -14.308 -11.799 -8.739 837 HE ARG 15 HE ARG 15 -12.265 -11.537 -10.650 838 HH11 ARG 15 HH11 ARG 15 -15.304 -13.215 -10.192 839 HH12 ARG 15 HH12 ARG 15 -15.682 -13.251 -11.885 840 HH21 ARG 15 HH21 ARG 15 -12.750 -11.613 -12.887 841 HH22 ARG 15 HH22 ARG 15 -14.235 -12.340 -13.418 842 H ILE 16 H ILE 16 -9.349 -10.539 -5.926 843 HA ILE 16 HA ILE 16 -7.710 -9.117 -7.924 844 HB ILE 16 HB ILE 16 -6.834 -9.841 -5.125 845 HG12 ILE 16 HG12 ILE 16 -7.547 -7.080 -6.123 846 HG13 ILE 16 HG13 ILE 16 -8.673 -8.094 -5.229 847 HG21 ILE 16 HG21 ILE 16 -5.096 -9.640 -6.910 848 HG22 ILE 16 HG22 ILE 16 -4.904 -8.507 -5.572 849 HG23 ILE 16 HG23 ILE 16 -5.575 -7.952 -7.105 850 HD11 ILE 16 HD11 ILE 16 -6.061 -6.969 -4.258 851 HD12 ILE 16 HD12 ILE 16 -7.015 -8.152 -3.364 852 HD13 ILE 16 HD13 ILE 16 -7.683 -6.554 -3.709 853 H TYR 17 H TYR 17 -6.575 -10.412 -9.210 854 HA TYR 17 HA TYR 17 -5.638 -12.248 -10.132 855 HB2 TYR 17 HB2 TYR 17 -4.697 -12.154 -7.442 856 HB3 TYR 17 HB3 TYR 17 -4.952 -13.842 -7.874 857 HD1 TYR 17 HD1 TYR 17 -3.765 -10.921 -9.887 858 HD2 TYR 17 HD2 TYR 17 -2.881 -14.780 -8.326 859 HE1 TYR 17 HE1 TYR 17 -1.624 -10.916 -11.097 860 HE2 TYR 17 HE2 TYR 17 -0.739 -14.783 -9.531 861 HH TYR 17 HH TYR 17 0.713 -12.137 -10.709 862 H GLY 18 H GLY 18 -8.507 -12.257 -9.308 863 HA2 GLY 18 HA2 GLY 18 -10.073 -13.868 -10.095 864 HA3 GLY 18 HA3 GLY 18 -8.913 -15.132 -9.725 865 H GLN 19 H GLN 19 -8.506 -13.678 -7.021 866 HA GLN 19 HA GLN 19 -10.701 -15.117 -5.726 867 HB2 GLN 19 HB2 GLN 19 -7.933 -14.626 -5.093 868 HB3 GLN 19 HB3 GLN 19 -8.959 -14.100 -3.766 869 HG2 GLN 19 HG2 GLN 19 -8.993 -16.833 -5.027 870 HG3 GLN 19 HG3 GLN 19 -8.206 -16.414 -3.509 871 HE21 GLN 19 HE21 GLN 19 -10.343 -14.614 -2.672 872 HE22 GLN 19 HE22 GLN 19 -11.679 -15.617 -2.228 873 H ASP 20 H ASP 20 -12.371 -14.099 -4.804 874 HA ASP 20 HA ASP 20 -12.333 -11.189 -4.679 875 HB2 ASP 20 HB2 ASP 20 -14.244 -12.219 -5.782 876 HB3 ASP 20 HB3 ASP 20 -14.599 -13.155 -4.333 877 H TYR 21 H TYR 21 -12.176 -10.056 -2.853 878 HA TYR 21 HA TYR 21 -12.476 -11.503 -0.300 879 HB2 TYR 21 HB2 TYR 21 -10.619 -9.168 -0.788 880 HB3 TYR 21 HB3 TYR 21 -10.713 -10.176 0.651 881 HD1 TYR 21 HD1 TYR 21 -10.237 -12.746 0.224 882 HD2 TYR 21 HD2 TYR 21 -8.964 -9.586 -2.328 883 HE1 TYR 21 HE1 TYR 21 -8.476 -14.200 -0.685 884 HE2 TYR 21 HE2 TYR 21 -7.203 -11.038 -3.245 885 HH TYR 21 HH TYR 21 -6.043 -12.977 -2.883 886 H THR 22 H THR 22 -13.470 -10.409 1.389 887 HA THR 22 HA THR 22 -15.037 -8.069 0.589 888 HB THR 22 HB THR 22 -15.488 -9.378 3.223 889 HG1 THR 22 HG1 THR 22 -16.212 -10.581 0.728 890 HG21 THR 22 HG21 THR 22 -17.352 -8.474 1.021 891 HG22 THR 22 HG22 THR 22 -16.865 -7.495 2.406 892 HG23 THR 22 HG23 THR 22 -17.814 -8.958 2.655 893 H ILE 23 H ILE 23 -13.942 -6.221 0.985 894 HA ILE 23 HA ILE 23 -12.591 -5.968 3.597 895 HB ILE 23 HB ILE 23 -11.183 -4.215 2.581 896 HG12 ILE 23 HG12 ILE 23 -12.286 -5.116 -0.083 897 HG13 ILE 23 HG13 ILE 23 -12.868 -3.679 0.750 898 HG21 ILE 23 HG21 ILE 23 -9.681 -5.685 1.471 899 HG22 ILE 23 HG22 ILE 23 -10.989 -6.760 0.984 900 HG23 ILE 23 HG23 ILE 23 -10.529 -6.647 2.682 901 HD11 ILE 23 HD11 ILE 23 -10.083 -4.178 -0.259 902 HD12 ILE 23 HD12 ILE 23 -10.577 -2.766 0.674 903 HD13 ILE 23 HD13 ILE 23 -11.268 -3.057 -0.922 904 H VAL 24 H VAL 24 -12.307 -3.423 3.996 905 HA VAL 24 HA VAL 24 -15.036 -2.460 4.253 906 HB VAL 24 HB VAL 24 -12.478 -1.262 5.347 907 HG11 VAL 24 HG11 VAL 24 -13.980 -0.046 6.868 908 HG12 VAL 24 HG12 VAL 24 -15.369 -0.716 6.011 909 HG13 VAL 24 HG13 VAL 24 -14.260 0.373 5.179 910 HG21 VAL 24 HG21 VAL 24 -13.184 -2.245 7.499 911 HG22 VAL 24 HG22 VAL 24 -12.813 -3.465 6.283 912 HG23 VAL 24 HG23 VAL 24 -14.490 -3.084 6.662 913 H GLY 25 H GLY 25 -15.885 -1.077 2.830 914 HA2 GLY 25 HA2 GLY 25 -14.068 0.377 1.039 915 HA3 GLY 25 HA3 GLY 25 -15.776 0.075 0.747 916 H ALA 26 H ALA 26 -13.751 1.632 3.218 917 HA ALA 26 HA ALA 26 -15.808 3.592 3.744 918 HB1 ALA 26 HB1 ALA 26 -14.226 4.466 5.421 919 HB2 ALA 26 HB2 ALA 26 -13.021 3.305 4.861 920 HB3 ALA 26 HB3 ALA 26 -14.515 2.735 5.603 921 H GLU 27 H GLU 27 -15.590 4.147 1.329 922 HA GLU 27 HA GLU 27 -14.549 6.736 1.079 923 HB2 GLU 27 HB2 GLU 27 -12.583 4.763 0.678 924 HB3 GLU 27 HB3 GLU 27 -13.052 5.274 -0.935 925 HG2 GLU 27 HG2 GLU 27 -12.562 7.463 0.963 926 HG3 GLU 27 HG3 GLU 27 -11.163 6.470 0.570 927 H SER 28 H SER 28 -14.262 6.967 -1.650 928 HA SER 28 HA SER 28 -16.950 6.723 -2.532 929 HB2 SER 28 HB2 SER 28 -14.638 7.171 -4.402 930 HB3 SER 28 HB3 SER 28 -16.260 7.851 -4.469 931 HG SER 28 HG SER 28 -14.126 8.533 -2.715 932 HA PRO 29 HA PRO 29 -17.178 2.512 -3.919 933 HB2 PRO 29 HB2 PRO 29 -18.774 3.796 -6.099 934 HB3 PRO 29 HB3 PRO 29 -19.153 2.378 -5.112 935 HG2 PRO 29 HG2 PRO 29 -20.301 4.706 -4.585 936 HG3 PRO 29 HG3 PRO 29 -19.744 3.660 -3.265 937 HD2 PRO 29 HD2 PRO 29 -18.537 6.168 -4.337 938 HD3 PRO 29 HD3 PRO 29 -18.574 5.552 -2.673 939 H ALA 30 H ALA 30 -16.681 5.024 -6.399 940 HA ALA 30 HA ALA 30 -15.513 3.238 -8.283 941 HB1 ALA 30 HB1 ALA 30 -15.271 6.237 -8.143 942 HB2 ALA 30 HB2 ALA 30 -16.595 5.359 -8.911 943 HB3 ALA 30 HB3 ALA 30 -14.956 5.218 -9.549 944 H HIS 31 H HIS 31 -14.256 5.231 -5.713 945 HA HIS 31 HA HIS 31 -11.518 5.148 -6.484 946 HB2 HIS 31 HB2 HIS 31 -12.829 6.676 -4.752 947 HB3 HIS 31 HB3 HIS 31 -12.298 5.442 -3.619 948 HD1 HIS 31 HD1 HIS 31 -11.223 8.484 -5.281 949 HD2 HIS 31 HD2 HIS 31 -9.377 5.201 -3.528 950 HE1 HIS 31 HE1 HIS 31 -8.854 9.188 -4.873 951 HE2 HIS 31 HE2 HIS 31 -7.855 7.297 -3.555 952 H ILE 32 H ILE 32 -13.498 3.252 -4.251 953 HA ILE 32 HA ILE 32 -11.316 1.540 -3.470 954 HB ILE 32 HB ILE 32 -12.961 0.253 -2.216 955 HG12 ILE 32 HG12 ILE 32 -15.068 2.085 -3.395 956 HG13 ILE 32 HG13 ILE 32 -14.805 0.426 -3.912 957 HG21 ILE 32 HG21 ILE 32 -13.439 3.213 -1.922 958 HG22 ILE 32 HG22 ILE 32 -12.053 2.333 -1.278 959 HG23 ILE 32 HG23 ILE 32 -13.675 1.984 -0.678 960 HD11 ILE 32 HD11 ILE 32 -15.215 -0.149 -1.431 961 HD12 ILE 32 HD12 ILE 32 -16.584 0.263 -2.461 962 HD13 ILE 32 HD13 ILE 32 -15.926 1.463 -1.349 963 H ARG 33 H ARG 33 -13.174 1.684 -6.218 964 HA ARG 33 HA ARG 33 -13.294 -1.171 -6.680 965 HB2 ARG 33 HB2 ARG 33 -14.785 0.944 -7.610 966 HB3 ARG 33 HB3 ARG 33 -13.742 0.596 -8.983 967 HG2 ARG 33 HG2 ARG 33 -15.686 -0.677 -9.322 968 HG3 ARG 33 HG3 ARG 33 -14.469 -1.819 -8.747 969 HD2 ARG 33 HD2 ARG 33 -15.454 -1.347 -6.408 970 HD3 ARG 33 HD3 ARG 33 -16.826 -0.678 -7.285 971 HE ARG 33 HE ARG 33 -17.211 -2.851 -8.236 972 HH11 ARG 33 HH11 ARG 33 -14.885 -2.765 -5.615 973 HH12 ARG 33 HH12 ARG 33 -15.088 -4.442 -5.209 974 HH21 ARG 33 HH21 ARG 33 -17.476 -5.055 -7.701 975 HH22 ARG 33 HH22 ARG 33 -16.553 -5.741 -6.400 976 H LEU 34 H LEU 34 -11.421 1.613 -7.755 977 HA LEU 34 HA LEU 34 -9.921 0.140 -9.685 978 HB2 LEU 34 HB2 LEU 34 -8.603 2.112 -9.971 979 HB3 LEU 34 HB3 LEU 34 -10.282 2.581 -9.826 980 HG LEU 34 HG LEU 34 -9.495 2.873 -7.254 981 HD11 LEU 34 HD11 LEU 34 -7.089 3.539 -8.949 982 HD12 LEU 34 HD12 LEU 34 -7.181 2.304 -7.695 983 HD13 LEU 34 HD13 LEU 34 -7.316 4.008 -7.265 984 HD21 LEU 34 HD21 LEU 34 -9.355 5.262 -7.735 985 HD22 LEU 34 HD22 LEU 34 -10.691 4.513 -8.609 986 HD23 LEU 34 HD23 LEU 34 -9.199 4.913 -9.457 987 H VAL 35 H VAL 35 -9.713 0.511 -6.287 988 HA VAL 35 HA VAL 35 -6.981 0.192 -5.816 989 HB VAL 35 HB VAL 35 -9.253 -0.946 -4.170 990 HG11 VAL 35 HG11 VAL 35 -7.695 -0.892 -2.311 991 HG12 VAL 35 HG12 VAL 35 -6.431 -0.260 -3.363 992 HG13 VAL 35 HG13 VAL 35 -7.053 -1.890 -3.617 993 HG21 VAL 35 HG21 VAL 35 -7.841 1.703 -3.872 994 HG22 VAL 35 HG22 VAL 35 -9.165 1.091 -2.881 995 HG23 VAL 35 HG23 VAL 35 -9.441 1.488 -4.577 996 H ALA 36 H ALA 36 -9.533 -2.199 -6.292 997 HA ALA 36 HA ALA 36 -8.022 -4.521 -5.912 998 HB1 ALA 36 HB1 ALA 36 -9.793 -5.691 -6.981 999 HB2 ALA 36 HB2 ALA 36 -10.302 -4.249 -7.861 1000 HB3 ALA 36 HB3 ALA 36 -10.525 -4.338 -6.114 1001 H ALA 37 H ALA 37 -8.643 -2.659 -8.852 1002 HA ALA 37 HA ALA 37 -7.271 -4.388 -10.622 1003 HB1 ALA 37 HB1 ALA 37 -8.945 -2.770 -11.372 1004 HB2 ALA 37 HB2 ALA 37 -7.412 -2.547 -12.213 1005 HB3 ALA 37 HB3 ALA 37 -7.872 -1.447 -10.915 1006 H PHE 38 H PHE 38 -6.276 -1.624 -8.690 1007 HA PHE 38 HA PHE 38 -3.733 -1.255 -9.865 1008 HB2 PHE 38 HB2 PHE 38 -4.732 0.488 -8.508 1009 HB3 PHE 38 HB3 PHE 38 -4.754 -0.569 -7.101 1010 HD1 PHE 38 HD1 PHE 38 -2.295 0.720 -9.592 1011 HD2 PHE 38 HD2 PHE 38 -3.126 -0.223 -5.531 1012 HE1 PHE 38 HE1 PHE 38 -0.069 1.548 -8.952 1013 HE2 PHE 38 HE2 PHE 38 -0.901 0.600 -4.880 1014 HZ PHE 38 HZ PHE 38 0.631 1.489 -6.590 1015 H VAL 39 H VAL 39 -4.789 -3.092 -7.014 1016 HA VAL 39 HA VAL 39 -2.200 -3.997 -6.285 1017 HB VAL 39 HB VAL 39 -4.898 -5.229 -5.663 1018 HG11 VAL 39 HG11 VAL 39 -3.141 -6.873 -5.366 1019 HG12 VAL 39 HG12 VAL 39 -3.724 -6.333 -3.790 1020 HG13 VAL 39 HG13 VAL 39 -2.191 -5.727 -4.421 1021 HG21 VAL 39 HG21 VAL 39 -4.362 -2.835 -4.888 1022 HG22 VAL 39 HG22 VAL 39 -3.208 -3.595 -3.795 1023 HG23 VAL 39 HG23 VAL 39 -4.922 -3.991 -3.683 1024 H ASP 40 H ASP 40 -4.774 -5.385 -8.262 1025 HA ASP 40 HA ASP 40 -3.664 -7.898 -8.757 1026 HB2 ASP 40 HB2 ASP 40 -5.992 -7.131 -9.353 1027 HB3 ASP 40 HB3 ASP 40 -5.289 -6.255 -10.709 1028 H ASP 41 H ASP 41 -3.216 -4.809 -10.405 1029 HA ASP 41 HA ASP 41 -1.661 -5.701 -12.566 1030 HB2 ASP 41 HB2 ASP 41 -2.373 -3.530 -12.884 1031 HB3 ASP 41 HB3 ASP 41 -2.097 -3.079 -11.206 1032 H LYS 42 H LYS 42 -0.692 -4.477 -9.386 1033 HA LYS 42 HA LYS 42 2.067 -4.537 -9.816 1034 HB2 LYS 42 HB2 LYS 42 0.543 -4.842 -7.229 1035 HB3 LYS 42 HB3 LYS 42 2.264 -4.499 -7.352 1036 HG2 LYS 42 HG2 LYS 42 0.485 -2.672 -8.826 1037 HG3 LYS 42 HG3 LYS 42 0.373 -2.606 -7.069 1038 HD2 LYS 42 HD2 LYS 42 1.994 -0.986 -7.842 1039 HD3 LYS 42 HD3 LYS 42 2.818 -2.270 -6.959 1040 HE2 LYS 42 HE2 LYS 42 4.097 -1.735 -8.922 1041 HE3 LYS 42 HE3 LYS 42 3.388 -3.332 -9.122 1042 HZ1 LYS 42 HZ1 LYS 42 2.614 -0.802 -10.440 1043 HZ2 LYS 42 HZ2 LYS 42 1.552 -2.120 -10.391 1044 HZ3 LYS 42 HZ3 LYS 42 3.059 -2.273 -11.155 1045 H MET 43 H MET 43 -0.042 -7.054 -8.420 1046 HA MET 43 HA MET 43 2.202 -8.843 -8.112 1047 HB2 MET 43 HB2 MET 43 0.485 -10.516 -7.432 1048 HB3 MET 43 HB3 MET 43 0.462 -9.036 -6.485 1049 HG2 MET 43 HG2 MET 43 -1.494 -8.269 -7.560 1050 HG3 MET 43 HG3 MET 43 -1.385 -9.522 -8.797 1051 HE1 MET 43 HE1 MET 43 -1.482 -9.117 -4.873 1052 HE2 MET 43 HE2 MET 43 -0.463 -10.529 -5.157 1053 HE3 MET 43 HE3 MET 43 -2.044 -10.720 -4.397 1054 H HIS 44 H HIS 44 0.636 -7.860 -10.775 1055 HA HIS 44 HA HIS 44 0.594 -10.479 -12.071 1056 HB2 HIS 44 HB2 HIS 44 -0.943 -8.145 -12.373 1057 HB3 HIS 44 HB3 HIS 44 0.015 -8.276 -13.845 1058 HD1 HIS 44 HD1 HIS 44 -3.167 -9.201 -12.663 1059 HD2 HIS 44 HD2 HIS 44 -0.199 -11.225 -14.777 1060 HE1 HIS 44 HE1 HIS 44 -4.325 -11.121 -13.806 1061 HE2 HIS 44 HE2 HIS 44 -2.514 -12.338 -15.065 1062 H GLU 45 H GLU 45 2.625 -7.782 -11.682 1063 HA GLU 45 HA GLU 45 4.170 -8.490 -14.075 1064 HB2 GLU 45 HB2 GLU 45 5.335 -6.323 -13.739 1065 HB3 GLU 45 HB3 GLU 45 3.606 -6.155 -14.014 1066 HG2 GLU 45 HG2 GLU 45 3.207 -5.684 -11.707 1067 HG3 GLU 45 HG3 GLU 45 4.855 -6.133 -11.270 1068 H PHE 46 H PHE 46 4.425 -8.226 -10.567 1069 HA PHE 46 HA PHE 46 7.249 -8.701 -10.530 1070 HB2 PHE 46 HB2 PHE 46 5.108 -8.470 -8.463 1071 HB3 PHE 46 HB3 PHE 46 6.644 -9.205 -8.011 1072 HD1 PHE 46 HD2 PHE 46 8.759 -7.887 -8.406 1073 HD2 PHE 46 HD1 PHE 46 4.882 -6.146 -8.590 1074 HE1 PHE 46 HE2 PHE 46 9.752 -5.656 -8.126 1075 HE2 PHE 46 HE1 PHE 46 5.871 -3.911 -8.315 1076 HZ PHE 46 HZ PHE 46 8.307 -3.664 -8.084 1077 H SER 47 H SER 47 4.600 -10.702 -11.022 1078 HA SER 47 HA SER 47 5.472 -13.046 -9.692 1079 HB2 SER 47 HB2 SER 47 3.903 -14.026 -11.647 1080 HB3 SER 47 HB3 SER 47 3.252 -13.238 -10.208 1081 HG SER 47 HG SER 47 3.176 -12.435 -12.814 1082 H GLU 48 H GLU 48 6.547 -11.454 -12.499 1083 HA GLU 48 HA GLU 48 7.563 -13.787 -13.846 1084 HB2 GLU 48 HB2 GLU 48 8.009 -10.839 -14.315 1085 HB3 GLU 48 HB3 GLU 48 8.640 -12.112 -15.348 1086 HG2 GLU 48 HG2 GLU 48 5.749 -11.479 -14.833 1087 HG3 GLU 48 HG3 GLU 48 6.652 -11.196 -16.322 1088 H LYS 49 H LYS 49 8.637 -11.787 -11.308 1089 HA LYS 49 HA LYS 49 11.454 -12.135 -11.804 1090 HB2 LYS 49 HB2 LYS 49 10.009 -11.152 -9.341 1091 HB3 LYS 49 HB3 LYS 49 11.749 -11.088 -9.589 1092 HG2 LYS 49 HG2 LYS 49 10.953 -9.798 -11.790 1093 HG3 LYS 49 HG3 LYS 49 9.601 -9.416 -10.724 1094 HD2 LYS 49 HD2 LYS 49 11.163 -8.566 -9.046 1095 HD3 LYS 49 HD3 LYS 49 12.517 -8.937 -10.115 1096 HE2 LYS 49 HE2 LYS 49 10.285 -6.982 -10.647 1097 HE3 LYS 49 HE3 LYS 49 11.952 -6.579 -10.246 1098 HZ1 LYS 49 HZ1 LYS 49 11.706 -6.372 -12.577 1099 HZ2 LYS 49 HZ2 LYS 49 10.955 -7.879 -12.715 1100 HZ3 LYS 49 HZ3 LYS 49 12.595 -7.785 -12.319 1101 H GLN 50 H GLN 50 9.051 -13.505 -9.614 1102 HA GLN 50 HA GLN 50 9.031 -15.333 -8.269 1103 HB2 GLN 50 HB2 GLN 50 10.880 -16.277 -10.454 1104 HB3 GLN 50 HB3 GLN 50 10.290 -17.329 -9.175 1105 HG2 GLN 50 HG2 GLN 50 8.143 -17.331 -9.974 1106 HG3 GLN 50 HG3 GLN 50 8.328 -15.778 -10.788 1107 HE21 GLN 50 HE21 GLN 50 7.330 -18.363 -11.772 1108 HE22 GLN 50 HE22 GLN 50 8.301 -18.737 -13.155 1109 HA PRO 51 HA PRO 51 12.854 -14.146 -6.001 1110 HB2 PRO 51 HB2 PRO 51 11.238 -14.286 -3.608 1111 HB3 PRO 51 HB3 PRO 51 12.041 -12.884 -4.314 1112 HG2 PRO 51 HG2 PRO 51 9.315 -13.279 -4.222 1113 HG3 PRO 51 HG3 PRO 51 10.146 -12.179 -5.331 1114 HD2 PRO 51 HD2 PRO 51 8.960 -14.848 -5.840 1115 HD3 PRO 51 HD3 PRO 51 9.190 -13.482 -6.951 1116 H MET 52 H MET 52 10.443 -16.108 -4.277 1117 HA MET 52 HA MET 52 12.497 -18.187 -3.913 1118 HB2 MET 52 HB2 MET 52 10.018 -17.734 -2.245 1119 HB3 MET 52 HB3 MET 52 11.335 -18.840 -1.896 1120 HG2 MET 52 HG2 MET 52 11.713 -15.871 -2.073 1121 HG3 MET 52 HG3 MET 52 11.281 -16.696 -0.576 1122 HE1 MET 52 HE1 MET 52 14.372 -18.911 0.155 1123 HE2 MET 52 HE2 MET 52 12.797 -19.329 -0.517 1124 HE3 MET 52 HE3 MET 52 12.909 -18.196 0.830 1125 H LEU 53 H LEU 53 10.079 -17.485 -5.867 1126 HA LEU 53 HA LEU 53 8.707 -18.630 -7.254 1127 HB2 LEU 53 HB2 LEU 53 10.352 -20.906 -6.184 1128 HB3 LEU 53 HB3 LEU 53 9.037 -21.176 -7.314 1129 HG LEU 53 HG LEU 53 11.168 -19.194 -8.001 1130 HD11 LEU 53 HD11 LEU 53 12.417 -21.156 -7.345 1131 HD12 LEU 53 HD12 LEU 53 12.433 -20.987 -9.100 1132 HD13 LEU 53 HD13 LEU 53 11.380 -22.180 -8.339 1133 HD21 LEU 53 HD21 LEU 53 9.127 -19.391 -9.365 1134 HD22 LEU 53 HD22 LEU 53 9.516 -21.087 -9.666 1135 HD23 LEU 53 HD23 LEU 53 10.589 -19.817 -10.255 1136 H ASP 54 H ASP 54 7.968 -17.997 -4.539 1137 HA ASP 54 HA ASP 54 5.864 -20.007 -4.110 1138 HB2 ASP 54 HB2 ASP 54 5.941 -19.535 -1.755 1139 HB3 ASP 54 HB3 ASP 54 7.591 -19.856 -2.279 1140 H VAL 55 H VAL 55 3.892 -19.098 -3.123 1141 HA VAL 55 HA VAL 55 3.090 -16.733 -4.540 1142 HB VAL 55 HB VAL 55 1.327 -18.110 -2.544 1143 HG11 VAL 55 HG11 VAL 55 0.805 -16.766 -5.191 1144 HG12 VAL 55 HG12 VAL 55 0.501 -16.079 -3.594 1145 HG13 VAL 55 HG13 VAL 55 -0.420 -17.482 -4.141 1146 HG21 VAL 55 HG21 VAL 55 0.643 -19.694 -4.288 1147 HG22 VAL 55 HG22 VAL 55 2.336 -19.908 -3.842 1148 HG23 VAL 55 HG23 VAL 55 1.916 -19.077 -5.341 1149 HA PRO 56 HA PRO 56 2.323 -15.198 0.137 1150 HB2 PRO 56 HB2 PRO 56 4.795 -16.477 1.218 1151 HB3 PRO 56 HB3 PRO 56 3.268 -16.112 2.029 1152 HG2 PRO 56 HG2 PRO 56 3.803 -18.592 1.295 1153 HG3 PRO 56 HG3 PRO 56 2.175 -17.927 1.067 1154 HD2 PRO 56 HD2 PRO 56 4.344 -18.371 -0.943 1155 HD3 PRO 56 HD3 PRO 56 2.590 -18.600 -1.108 1156 H LYS 57 H LYS 57 5.771 -15.796 -0.691 1157 HA LYS 57 HA LYS 57 6.709 -13.278 0.109 1158 HB2 LYS 57 HB2 LYS 57 7.739 -15.455 -1.597 1159 HB3 LYS 57 HB3 LYS 57 8.414 -13.868 -1.922 1160 HG2 LYS 57 HG2 LYS 57 8.447 -14.196 0.873 1161 HG3 LYS 57 HG3 LYS 57 9.045 -15.700 0.170 1162 HD2 LYS 57 HD2 LYS 57 10.608 -14.362 -1.224 1163 HD3 LYS 57 HD3 LYS 57 10.072 -12.915 -0.371 1164 HE2 LYS 57 HE2 LYS 57 10.910 -13.759 1.709 1165 HE3 LYS 57 HE3 LYS 57 11.269 -15.325 0.986 1166 HZ1 LYS 57 HZ1 LYS 57 12.726 -13.795 -0.580 1167 HZ2 LYS 57 HZ2 LYS 57 13.315 -14.388 0.886 1168 HZ3 LYS 57 HZ3 LYS 57 12.732 -12.802 0.793 1169 H LEU 58 H LEU 58 5.448 -14.352 -2.991 1170 HA LEU 58 HA LEU 58 6.063 -12.013 -4.430 1171 HB2 LEU 58 HB2 LEU 58 5.526 -14.222 -5.434 1172 HB3 LEU 58 HB3 LEU 58 3.868 -14.034 -4.913 1173 HG LEU 58 HG LEU 58 4.491 -13.595 -7.383 1174 HD11 LEU 58 HD11 LEU 58 2.760 -11.858 -7.571 1175 HD12 LEU 58 HD12 LEU 58 2.800 -11.656 -5.820 1176 HD13 LEU 58 HD13 LEU 58 2.287 -13.191 -6.520 1177 HD21 LEU 58 HD21 LEU 58 5.187 -11.404 -7.973 1178 HD22 LEU 58 HD22 LEU 58 6.371 -12.042 -6.835 1179 HD23 LEU 58 HD23 LEU 58 5.165 -10.869 -6.295 1180 H ALA 59 H ALA 59 3.185 -13.038 -2.660 1181 HA ALA 59 HA ALA 59 1.539 -10.873 -3.367 1182 HB1 ALA 59 HB1 ALA 59 1.465 -12.551 -0.864 1183 HB2 ALA 59 HB2 ALA 59 0.689 -12.947 -2.399 1184 HB3 ALA 59 HB3 ALA 59 0.156 -11.541 -1.477 1185 H VAL 60 H VAL 60 3.501 -11.364 -0.423 1186 HA VAL 60 HA VAL 60 2.875 -8.802 0.643 1187 HB VAL 60 HB VAL 60 3.548 -10.589 2.136 1188 HG11 VAL 60 HG11 VAL 60 5.077 -11.943 1.113 1189 HG12 VAL 60 HG12 VAL 60 6.130 -11.022 2.187 1190 HG13 VAL 60 HG13 VAL 60 6.016 -10.590 0.480 1191 HG21 VAL 60 HG21 VAL 60 5.443 -8.249 2.107 1192 HG22 VAL 60 HG22 VAL 60 5.304 -9.386 3.445 1193 HG23 VAL 60 HG23 VAL 60 3.921 -8.392 2.987 1194 H LEU 61 H LEU 61 5.309 -9.903 -1.591 1195 HA LEU 61 HA LEU 61 7.200 -7.868 -1.325 1196 HB2 LEU 61 HB2 LEU 61 7.433 -9.937 -2.708 1197 HB3 LEU 61 HB3 LEU 61 6.366 -9.211 -3.892 1198 HG LEU 61 HG LEU 61 8.034 -7.355 -4.151 1199 HD11 LEU 61 HD11 LEU 61 9.266 -7.433 -2.142 1200 HD12 LEU 61 HD12 LEU 61 10.374 -7.962 -3.406 1201 HD13 LEU 61 HD13 LEU 61 9.627 -9.148 -2.339 1202 HD21 LEU 61 HD21 LEU 61 9.001 -10.149 -4.755 1203 HD22 LEU 61 HD22 LEU 61 9.567 -8.668 -5.529 1204 HD23 LEU 61 HD23 LEU 61 7.898 -9.192 -5.745 1205 H THR 62 H THR 62 4.195 -7.979 -3.164 1206 HA THR 62 HA THR 62 4.581 -5.414 -4.360 1207 HB THR 62 HB THR 62 2.251 -5.598 -5.093 1208 HG1 THR 62 HG1 THR 62 2.198 -7.961 -3.478 1209 HG21 THR 62 HG21 THR 62 2.481 -7.958 -6.147 1210 HG22 THR 62 HG22 THR 62 4.078 -7.944 -5.404 1211 HG23 THR 62 HG23 THR 62 3.639 -6.703 -6.577 1212 H ALA 63 H ALA 63 2.949 -6.632 -1.506 1213 HA ALA 63 HA ALA 63 1.447 -4.399 -0.787 1214 HB1 ALA 63 HB1 ALA 63 1.312 -6.661 0.255 1215 HB2 ALA 63 HB2 ALA 63 1.359 -5.335 1.419 1216 HB3 ALA 63 HB3 ALA 63 2.806 -6.298 1.119 1217 H VAL 64 H VAL 64 4.769 -5.276 0.147 1218 HA VAL 64 HA VAL 64 5.156 -2.955 1.713 1219 HB VAL 64 HB VAL 64 6.495 -5.027 1.984 1220 HG11 VAL 64 HG11 VAL 64 6.948 -5.631 -0.283 1221 HG12 VAL 64 HG12 VAL 64 8.484 -5.328 0.529 1222 HG13 VAL 64 HG13 VAL 64 7.811 -4.118 -0.564 1223 HG21 VAL 64 HG21 VAL 64 8.639 -3.875 2.417 1224 HG22 VAL 64 HG22 VAL 64 7.240 -2.996 3.030 1225 HG23 VAL 64 HG23 VAL 64 8.028 -2.472 1.541 1226 H GLN 65 H GLN 65 5.717 -3.638 -1.699 1227 HA GLN 65 HA GLN 65 7.226 -1.297 -2.234 1228 HB2 GLN 65 HB2 GLN 65 7.124 -3.262 -3.757 1229 HB3 GLN 65 HB3 GLN 65 5.449 -2.859 -4.117 1230 HG2 GLN 65 HG2 GLN 65 6.518 -0.516 -4.732 1231 HG3 GLN 65 HG3 GLN 65 7.951 -1.510 -4.994 1232 HE21 GLN 65 HE21 GLN 65 7.864 -1.033 -7.230 1233 HE22 GLN 65 HE22 GLN 65 6.714 -1.798 -8.267 1234 H ILE 66 H ILE 66 3.794 -2.091 -2.511 1235 HA ILE 66 HA ILE 66 2.862 0.337 -3.522 1236 HB ILE 66 HB ILE 66 1.546 -1.762 -1.805 1237 HG12 ILE 66 HG12 ILE 66 0.959 -0.993 -4.665 1238 HG13 ILE 66 HG13 ILE 66 2.205 -2.164 -4.245 1239 HG21 ILE 66 HG21 ILE 66 0.311 0.739 -2.936 1240 HG22 ILE 66 HG22 ILE 66 0.390 0.247 -1.245 1241 HG23 ILE 66 HG23 ILE 66 -0.620 -0.650 -2.375 1242 HD11 ILE 66 HD11 ILE 66 0.375 -3.431 -3.014 1243 HD12 ILE 66 HD12 ILE 66 0.317 -3.432 -4.775 1244 HD13 ILE 66 HD13 ILE 66 -0.762 -2.380 -3.860 1245 H ALA 67 H ALA 67 3.268 -0.748 -0.176 1246 HA ALA 67 HA ALA 67 2.230 1.510 1.107 1247 HB1 ALA 67 HB1 ALA 67 2.664 -0.595 2.261 1248 HB2 ALA 67 HB2 ALA 67 3.473 0.744 3.073 1249 HB3 ALA 67 HB3 ALA 67 4.397 -0.359 2.055 1250 H SER 68 H SER 68 5.507 0.787 -0.007 1251 HA SER 68 HA SER 68 6.762 3.068 1.066 1252 HB2 SER 68 HB2 SER 68 7.559 1.537 -1.422 1253 HB3 SER 68 HB3 SER 68 8.605 2.540 -0.418 1254 HG SER 68 HG SER 68 7.386 0.068 0.250 1255 H GLU 69 H GLU 69 5.374 2.432 -2.136 1256 HA GLU 69 HA GLU 69 6.060 4.859 -3.342 1257 HB2 GLU 69 HB2 GLU 69 3.817 2.916 -3.861 1258 HB3 GLU 69 HB3 GLU 69 4.092 4.330 -4.868 1259 HG2 GLU 69 HG2 GLU 69 6.187 2.235 -4.364 1260 HG3 GLU 69 HG3 GLU 69 5.053 2.173 -5.714 1261 H TYR 70 H TYR 70 3.318 4.030 -1.277 1262 HA TYR 70 HA TYR 70 2.037 6.570 -1.802 1263 HB2 TYR 70 HB2 TYR 70 1.374 4.215 -0.067 1264 HB3 TYR 70 HB3 TYR 70 0.512 5.737 0.126 1265 HD1 TYR 70 HD1 TYR 70 -0.066 6.753 -2.407 1266 HD2 TYR 70 HD2 TYR 70 0.163 2.665 -1.260 1267 HE1 TYR 70 HE1 TYR 70 -1.547 6.153 -4.273 1268 HE2 TYR 70 HE2 TYR 70 -1.321 2.054 -3.124 1269 HH TYR 70 HH TYR 70 -2.933 3.019 -4.589 1270 H LEU 71 H LEU 71 4.082 5.178 0.677 1271 HA LEU 71 HA LEU 71 3.637 7.201 2.616 1272 HB2 LEU 71 HB2 LEU 71 5.485 4.953 2.285 1273 HB3 LEU 71 HB3 LEU 71 6.185 6.316 3.138 1274 HG LEU 71 HG LEU 71 3.509 5.209 3.963 1275 HD11 LEU 71 HD11 LEU 71 6.192 4.226 4.940 1276 HD12 LEU 71 HD12 LEU 71 5.016 3.298 4.005 1277 HD13 LEU 71 HD13 LEU 71 4.624 3.824 5.640 1278 HD21 LEU 71 HD21 LEU 71 5.607 6.465 5.700 1279 HD22 LEU 71 HD22 LEU 71 3.874 6.317 5.984 1280 HD23 LEU 71 HD23 LEU 71 4.476 7.443 4.767 1281 H LYS 72 H LYS 72 5.848 6.903 -0.101 1282 HA LYS 72 HA LYS 72 7.368 9.234 0.558 1283 HB2 LYS 72 HB2 LYS 72 8.425 8.971 -1.558 1284 HB3 LYS 72 HB3 LYS 72 8.119 7.341 -0.974 1285 HG2 LYS 72 HG2 LYS 72 6.133 7.206 -2.398 1286 HG3 LYS 72 HG3 LYS 72 6.449 8.836 -2.985 1287 HD2 LYS 72 HD2 LYS 72 8.661 8.020 -3.822 1288 HD3 LYS 72 HD3 LYS 72 8.148 6.383 -3.395 1289 HE2 LYS 72 HE2 LYS 72 6.164 6.685 -4.865 1290 HE3 LYS 72 HE3 LYS 72 6.817 8.246 -5.354 1291 HZ1 LYS 72 HZ1 LYS 72 7.446 6.712 -7.001 1292 HZ2 LYS 72 HZ2 LYS 72 7.945 5.556 -5.866 1293 HZ3 LYS 72 HZ3 LYS 72 8.845 6.976 -6.084 1294 H LEU 73 H LEU 73 4.341 8.626 -0.971 1295 HA LEU 73 HA LEU 73 4.176 11.057 -2.448 1296 HB2 LEU 73 HB2 LEU 73 2.864 8.843 -2.762 1297 HB3 LEU 73 HB3 LEU 73 1.813 9.451 -1.503 1298 HG LEU 73 HG LEU 73 0.957 9.791 -3.819 1299 HD11 LEU 73 HD11 LEU 73 1.477 12.354 -2.328 1300 HD12 LEU 73 HD12 LEU 73 0.199 11.197 -1.955 1301 HD13 LEU 73 HD13 LEU 73 0.191 12.054 -3.497 1302 HD21 LEU 73 HD21 LEU 73 2.961 11.985 -4.153 1303 HD22 LEU 73 HD22 LEU 73 1.934 11.209 -5.358 1304 HD23 LEU 73 HD23 LEU 73 3.319 10.342 -4.692 1305 H LYS 74 H LYS 74 2.818 9.952 0.656 1306 HA LYS 74 HA LYS 74 1.607 12.459 1.230 1307 HB2 LYS 74 HB2 LYS 74 1.116 11.613 3.387 1308 HB3 LYS 74 HB3 LYS 74 0.948 10.268 2.274 1309 HG2 LYS 74 HG2 LYS 74 3.124 9.417 2.947 1310 HG3 LYS 74 HG3 LYS 74 3.332 10.785 4.036 1311 HD2 LYS 74 HD2 LYS 74 1.002 8.898 4.267 1312 HD3 LYS 74 HD3 LYS 74 2.540 8.585 5.064 1313 HE2 LYS 74 HE2 LYS 74 0.798 11.013 5.469 1314 HE3 LYS 74 HE3 LYS 74 0.958 9.656 6.575 1315 HZ1 LYS 74 HZ1 LYS 74 3.361 11.141 5.784 1316 HZ2 LYS 74 HZ2 LYS 74 3.041 10.297 7.212 1317 HZ3 LYS 74 HZ3 LYS 74 2.330 11.808 6.942 1318 H GLU 75 H GLU 75 4.814 11.349 1.387 1319 HA GLU 75 HA GLU 75 5.801 12.988 3.464 1320 HB2 GLU 75 HB2 GLU 75 7.049 11.072 2.558 1321 HB3 GLU 75 HB3 GLU 75 7.218 11.906 1.021 1322 HG2 GLU 75 HG2 GLU 75 9.270 12.098 2.214 1323 HG3 GLU 75 HG3 GLU 75 8.498 13.682 2.182 1324 H GLU 76 H GLU 76 5.681 13.414 -0.076 1325 HA GLU 76 HA GLU 76 6.826 15.992 -0.081 1326 HB2 GLU 76 HB2 GLU 76 6.273 16.127 -2.356 1327 HB3 GLU 76 HB3 GLU 76 6.501 14.409 -2.075 1328 HG2 GLU 76 HG2 GLU 76 4.332 13.915 -2.462 1329 HG3 GLU 76 HG3 GLU 76 3.749 15.429 -1.775 1330 H TYR 77 H TYR 77 3.613 14.843 0.500 1331 HA TYR 77 HA TYR 77 2.144 17.182 0.084 1332 HB2 TYR 77 HB2 TYR 77 1.002 15.087 0.411 1333 HB3 TYR 77 HB3 TYR 77 1.719 14.887 2.006 1334 HD1 TYR 77 HD2 TYR 77 -0.057 17.728 0.368 1335 HD2 TYR 77 HD1 TYR 77 0.058 14.999 3.624 1336 HE1 TYR 77 HE2 TYR 77 -1.999 18.850 1.360 1337 HE2 TYR 77 HE1 TYR 77 -1.887 16.121 4.635 1338 HH TYR 77 HH TYR 77 -3.891 18.160 3.021 1339 H GLN 78 H GLN 78 3.831 15.986 2.951 1340 HA GLN 78 HA GLN 78 3.117 18.285 4.526 1341 HB2 GLN 78 HB2 GLN 78 5.035 15.998 4.989 1342 HB3 GLN 78 HB3 GLN 78 4.751 17.277 6.162 1343 HG2 GLN 78 HG2 GLN 78 2.551 16.600 6.550 1344 HG3 GLN 78 HG3 GLN 78 2.492 15.641 5.071 1345 HE21 GLN 78 HE21 GLN 78 5.248 15.547 7.184 1346 HE22 GLN 78 HE22 GLN 78 4.974 13.953 7.794 1347 H ARG 79 H ARG 79 5.870 17.210 2.648 1348 HA ARG 79 HA ARG 79 7.752 19.081 3.571 1349 HB2 ARG 79 HB2 ARG 79 7.543 17.601 0.960 1350 HB3 ARG 79 HB3 ARG 79 8.914 18.615 1.386 1351 HG2 ARG 79 HG2 ARG 79 8.020 16.053 2.657 1352 HG3 ARG 79 HG3 ARG 79 9.571 16.434 1.910 1353 HD2 ARG 79 HD2 ARG 79 9.717 18.241 3.784 1354 HD3 ARG 79 HD3 ARG 79 8.507 17.238 4.584 1355 HE ARG 79 HE ARG 79 10.293 15.392 4.061 1356 HH11 ARG 79 HH11 ARG 79 10.731 18.625 5.323 1357 HH12 ARG 79 HH12 ARG 79 12.282 18.275 6.026 1358 HH21 ARG 79 HH21 ARG 79 12.323 14.917 4.997 1359 HH22 ARG 79 HH22 ARG 79 13.188 16.159 5.843 1360 H LEU 80 H LEU 80 5.581 19.241 0.734 1361 HA LEU 80 HA LEU 80 6.599 21.798 -0.040 1362 HB2 LEU 80 HB2 LEU 80 5.448 21.495 -1.918 1363 HB3 LEU 80 HB3 LEU 80 5.116 19.886 -1.313 1364 HG LEU 80 HG LEU 80 3.241 22.087 -0.571 1365 HD11 LEU 80 HD11 LEU 80 3.342 20.751 -3.271 1366 HD12 LEU 80 HD12 LEU 80 3.479 22.476 -2.926 1367 HD13 LEU 80 HD13 LEU 80 1.954 21.638 -2.644 1368 HD21 LEU 80 HD21 LEU 80 3.111 19.711 0.278 1369 HD22 LEU 80 HD22 LEU 80 2.689 19.244 -1.369 1370 HD23 LEU 80 HD23 LEU 80 1.651 20.354 -0.473 1371 H ARG 81 H ARG 81 4.176 20.760 2.192 1372 HA ARG 81 HA ARG 81 2.797 23.279 2.248 1373 HB2 ARG 81 HB2 ARG 81 2.680 20.806 3.944 1374 HB3 ARG 81 HB3 ARG 81 1.844 22.273 4.424 1375 HG2 ARG 81 HG2 ARG 81 0.700 22.217 2.168 1376 HG3 ARG 81 HG3 ARG 81 1.382 20.606 1.968 1377 HD2 ARG 81 HD2 ARG 81 -1.019 20.910 2.935 1378 HD3 ARG 81 HD3 ARG 81 0.060 19.691 3.601 1379 HE ARG 81 HE ARG 81 0.305 22.162 5.000 1380 HH11 ARG 81 HH11 ARG 81 -1.808 19.378 4.683 1381 HH12 ARG 81 HH12 ARG 81 -2.398 19.499 6.308 1382 HH21 ARG 81 HH21 ARG 81 -0.514 22.331 7.121 1383 HH22 ARG 81 HH22 ARG 81 -1.670 21.166 7.687 1384 H GLU 82 H GLU 82 5.191 21.650 4.308 1385 HA GLU 82 HA GLU 82 5.337 23.763 6.214 1386 HB2 GLU 82 HB2 GLU 82 7.235 22.608 7.122 1387 HB3 GLU 82 HB3 GLU 82 6.028 21.413 6.664 1388 HG2 GLU 82 HG2 GLU 82 7.280 20.961 4.603 1389 HG3 GLU 82 HG3 GLU 82 8.494 22.141 5.095 1390 H GLN 83 H GLN 83 6.464 23.499 3.062 1391 HA GLN 83 HA GLN 83 8.826 25.114 3.371 1392 HB2 GLN 83 HB2 GLN 83 8.407 23.353 1.573 1393 HB3 GLN 83 HB3 GLN 83 7.350 24.530 0.811 1394 HG2 GLN 83 HG2 GLN 83 9.227 26.081 0.597 1395 HG3 GLN 83 HG3 GLN 83 10.287 24.892 1.354 1396 HE21 GLN 83 HE21 GLN 83 9.098 22.617 0.041 1397 HE22 GLN 83 HE22 GLN 83 9.595 22.679 -1.615 1398 H LEU 84 H LEU 84 5.494 25.691 3.190 1399 HA LEU 84 HA LEU 84 5.700 28.288 1.934 1400 HB2 LEU 84 HB2 LEU 84 3.556 26.475 2.666 1401 HB3 LEU 84 HB3 LEU 84 3.197 28.112 3.167 1402 HG LEU 84 HG LEU 84 2.253 27.607 0.964 1403 HD11 LEU 84 HD11 LEU 84 4.501 29.581 0.644 1404 HD12 LEU 84 HD12 LEU 84 3.034 29.914 1.563 1405 HD13 LEU 84 HD13 LEU 84 2.935 29.577 -0.163 1406 HD21 LEU 84 HD21 LEU 84 3.782 25.979 0.119 1407 HD22 LEU 84 HD22 LEU 84 5.122 27.123 0.177 1408 HD23 LEU 84 HD23 LEU 84 3.810 27.363 -0.974 1409 H LYS 85 H LYS 85 5.841 27.013 5.124 1410 HA LYS 85 HA LYS 85 5.321 29.631 6.302 1411 HB2 LYS 85 HB2 LYS 85 5.441 28.524 8.465 1412 HB3 LYS 85 HB3 LYS 85 4.342 27.651 7.406 1413 HG2 LYS 85 HG2 LYS 85 5.747 25.839 7.215 1414 HG3 LYS 85 HG3 LYS 85 7.189 26.785 7.592 1415 HD2 LYS 85 HD2 LYS 85 6.724 25.369 9.460 1416 HD3 LYS 85 HD3 LYS 85 6.334 27.025 9.924 1417 HE2 LYS 85 HE2 LYS 85 3.966 26.590 9.529 1418 HE3 LYS 85 HE3 LYS 85 4.341 24.946 9.009 1419 HZ1 LYS 85 HZ1 LYS 85 4.765 26.081 11.719 1420 HZ2 LYS 85 HZ2 LYS 85 5.241 24.532 11.238 1421 HZ3 LYS 85 HZ3 LYS 85 3.600 24.937 11.275 1422 H LYS 86 H LYS 86 6.917 30.256 8.122 1423 HA LYS 86 HA LYS 86 9.634 29.921 7.052 1424 HB2 LYS 86 HB2 LYS 86 8.430 32.234 7.084 1425 HB3 LYS 86 HB3 LYS 86 8.820 32.217 8.799 1426 HG2 LYS 86 HG2 LYS 86 11.152 32.117 8.347 1427 HG3 LYS 86 HG3 LYS 86 10.865 31.865 6.625 1428 HD2 LYS 86 HD2 LYS 86 9.849 34.096 6.476 1429 HD3 LYS 86 HD3 LYS 86 10.167 34.344 8.194 1430 HE2 LYS 86 HE2 LYS 86 12.255 33.843 6.079 1431 HE3 LYS 86 HE3 LYS 86 11.861 35.413 6.775 1432 HZ1 LYS 86 HZ1 LYS 86 12.668 34.737 8.869 1433 HZ2 LYS 86 HZ2 LYS 86 13.840 34.253 7.751 1434 HZ3 LYS 86 HZ3 LYS 86 12.778 33.115 8.405 Start of MODEL 19 1 H1 GLY 1 H1 GLY 1 34.949 -7.831 -16.966 2 H2 GLY 1 H2 GLY 1 33.958 -7.239 -18.198 3 H3 GLY 1 H3 GLY 1 33.674 -8.772 -17.552 4 HA2 GLY 1 HA3 GLY 1 32.108 -7.030 -16.763 5 HA3 GLY 1 HA2 GLY 1 32.954 -7.906 -15.496 6 H SER 2 H SER 2 31.921 -4.951 -16.259 7 HA SER 2 HA SER 2 34.101 -3.659 -14.767 8 HB2 SER 2 HB2 SER 2 32.692 -2.430 -17.153 9 HB3 SER 2 HB3 SER 2 34.018 -1.724 -16.228 10 HG SER 2 HG SER 2 35.389 -3.292 -17.008 11 H HIS 3 H HIS 3 33.352 -1.412 -14.019 12 HA HIS 3 HA HIS 3 30.671 -1.714 -12.875 13 HB2 HIS 3 HB2 HIS 3 33.129 -0.209 -12.053 14 HB3 HIS 3 HB3 HIS 3 31.556 0.320 -11.469 15 HD1 HIS 3 HD1 HIS 3 30.231 -1.420 -9.964 16 HD2 HIS 3 HD2 HIS 3 34.186 -2.394 -10.777 17 HE1 HIS 3 HE1 HIS 3 30.845 -3.192 -8.297 18 HE2 HIS 3 HE2 HIS 3 33.311 -3.575 -8.653 19 H MET 4 H MET 4 29.391 0.314 -12.631 20 HA MET 4 HA MET 4 29.636 1.948 -15.070 21 HB2 MET 4 HB2 MET 4 27.574 0.426 -14.640 22 HB3 MET 4 HB3 MET 4 27.099 1.661 -13.484 23 HG2 MET 4 HG2 MET 4 25.980 2.179 -15.479 24 HG3 MET 4 HG3 MET 4 27.312 3.327 -15.364 25 HE1 MET 4 HE1 MET 4 26.782 3.764 -18.123 26 HE2 MET 4 HE2 MET 4 25.529 2.543 -17.904 27 HE3 MET 4 HE3 MET 4 26.684 2.389 -19.228 28 H THR 5 H THR 5 29.831 4.110 -14.878 29 HA THR 5 HA THR 5 30.233 5.207 -12.252 30 HB THR 5 HB THR 5 30.289 7.281 -14.153 31 HG1 THR 5 HG1 THR 5 30.889 6.366 -15.956 32 HG21 THR 5 HG21 THR 5 31.798 7.028 -12.241 33 HG22 THR 5 HG22 THR 5 32.705 7.213 -13.742 34 HG23 THR 5 HG23 THR 5 32.536 5.622 -13.005 35 H GLU 6 H GLU 6 27.861 4.734 -11.739 36 HA GLU 6 HA GLU 6 26.452 7.232 -11.837 37 HB2 GLU 6 HB2 GLU 6 24.389 6.344 -12.846 38 HB3 GLU 6 HB3 GLU 6 25.732 6.319 -13.980 39 HG2 GLU 6 HG2 GLU 6 26.004 3.960 -13.700 40 HG3 GLU 6 HG3 GLU 6 24.819 3.928 -12.397 41 H GLN 7 H GLN 7 24.294 6.996 -10.667 42 HA GLN 7 HA GLN 7 24.423 4.860 -8.653 43 HB2 GLN 7 HB2 GLN 7 25.339 7.051 -7.780 44 HB3 GLN 7 HB3 GLN 7 23.736 7.735 -8.015 45 HG2 GLN 7 HG2 GLN 7 23.403 7.131 -5.892 46 HG3 GLN 7 HG3 GLN 7 23.151 5.520 -6.564 47 HE21 GLN 7 HE21 GLN 7 24.124 6.311 -3.941 48 HE22 GLN 7 HE22 GLN 7 25.678 5.577 -3.763 49 HA PRO 8 HA PRO 8 20.199 5.143 -10.384 50 HB2 PRO 8 HB2 PRO 8 19.886 2.556 -10.989 51 HB3 PRO 8 HB3 PRO 8 20.830 3.636 -12.020 52 HG2 PRO 8 HG2 PRO 8 21.755 1.575 -10.084 53 HG3 PRO 8 HG3 PRO 8 22.466 2.065 -11.629 54 HD2 PRO 8 HD2 PRO 8 23.294 2.893 -9.081 55 HD3 PRO 8 HD3 PRO 8 23.756 3.635 -10.624 56 H LYS 9 H LYS 9 18.259 3.599 -9.875 57 HA LYS 9 HA LYS 9 17.685 3.751 -7.178 58 HB2 LYS 9 HB2 LYS 9 15.728 2.362 -7.667 59 HB3 LYS 9 HB3 LYS 9 15.972 3.592 -8.899 60 HG2 LYS 9 HG2 LYS 9 17.159 1.750 -10.235 61 HG3 LYS 9 HG3 LYS 9 16.418 0.635 -9.085 62 HD2 LYS 9 HD2 LYS 9 14.202 1.634 -9.672 63 HD3 LYS 9 HD3 LYS 9 15.012 2.553 -10.942 64 HE2 LYS 9 HE2 LYS 9 15.847 0.326 -11.822 65 HE3 LYS 9 HE3 LYS 9 14.712 -0.435 -10.710 66 HZ1 LYS 9 HZ1 LYS 9 13.214 1.428 -12.015 67 HZ2 LYS 9 HZ2 LYS 9 13.241 -0.229 -12.341 68 HZ3 LYS 9 HZ3 LYS 9 14.223 0.819 -13.232 69 H THR 10 H THR 10 18.532 2.707 -5.526 70 HA THR 10 HA THR 10 19.931 0.212 -5.906 71 HB THR 10 HB THR 10 20.672 2.229 -4.448 72 HG1 THR 10 HG1 THR 10 21.339 -0.233 -4.469 73 HG21 THR 10 HG21 THR 10 20.040 2.025 -2.073 74 HG22 THR 10 HG22 THR 10 18.842 0.809 -2.514 75 HG23 THR 10 HG23 THR 10 18.672 2.466 -3.096 76 H ARG 11 H ARG 11 19.545 -1.674 -4.609 77 HA ARG 11 HA ARG 11 16.706 -1.986 -3.897 78 HB2 ARG 11 HB2 ARG 11 18.737 -4.034 -4.807 79 HB3 ARG 11 HB3 ARG 11 17.123 -4.433 -4.236 80 HG2 ARG 11 HG2 ARG 11 16.175 -3.066 -6.065 81 HG3 ARG 11 HG3 ARG 11 17.811 -2.788 -6.659 82 HD2 ARG 11 HD2 ARG 11 18.094 -5.234 -6.900 83 HD3 ARG 11 HD3 ARG 11 16.415 -5.447 -6.407 84 HE ARG 11 HE ARG 11 16.713 -3.677 -8.646 85 HH11 ARG 11 HH11 ARG 11 16.495 -7.027 -7.671 86 HH12 ARG 11 HH12 ARG 11 15.877 -7.570 -9.198 87 HH21 ARG 11 HH21 ARG 11 15.911 -4.396 -10.681 88 HH22 ARG 11 HH22 ARG 11 15.557 -6.077 -10.910 89 H VAL 12 H VAL 12 16.162 -2.606 -1.888 90 HA VAL 12 HA VAL 12 18.375 -3.168 -0.024 91 HB VAL 12 HB VAL 12 17.371 -0.964 0.385 92 HG11 VAL 12 HG11 VAL 12 15.026 -0.910 1.331 93 HG12 VAL 12 HG12 VAL 12 14.816 -2.525 0.655 94 HG13 VAL 12 HG13 VAL 12 15.161 -1.160 -0.409 95 HG21 VAL 12 HG21 VAL 12 16.730 -2.990 2.523 96 HG22 VAL 12 HG22 VAL 12 16.868 -1.248 2.772 97 HG23 VAL 12 HG23 VAL 12 18.277 -2.182 2.273 98 H SER 13 H SER 13 18.169 -4.836 1.374 99 HA SER 13 HA SER 13 15.847 -6.586 1.010 100 HB2 SER 13 HB2 SER 13 18.135 -7.652 2.502 101 HB3 SER 13 HB3 SER 13 17.269 -8.339 1.127 102 HG SER 13 HG SER 13 18.853 -7.690 -0.082 103 H VAL 14 H VAL 14 14.459 -6.880 2.661 104 HA VAL 14 HA VAL 14 15.328 -6.242 5.394 105 HB VAL 14 HB VAL 14 12.858 -5.278 5.597 106 HG11 VAL 14 HG11 VAL 14 15.214 -3.707 4.555 107 HG12 VAL 14 HG12 VAL 14 14.863 -4.073 6.245 108 HG13 VAL 14 HG13 VAL 14 13.791 -3.011 5.331 109 HG21 VAL 14 HG21 VAL 14 13.619 -4.649 2.745 110 HG22 VAL 14 HG22 VAL 14 12.284 -3.912 3.628 111 HG23 VAL 14 HG23 VAL 14 12.254 -5.638 3.266 112 H ARG 15 H ARG 15 13.955 -7.168 7.044 113 HA ARG 15 HA ARG 15 12.756 -9.670 6.127 114 HB2 ARG 15 HB2 ARG 15 14.478 -9.922 7.795 115 HB3 ARG 15 HB3 ARG 15 13.679 -8.770 8.855 116 HG2 ARG 15 HG2 ARG 15 11.821 -10.293 9.162 117 HG3 ARG 15 HG3 ARG 15 12.550 -11.438 8.035 118 HD2 ARG 15 HD2 ARG 15 13.971 -10.508 10.513 119 HD3 ARG 15 HD3 ARG 15 12.861 -11.876 10.532 120 HE ARG 15 HE ARG 15 14.864 -12.109 8.496 121 HH11 ARG 15 HH11 ARG 15 14.200 -12.610 11.900 122 HH12 ARG 15 HH12 ARG 15 15.411 -13.835 12.087 123 HH21 ARG 15 HH21 ARG 15 16.466 -13.719 8.742 124 HH22 ARG 15 HH22 ARG 15 16.708 -14.461 10.292 125 H ILE 16 H ILE 16 10.634 -9.874 6.012 126 HA ILE 16 HA ILE 16 8.940 -8.194 7.746 127 HB ILE 16 HB ILE 16 8.180 -9.120 4.969 128 HG12 ILE 16 HG12 ILE 16 8.967 -6.313 5.751 129 HG13 ILE 16 HG13 ILE 16 10.117 -7.458 5.067 130 HG21 ILE 16 HG21 ILE 16 6.364 -8.670 6.620 131 HG22 ILE 16 HG22 ILE 16 6.318 -7.625 5.201 132 HG23 ILE 16 HG23 ILE 16 6.943 -7.007 6.728 133 HD11 ILE 16 HD11 ILE 16 8.614 -7.655 3.084 134 HD12 ILE 16 HD12 ILE 16 9.330 -6.061 3.316 135 HD13 ILE 16 HD13 ILE 16 7.649 -6.344 3.763 136 H TYR 17 H TYR 17 7.894 -9.404 9.158 137 HA TYR 17 HA TYR 17 6.828 -11.110 10.181 138 HB2 TYR 17 HB2 TYR 17 5.641 -10.895 7.696 139 HB3 TYR 17 HB3 TYR 17 6.023 -12.610 7.812 140 HD1 TYR 17 HD1 TYR 17 4.779 -10.033 10.232 141 HD2 TYR 17 HD2 TYR 17 4.189 -13.854 8.458 142 HE1 TYR 17 HE1 TYR 17 2.782 -10.366 11.627 143 HE2 TYR 17 HE2 TYR 17 2.187 -14.192 9.852 144 HH TYR 17 HH TYR 17 0.518 -11.945 11.256 145 H GLY 18 H GLY 18 9.651 -11.416 9.248 146 HA2 GLY 18 HA2 GLY 18 11.032 -13.191 10.101 147 HA3 GLY 18 HA3 GLY 18 9.776 -14.329 9.656 148 H GLN 19 H GLN 19 9.492 -13.052 6.959 149 HA GLN 19 HA GLN 19 11.697 -14.530 5.746 150 HB2 GLN 19 HB2 GLN 19 8.966 -13.791 4.942 151 HB3 GLN 19 HB3 GLN 19 10.155 -13.722 3.650 152 HG2 GLN 19 HG2 GLN 19 8.964 -15.886 3.813 153 HG3 GLN 19 HG3 GLN 19 10.715 -16.022 3.941 154 HE21 GLN 19 HE21 GLN 19 7.695 -16.176 5.668 155 HE22 GLN 19 HE22 GLN 19 8.296 -17.032 7.043 156 H ASP 20 H ASP 20 13.040 -13.699 4.131 157 HA ASP 20 HA ASP 20 13.573 -10.845 4.381 158 HB2 ASP 20 HB2 ASP 20 15.538 -12.106 4.600 159 HB3 ASP 20 HB3 ASP 20 15.101 -13.191 3.286 160 H TYR 21 H TYR 21 13.139 -9.367 2.853 161 HA TYR 21 HA TYR 21 12.475 -10.299 0.144 162 HB2 TYR 21 HB2 TYR 21 10.914 -8.272 1.758 163 HB3 TYR 21 HB3 TYR 21 10.626 -8.653 0.062 164 HD1 TYR 21 HD1 TYR 21 10.023 -11.092 -0.501 165 HD2 TYR 21 HD2 TYR 21 9.840 -9.485 3.434 166 HE1 TYR 21 HE1 TYR 21 8.524 -12.920 0.170 167 HE2 TYR 21 HE2 TYR 21 8.338 -11.306 4.114 168 HH TYR 21 HH TYR 21 6.823 -12.906 3.148 169 H THR 22 H THR 22 13.143 -9.002 -1.506 170 HA THR 22 HA THR 22 14.712 -6.626 -0.749 171 HB THR 22 HB THR 22 15.196 -8.249 -3.238 172 HG1 THR 22 HG1 THR 22 15.416 -9.356 -1.004 173 HG21 THR 22 HG21 THR 22 16.153 -5.958 -3.057 174 HG22 THR 22 HG22 THR 22 17.376 -7.222 -3.185 175 HG23 THR 22 HG23 THR 22 17.033 -6.484 -1.620 176 H ILE 23 H ILE 23 14.018 -4.737 -1.544 177 HA ILE 23 HA ILE 23 12.527 -4.713 -4.072 178 HB ILE 23 HB ILE 23 10.928 -3.081 -3.264 179 HG12 ILE 23 HG12 ILE 23 12.573 -2.302 -1.387 180 HG13 ILE 23 HG13 ILE 23 10.839 -2.166 -1.145 181 HG21 ILE 23 HG21 ILE 23 10.187 -5.331 -3.199 182 HG22 ILE 23 HG22 ILE 23 9.597 -4.534 -1.743 183 HG23 ILE 23 HG23 ILE 23 10.986 -5.617 -1.656 184 HD11 ILE 23 HD11 ILE 23 12.397 -4.511 -0.118 185 HD12 ILE 23 HD12 ILE 23 10.806 -3.938 0.377 186 HD13 ILE 23 HD13 ILE 23 12.244 -3.010 0.790 187 H VAL 24 H VAL 24 12.142 -2.233 -4.642 188 HA VAL 24 HA VAL 24 14.799 -1.111 -4.809 189 HB VAL 24 HB VAL 24 12.185 -0.031 -5.883 190 HG11 VAL 24 HG11 VAL 24 15.025 0.697 -6.578 191 HG12 VAL 24 HG12 VAL 24 13.899 1.693 -5.660 192 HG13 VAL 24 HG13 VAL 24 13.574 1.328 -7.354 193 HG21 VAL 24 HG21 VAL 24 12.716 -2.223 -6.818 194 HG22 VAL 24 HG22 VAL 24 14.320 -1.648 -7.271 195 HG23 VAL 24 HG23 VAL 24 12.886 -0.953 -8.029 196 H GLY 25 H GLY 25 15.598 0.327 -3.394 197 HA2 GLY 25 HA2 GLY 25 13.664 1.823 -1.733 198 HA3 GLY 25 HA3 GLY 25 15.226 1.270 -1.152 199 H ALA 26 H ALA 26 14.064 3.111 -3.971 200 HA ALA 26 HA ALA 26 16.370 4.859 -3.789 201 HB1 ALA 26 HB1 ALA 26 15.627 4.073 -5.980 202 HB2 ALA 26 HB2 ALA 26 15.542 5.830 -5.871 203 HB3 ALA 26 HB3 ALA 26 14.071 4.866 -5.742 204 H GLU 27 H GLU 27 15.214 5.295 -1.524 205 HA GLU 27 HA GLU 27 13.928 7.902 -1.845 206 HB2 GLU 27 HB2 GLU 27 12.026 6.589 -1.454 207 HB3 GLU 27 HB3 GLU 27 12.851 5.562 -0.294 208 HG2 GLU 27 HG2 GLU 27 11.353 6.875 0.936 209 HG3 GLU 27 HG3 GLU 27 12.946 7.559 1.230 210 H SER 28 H SER 28 14.421 6.040 1.132 211 HA SER 28 HA SER 28 16.814 7.469 1.833 212 HB2 SER 28 HB2 SER 28 14.259 7.986 3.389 213 HB3 SER 28 HB3 SER 28 15.866 8.541 3.845 214 HG SER 28 HG SER 28 15.348 9.278 1.319 215 HA PRO 29 HA PRO 29 17.680 3.719 3.974 216 HB2 PRO 29 HB2 PRO 29 18.877 4.870 6.245 217 HB3 PRO 29 HB3 PRO 29 19.693 4.379 4.760 218 HG2 PRO 29 HG2 PRO 29 18.764 7.077 5.610 219 HG3 PRO 29 HG3 PRO 29 20.190 6.620 4.659 220 HD2 PRO 29 HD2 PRO 29 18.040 7.705 3.499 221 HD3 PRO 29 HD3 PRO 29 18.972 6.423 2.695 222 H ALA 30 H ALA 30 16.434 6.323 6.078 223 HA ALA 30 HA ALA 30 15.450 4.534 8.056 224 HB1 ALA 30 HB1 ALA 30 14.328 6.497 8.983 225 HB2 ALA 30 HB2 ALA 30 14.713 7.406 7.525 226 HB3 ALA 30 HB3 ALA 30 16.009 6.842 8.580 227 H HIS 31 H HIS 31 13.979 6.164 5.302 228 HA HIS 31 HA HIS 31 11.309 5.452 5.880 229 HB2 HIS 31 HB2 HIS 31 12.712 6.725 3.665 230 HB3 HIS 31 HB3 HIS 31 11.416 5.678 3.110 231 HD1 HIS 31 HD1 HIS 31 10.847 8.461 2.465 232 HD2 HIS 31 HD2 HIS 31 10.020 6.951 6.260 233 HE1 HIS 31 HE1 HIS 31 9.104 9.975 3.436 234 HE2 HIS 31 HE2 HIS 31 8.752 9.163 5.794 235 H ILE 32 H ILE 32 13.727 3.937 3.766 236 HA ILE 32 HA ILE 32 11.979 1.838 2.925 237 HB ILE 32 HB ILE 32 13.910 0.818 1.888 238 HG12 ILE 32 HG12 ILE 32 15.582 2.887 3.351 239 HG13 ILE 32 HG13 ILE 32 15.538 1.170 3.725 240 HG21 ILE 32 HG21 ILE 32 14.473 2.560 0.361 241 HG22 ILE 32 HG22 ILE 32 14.133 3.806 1.559 242 HG23 ILE 32 HG23 ILE 32 12.815 2.840 0.893 243 HD11 ILE 32 HD11 ILE 32 17.490 1.489 2.489 244 HD12 ILE 32 HD12 ILE 32 16.687 2.528 1.316 245 HD13 ILE 32 HD13 ILE 32 16.342 0.799 1.341 246 H ARG 33 H ARG 33 13.592 2.359 5.824 247 HA ARG 33 HA ARG 33 13.768 -0.497 6.426 248 HB2 ARG 33 HB2 ARG 33 15.043 1.918 7.448 249 HB3 ARG 33 HB3 ARG 33 14.452 0.877 8.736 250 HG2 ARG 33 HG2 ARG 33 15.808 -0.907 8.083 251 HG3 ARG 33 HG3 ARG 33 16.100 -0.212 6.486 252 HD2 ARG 33 HD2 ARG 33 18.041 -0.032 8.011 253 HD3 ARG 33 HD3 ARG 33 17.453 1.526 7.432 254 HE ARG 33 HE ARG 33 16.166 1.194 9.799 255 HH11 ARG 33 HH11 ARG 33 19.519 1.034 8.841 256 HH12 ARG 33 HH12 ARG 33 20.119 1.616 10.357 257 HH21 ARG 33 HH21 ARG 33 16.942 1.940 11.818 258 HH22 ARG 33 HH22 ARG 33 18.651 2.118 12.060 259 H LEU 34 H LEU 34 11.783 2.252 6.947 260 HA LEU 34 HA LEU 34 10.378 1.146 9.206 261 HB2 LEU 34 HB2 LEU 34 10.638 3.536 9.074 262 HB3 LEU 34 HB3 LEU 34 9.892 3.577 7.488 263 HG LEU 34 HG LEU 34 7.770 2.737 8.596 264 HD11 LEU 34 HD11 LEU 34 7.569 3.101 11.000 265 HD12 LEU 34 HD12 LEU 34 9.281 3.511 11.089 266 HD13 LEU 34 HD13 LEU 34 8.787 1.878 10.642 267 HD21 LEU 34 HD21 LEU 34 8.023 5.048 7.914 268 HD22 LEU 34 HD22 LEU 34 8.887 5.419 9.406 269 HD23 LEU 34 HD23 LEU 34 7.183 4.967 9.464 270 H VAL 35 H VAL 35 10.010 1.313 5.740 271 HA VAL 35 HA VAL 35 7.296 0.725 5.478 272 HB VAL 35 HB VAL 35 7.864 -0.180 3.237 273 HG11 VAL 35 HG11 VAL 35 9.136 2.413 4.060 274 HG12 VAL 35 HG12 VAL 35 7.521 2.159 3.398 275 HG13 VAL 35 HG13 VAL 35 8.940 1.911 2.381 276 HG21 VAL 35 HG21 VAL 35 10.705 0.243 4.141 277 HG22 VAL 35 HG22 VAL 35 10.211 -0.058 2.476 278 HG23 VAL 35 HG23 VAL 35 9.948 -1.290 3.708 279 H ALA 36 H ALA 36 10.026 -1.403 6.055 280 HA ALA 36 HA ALA 36 8.640 -3.842 5.617 281 HB1 ALA 36 HB1 ALA 36 11.087 -3.405 7.321 282 HB2 ALA 36 HB2 ALA 36 11.111 -3.576 5.567 283 HB3 ALA 36 HB3 ALA 36 10.555 -4.913 6.574 284 H ALA 37 H ALA 37 9.114 -1.763 8.384 285 HA ALA 37 HA ALA 37 8.051 -3.648 10.275 286 HB1 ALA 37 HB1 ALA 37 8.529 -0.688 10.588 287 HB2 ALA 37 HB2 ALA 37 9.708 -1.956 10.926 288 HB3 ALA 37 HB3 ALA 37 8.231 -1.847 11.882 289 H PHE 38 H PHE 38 6.823 -1.061 8.299 290 HA PHE 38 HA PHE 38 4.370 -0.674 9.643 291 HB2 PHE 38 HB2 PHE 38 5.159 0.998 8.088 292 HB3 PHE 38 HB3 PHE 38 5.162 -0.170 6.769 293 HD1 PHE 38 HD2 PHE 38 2.785 1.209 9.293 294 HD2 PHE 38 HD1 PHE 38 3.430 -0.080 5.289 295 HE1 PHE 38 HE2 PHE 38 0.476 1.833 8.728 296 HE2 PHE 38 HE1 PHE 38 1.120 0.538 4.719 297 HZ PHE 38 HZ PHE 38 -0.365 1.493 6.438 298 H VAL 39 H VAL 39 5.237 -2.663 6.810 299 HA VAL 39 HA VAL 39 2.629 -3.775 6.537 300 HB VAL 39 HB VAL 39 5.286 -4.822 5.532 301 HG11 VAL 39 HG11 VAL 39 3.960 -6.143 3.951 302 HG12 VAL 39 HG12 VAL 39 2.480 -5.603 4.742 303 HG13 VAL 39 HG13 VAL 39 3.633 -6.608 5.620 304 HG21 VAL 39 HG21 VAL 39 5.011 -2.808 4.452 305 HG22 VAL 39 HG22 VAL 39 3.251 -2.931 4.442 306 HG23 VAL 39 HG23 VAL 39 4.209 -3.925 3.347 307 H ASP 40 H ASP 40 5.521 -4.692 8.274 308 HA ASP 40 HA ASP 40 4.885 -7.298 9.024 309 HB2 ASP 40 HB2 ASP 40 7.090 -6.224 9.375 310 HB3 ASP 40 HB3 ASP 40 6.383 -5.209 10.623 311 H ASP 41 H ASP 41 3.773 -4.219 10.247 312 HA ASP 41 HA ASP 41 2.456 -5.345 12.559 313 HB2 ASP 41 HB2 ASP 41 3.255 -3.092 12.790 314 HB3 ASP 41 HB3 ASP 41 2.433 -2.588 11.317 315 H LYS 42 H LYS 42 1.484 -4.001 9.423 316 HA LYS 42 HA LYS 42 -1.281 -4.225 9.719 317 HB2 LYS 42 HB2 LYS 42 0.573 -4.087 7.395 318 HB3 LYS 42 HB3 LYS 42 -1.094 -4.557 7.089 319 HG2 LYS 42 HG2 LYS 42 -0.451 -2.092 8.664 320 HG3 LYS 42 HG3 LYS 42 -0.454 -2.077 6.899 321 HD2 LYS 42 HD2 LYS 42 -2.755 -2.728 6.824 322 HD3 LYS 42 HD3 LYS 42 -2.785 -3.015 8.567 323 HE2 LYS 42 HE2 LYS 42 -2.235 -0.575 8.861 324 HE3 LYS 42 HE3 LYS 42 -2.510 -0.385 7.132 325 HZ1 LYS 42 HZ1 LYS 42 -4.758 -0.843 7.351 326 HZ2 LYS 42 HZ2 LYS 42 -4.435 0.082 8.731 327 HZ3 LYS 42 HZ3 LYS 42 -4.572 -1.595 8.860 328 H MET 43 H MET 43 1.049 -6.594 8.454 329 HA MET 43 HA MET 43 -1.042 -8.525 7.978 330 HB2 MET 43 HB2 MET 43 0.706 -10.020 7.253 331 HB3 MET 43 HB3 MET 43 0.966 -8.434 6.544 332 HG2 MET 43 HG2 MET 43 2.594 -8.024 8.449 333 HG3 MET 43 HG3 MET 43 2.480 -9.755 8.765 334 HE1 MET 43 HE1 MET 43 2.039 -10.712 5.654 335 HE2 MET 43 HE2 MET 43 3.008 -11.597 6.830 336 HE3 MET 43 HE3 MET 43 3.696 -11.176 5.263 337 H HIS 44 H HIS 44 0.367 -7.438 10.724 338 HA HIS 44 HA HIS 44 0.454 -10.019 12.082 339 HB2 HIS 44 HB2 HIS 44 2.193 -8.346 12.587 340 HB3 HIS 44 HB3 HIS 44 0.956 -7.224 13.136 341 HD1 HIS 44 HD1 HIS 44 0.827 -7.132 15.581 342 HD2 HIS 44 HD2 HIS 44 1.916 -10.920 14.256 343 HE1 HIS 44 HE1 HIS 44 1.153 -8.507 17.656 344 HE2 HIS 44 HE2 HIS 44 1.812 -10.797 16.841 345 H GLU 45 H GLU 45 -1.580 -7.242 11.693 346 HA GLU 45 HA GLU 45 -3.343 -8.068 13.860 347 HB2 GLU 45 HB2 GLU 45 -4.646 -6.023 13.242 348 HB3 GLU 45 HB3 GLU 45 -2.991 -5.709 13.743 349 HG2 GLU 45 HG2 GLU 45 -2.305 -5.241 11.525 350 HG3 GLU 45 HG3 GLU 45 -3.789 -5.909 10.846 351 H PHE 46 H PHE 46 -3.073 -8.325 10.438 352 HA PHE 46 HA PHE 46 -5.858 -8.860 9.990 353 HB2 PHE 46 HB2 PHE 46 -3.434 -8.694 8.320 354 HB3 PHE 46 HB3 PHE 46 -4.665 -9.819 7.753 355 HD1 PHE 46 HD1 PHE 46 -7.043 -8.956 7.528 356 HD2 PHE 46 HD2 PHE 46 -3.669 -6.401 7.937 357 HE1 PHE 46 HE1 PHE 46 -8.347 -7.087 6.599 358 HE2 PHE 46 HE2 PHE 46 -4.962 -4.532 7.007 359 HZ PHE 46 HZ PHE 46 -7.308 -4.871 6.339 360 H SER 47 H SER 47 -3.095 -10.732 10.871 361 HA SER 47 HA SER 47 -4.039 -13.276 10.058 362 HB2 SER 47 HB2 SER 47 -2.432 -13.824 12.188 363 HB3 SER 47 HB3 SER 47 -1.827 -13.480 10.565 364 HG SER 47 HG SER 47 -1.887 -11.842 12.840 365 H GLU 48 H GLU 48 -5.117 -11.131 12.353 366 HA GLU 48 HA GLU 48 -6.182 -13.067 14.224 367 HB2 GLU 48 HB2 GLU 48 -5.276 -10.827 14.901 368 HB3 GLU 48 HB3 GLU 48 -6.620 -10.080 14.054 369 HG2 GLU 48 HG2 GLU 48 -6.971 -10.214 16.469 370 HG3 GLU 48 HG3 GLU 48 -8.194 -11.092 15.556 371 H LYS 49 H LYS 49 -7.099 -11.459 11.348 372 HA LYS 49 HA LYS 49 -9.940 -11.561 11.741 373 HB2 LYS 49 HB2 LYS 49 -8.226 -11.115 9.294 374 HB3 LYS 49 HB3 LYS 49 -9.981 -11.104 9.245 375 HG2 LYS 49 HG2 LYS 49 -8.479 -9.296 11.095 376 HG3 LYS 49 HG3 LYS 49 -8.726 -8.870 9.402 377 HD2 LYS 49 HD2 LYS 49 -11.209 -9.337 9.855 378 HD3 LYS 49 HD3 LYS 49 -10.774 -9.274 11.562 379 HE2 LYS 49 HE2 LYS 49 -10.157 -7.071 9.606 380 HE3 LYS 49 HE3 LYS 49 -11.629 -7.123 10.573 381 HZ1 LYS 49 HZ1 LYS 49 -8.876 -7.107 11.691 382 HZ2 LYS 49 HZ2 LYS 49 -10.319 -7.043 12.567 383 HZ3 LYS 49 HZ3 LYS 49 -9.878 -5.751 11.573 384 H GLN 50 H GLN 50 -7.607 -13.389 9.797 385 HA GLN 50 HA GLN 50 -7.643 -15.436 8.822 386 HB2 GLN 50 HB2 GLN 50 -9.487 -15.970 11.153 387 HB3 GLN 50 HB3 GLN 50 -8.890 -17.226 10.077 388 HG2 GLN 50 HG2 GLN 50 -6.879 -17.270 11.041 389 HG3 GLN 50 HG3 GLN 50 -6.802 -15.513 11.194 390 HE21 GLN 50 HE21 GLN 50 -6.049 -15.541 13.273 391 HE22 GLN 50 HE22 GLN 50 -7.015 -16.036 14.622 392 HA PRO 51 HA PRO 51 -11.782 -14.524 6.813 393 HB2 PRO 51 HB2 PRO 51 -10.793 -13.848 4.355 394 HB3 PRO 51 HB3 PRO 51 -11.115 -12.684 5.643 395 HG2 PRO 51 HG2 PRO 51 -8.531 -13.874 4.762 396 HG3 PRO 51 HG3 PRO 51 -8.881 -12.240 5.343 397 HD2 PRO 51 HD2 PRO 51 -7.715 -14.182 6.875 398 HD3 PRO 51 HD3 PRO 51 -8.661 -12.837 7.537 399 H MET 52 H MET 52 -8.941 -15.974 5.177 400 HA MET 52 HA MET 52 -10.710 -18.189 4.357 401 HB2 MET 52 HB2 MET 52 -8.282 -17.240 2.841 402 HB3 MET 52 HB3 MET 52 -9.458 -18.436 2.321 403 HG2 MET 52 HG2 MET 52 -10.275 -16.710 1.148 404 HG3 MET 52 HG3 MET 52 -11.073 -16.322 2.671 405 HE1 MET 52 HE1 MET 52 -11.364 -13.824 1.654 406 HE2 MET 52 HE2 MET 52 -10.464 -14.300 0.213 407 HE3 MET 52 HE3 MET 52 -10.001 -12.850 1.105 408 H LEU 53 H LEU 53 -8.358 -17.516 6.482 409 HA LEU 53 HA LEU 53 -6.727 -18.667 7.578 410 HB2 LEU 53 HB2 LEU 53 -8.328 -20.968 6.464 411 HB3 LEU 53 HB3 LEU 53 -7.004 -21.180 7.593 412 HG LEU 53 HG LEU 53 -9.395 -19.471 8.242 413 HD11 LEU 53 HD11 LEU 53 -9.007 -22.405 8.815 414 HD12 LEU 53 HD12 LEU 53 -10.196 -21.712 7.714 415 HD13 LEU 53 HD13 LEU 53 -10.305 -21.393 9.446 416 HD21 LEU 53 HD21 LEU 53 -8.673 -20.027 10.565 417 HD22 LEU 53 HD22 LEU 53 -7.510 -19.064 9.658 418 HD23 LEU 53 HD23 LEU 53 -7.239 -20.793 9.882 419 H ASP 54 H ASP 54 -6.133 -17.757 4.976 420 HA ASP 54 HA ASP 54 -4.090 -19.710 4.171 421 HB2 ASP 54 HB2 ASP 54 -5.887 -19.728 2.516 422 HB3 ASP 54 HB3 ASP 54 -5.788 -17.979 2.355 423 H VAL 55 H VAL 55 -2.069 -18.901 4.001 424 HA VAL 55 HA VAL 55 -1.533 -16.291 4.956 425 HB VAL 55 HB VAL 55 0.387 -18.228 3.659 426 HG11 VAL 55 HG11 VAL 55 0.907 -15.789 5.351 427 HG12 VAL 55 HG12 VAL 55 1.245 -15.954 3.628 428 HG13 VAL 55 HG13 VAL 55 2.127 -16.935 4.799 429 HG21 VAL 55 HG21 VAL 55 0.985 -18.863 5.923 430 HG22 VAL 55 HG22 VAL 55 -0.739 -19.126 5.653 431 HG23 VAL 55 HG23 VAL 55 -0.194 -17.724 6.574 432 HA PRO 56 HA PRO 56 -0.054 -15.412 0.308 433 HB2 PRO 56 HB2 PRO 56 -2.157 -17.085 -0.985 434 HB3 PRO 56 HB3 PRO 56 -0.522 -16.704 -1.539 435 HG2 PRO 56 HG2 PRO 56 -1.081 -19.091 -0.508 436 HG3 PRO 56 HG3 PRO 56 0.458 -18.286 -0.163 437 HD2 PRO 56 HD2 PRO 56 -1.931 -18.626 1.581 438 HD3 PRO 56 HD3 PRO 56 -0.210 -18.592 2.006 439 H LYS 57 H LYS 57 -3.465 -16.288 0.838 440 HA LYS 57 HA LYS 57 -4.564 -14.052 -0.495 441 HB2 LYS 57 HB2 LYS 57 -5.580 -16.093 1.430 442 HB3 LYS 57 HB3 LYS 57 -6.547 -14.648 1.182 443 HG2 LYS 57 HG2 LYS 57 -6.925 -16.827 -0.248 444 HG3 LYS 57 HG3 LYS 57 -7.119 -15.221 -0.946 445 HD2 LYS 57 HD2 LYS 57 -5.299 -15.439 -2.280 446 HD3 LYS 57 HD3 LYS 57 -4.409 -16.390 -1.090 447 HE2 LYS 57 HE2 LYS 57 -6.772 -17.539 -2.526 448 HE3 LYS 57 HE3 LYS 57 -5.178 -17.528 -3.276 449 HZ1 LYS 57 HZ1 LYS 57 -4.777 -18.479 -0.726 450 HZ2 LYS 57 HZ2 LYS 57 -4.784 -19.387 -2.158 451 HZ3 LYS 57 HZ3 LYS 57 -6.200 -19.237 -1.249 452 H LEU 58 H LEU 58 -3.535 -14.556 2.820 453 HA LEU 58 HA LEU 58 -4.667 -12.224 3.944 454 HB2 LEU 58 HB2 LEU 58 -3.927 -13.995 5.379 455 HB3 LEU 58 HB3 LEU 58 -2.304 -13.927 4.726 456 HG LEU 58 HG LEU 58 -3.151 -11.411 5.976 457 HD11 LEU 58 HD11 LEU 58 -2.879 -12.311 8.270 458 HD12 LEU 58 HD12 LEU 58 -2.994 -13.939 7.600 459 HD13 LEU 58 HD13 LEU 58 -4.359 -12.829 7.466 460 HD21 LEU 58 HD21 LEU 58 -0.790 -13.259 6.333 461 HD22 LEU 58 HD22 LEU 58 -0.945 -11.654 7.047 462 HD23 LEU 58 HD23 LEU 58 -0.859 -11.835 5.295 463 H ALA 59 H ALA 59 -1.683 -12.861 2.228 464 HA ALA 59 HA ALA 59 -0.452 -10.354 2.803 465 HB1 ALA 59 HB1 ALA 59 0.106 -12.361 0.628 466 HB2 ALA 59 HB2 ALA 59 0.886 -12.272 2.209 467 HB3 ALA 59 HB3 ALA 59 1.131 -10.982 1.029 468 H VAL 60 H VAL 60 -2.812 -11.403 0.504 469 HA VAL 60 HA VAL 60 -2.427 -9.082 -1.216 470 HB VAL 60 HB VAL 60 -4.679 -11.094 -1.326 471 HG11 VAL 60 HG11 VAL 60 -5.079 -8.981 -2.503 472 HG12 VAL 60 HG12 VAL 60 -4.947 -10.342 -3.618 473 HG13 VAL 60 HG13 VAL 60 -3.596 -9.224 -3.425 474 HG21 VAL 60 HG21 VAL 60 -3.471 -12.370 -2.916 475 HG22 VAL 60 HG22 VAL 60 -2.379 -12.121 -1.555 476 HG23 VAL 60 HG23 VAL 60 -2.197 -11.157 -3.020 477 H LEU 61 H LEU 61 -4.600 -10.322 1.231 478 HA LEU 61 HA LEU 61 -6.627 -8.393 1.065 479 HB2 LEU 61 HB2 LEU 61 -6.469 -10.609 2.439 480 HB3 LEU 61 HB3 LEU 61 -5.793 -9.578 3.685 481 HG LEU 61 HG LEU 61 -7.930 -8.151 3.341 482 HD11 LEU 61 HD11 LEU 61 -8.659 -9.314 1.301 483 HD12 LEU 61 HD12 LEU 61 -9.867 -9.383 2.582 484 HD13 LEU 61 HD13 LEU 61 -8.864 -10.793 2.235 485 HD21 LEU 61 HD21 LEU 61 -9.186 -9.758 4.858 486 HD22 LEU 61 HD22 LEU 61 -7.594 -9.224 5.395 487 HD23 LEU 61 HD23 LEU 61 -7.793 -10.826 4.686 488 H THR 62 H THR 62 -3.534 -8.414 2.711 489 HA THR 62 HA THR 62 -3.938 -6.017 4.188 490 HB THR 62 HB THR 62 -1.253 -6.114 3.951 491 HG1 THR 62 HG1 THR 62 -1.945 -8.857 3.814 492 HG21 THR 62 HG21 THR 62 -1.248 -7.580 5.951 493 HG22 THR 62 HG22 THR 62 -2.968 -7.874 5.693 494 HG23 THR 62 HG23 THR 62 -2.395 -6.247 6.060 495 H ALA 63 H ALA 63 -2.274 -6.803 1.177 496 HA ALA 63 HA ALA 63 -1.277 -4.321 0.484 497 HB1 ALA 63 HB1 ALA 63 -1.297 -5.180 -1.839 498 HB2 ALA 63 HB2 ALA 63 -2.267 -6.550 -1.290 499 HB3 ALA 63 HB3 ALA 63 -0.629 -6.323 -0.676 500 H VAL 64 H VAL 64 -4.455 -5.710 -0.352 501 HA VAL 64 HA VAL 64 -5.258 -3.498 -1.912 502 HB VAL 64 HB VAL 64 -6.273 -5.751 -2.095 503 HG11 VAL 64 HG11 VAL 64 -7.678 -4.976 0.451 504 HG12 VAL 64 HG12 VAL 64 -6.530 -6.296 0.243 505 HG13 VAL 64 HG13 VAL 64 -8.095 -6.355 -0.565 506 HG21 VAL 64 HG21 VAL 64 -7.351 -3.853 -3.131 507 HG22 VAL 64 HG22 VAL 64 -8.172 -3.454 -1.623 508 HG23 VAL 64 HG23 VAL 64 -8.572 -4.943 -2.479 509 H GLN 65 H GLN 65 -5.682 -4.178 1.557 510 HA GLN 65 HA GLN 65 -7.420 -1.914 1.869 511 HB2 GLN 65 HB2 GLN 65 -7.165 -4.056 3.402 512 HB3 GLN 65 HB3 GLN 65 -5.977 -3.044 4.223 513 HG2 GLN 65 HG2 GLN 65 -7.746 -1.259 4.384 514 HG3 GLN 65 HG3 GLN 65 -8.901 -2.446 3.787 515 HE21 GLN 65 HE21 GLN 65 -6.854 -1.501 6.429 516 HE22 GLN 65 HE22 GLN 65 -7.591 -2.526 7.620 517 H ILE 66 H ILE 66 -3.975 -2.546 2.436 518 HA ILE 66 HA ILE 66 -3.317 -0.089 3.606 519 HB ILE 66 HB ILE 66 -1.689 -1.915 1.827 520 HG12 ILE 66 HG12 ILE 66 -1.400 -1.339 4.781 521 HG13 ILE 66 HG13 ILE 66 -2.401 -2.642 4.154 522 HG21 ILE 66 HG21 ILE 66 0.298 -0.644 2.468 523 HG22 ILE 66 HG22 ILE 66 -0.715 0.517 3.327 524 HG23 ILE 66 HG23 ILE 66 -0.842 0.361 1.575 525 HD11 ILE 66 HD11 ILE 66 -0.350 -3.555 3.041 526 HD12 ILE 66 HD12 ILE 66 -0.327 -3.581 4.804 527 HD13 ILE 66 HD13 ILE 66 0.584 -2.350 3.931 528 H ALA 67 H ALA 67 -3.560 -1.055 0.222 529 HA ALA 67 HA ALA 67 -2.684 1.358 -0.918 530 HB1 ALA 67 HB1 ALA 67 -3.761 0.555 -2.974 531 HB2 ALA 67 HB2 ALA 67 -4.544 -0.726 -2.050 532 HB3 ALA 67 HB3 ALA 67 -2.788 -0.693 -2.200 533 H SER 68 H SER 68 -5.951 0.252 -0.013 534 HA SER 68 HA SER 68 -7.229 2.565 -1.093 535 HB2 SER 68 HB2 SER 68 -9.102 1.685 0.583 536 HB3 SER 68 HB3 SER 68 -8.759 0.866 -0.938 537 HG SER 68 HG SER 68 -7.700 -0.711 0.121 538 H GLU 69 H GLU 69 -6.143 1.625 2.145 539 HA GLU 69 HA GLU 69 -7.211 3.777 3.579 540 HB2 GLU 69 HB2 GLU 69 -4.776 2.058 4.030 541 HB3 GLU 69 HB3 GLU 69 -5.229 3.334 5.153 542 HG2 GLU 69 HG2 GLU 69 -7.406 2.251 5.480 543 HG3 GLU 69 HG3 GLU 69 -6.916 0.961 4.384 544 H TYR 70 H TYR 70 -4.344 3.539 1.601 545 HA TYR 70 HA TYR 70 -3.455 6.198 2.387 546 HB2 TYR 70 HB2 TYR 70 -2.281 3.974 0.761 547 HB3 TYR 70 HB3 TYR 70 -1.673 5.613 0.553 548 HD1 TYR 70 HD1 TYR 70 -2.649 3.515 3.499 549 HD2 TYR 70 HD2 TYR 70 0.309 5.968 1.666 550 HE1 TYR 70 HE1 TYR 70 -1.206 3.240 5.471 551 HE2 TYR 70 HE2 TYR 70 1.760 5.697 3.629 552 HH TYR 70 HH TYR 70 1.152 3.395 6.072 553 H LEU 71 H LEU 71 -5.063 4.584 -0.254 554 HA LEU 71 HA LEU 71 -4.738 6.521 -2.260 555 HB2 LEU 71 HB2 LEU 71 -5.775 4.134 -2.369 556 HB3 LEU 71 HB3 LEU 71 -7.271 4.942 -1.949 557 HG LEU 71 HG LEU 71 -6.795 6.453 -4.004 558 HD11 LEU 71 HD11 LEU 71 -5.439 5.541 -5.738 559 HD12 LEU 71 HD12 LEU 71 -5.126 4.081 -4.805 560 HD13 LEU 71 HD13 LEU 71 -4.456 5.622 -4.278 561 HD21 LEU 71 HD21 LEU 71 -7.833 4.821 -5.534 562 HD22 LEU 71 HD22 LEU 71 -8.641 4.883 -3.971 563 HD23 LEU 71 HD23 LEU 71 -7.548 3.551 -4.350 564 H LYS 72 H LYS 72 -7.149 6.180 0.298 565 HA LYS 72 HA LYS 72 -8.792 8.327 -0.484 566 HB2 LYS 72 HB2 LYS 72 -9.742 8.209 1.759 567 HB3 LYS 72 HB3 LYS 72 -9.560 6.606 1.062 568 HG2 LYS 72 HG2 LYS 72 -7.902 6.002 2.527 569 HG3 LYS 72 HG3 LYS 72 -7.403 7.667 2.822 570 HD2 LYS 72 HD2 LYS 72 -9.318 8.071 4.196 571 HD3 LYS 72 HD3 LYS 72 -10.040 6.528 3.745 572 HE2 LYS 72 HE2 LYS 72 -9.052 6.456 5.987 573 HE3 LYS 72 HE3 LYS 72 -8.264 5.329 4.882 574 HZ1 LYS 72 HZ1 LYS 72 -7.183 8.035 5.395 575 HZ2 LYS 72 HZ2 LYS 72 -6.393 6.699 4.715 576 HZ3 LYS 72 HZ3 LYS 72 -6.776 6.708 6.366 577 H LEU 73 H LEU 73 -5.694 8.278 0.936 578 HA LEU 73 HA LEU 73 -5.964 10.910 2.148 579 HB2 LEU 73 HB2 LEU 73 -4.692 9.226 3.357 580 HB3 LEU 73 HB3 LEU 73 -3.621 9.014 1.986 581 HG LEU 73 HG LEU 73 -2.981 11.463 2.291 582 HD11 LEU 73 HD11 LEU 73 -4.289 10.993 4.967 583 HD12 LEU 73 HD12 LEU 73 -4.847 12.112 3.723 584 HD13 LEU 73 HD13 LEU 73 -3.302 12.386 4.527 585 HD21 LEU 73 HD21 LEU 73 -1.421 10.920 4.136 586 HD22 LEU 73 HD22 LEU 73 -1.462 9.701 2.863 587 HD23 LEU 73 HD23 LEU 73 -2.299 9.413 4.388 588 H LYS 74 H LYS 74 -4.580 9.392 -0.698 589 HA LYS 74 HA LYS 74 -3.040 11.705 -1.411 590 HB2 LYS 74 HB2 LYS 74 -2.289 10.522 -3.250 591 HB3 LYS 74 HB3 LYS 74 -2.635 9.237 -2.102 592 HG2 LYS 74 HG2 LYS 74 -4.750 8.785 -3.207 593 HG3 LYS 74 HG3 LYS 74 -4.461 10.110 -4.333 594 HD2 LYS 74 HD2 LYS 74 -2.604 7.759 -4.050 595 HD3 LYS 74 HD3 LYS 74 -3.947 7.793 -5.190 596 HE2 LYS 74 HE2 LYS 74 -2.944 9.941 -6.090 597 HE3 LYS 74 HE3 LYS 74 -1.514 9.560 -5.134 598 HZ1 LYS 74 HZ1 LYS 74 -2.624 8.104 -7.440 599 HZ2 LYS 74 HZ2 LYS 74 -1.608 7.318 -6.339 600 HZ3 LYS 74 HZ3 LYS 74 -1.050 8.668 -7.196 601 H GLU 75 H GLU 75 -6.274 10.575 -2.016 602 HA GLU 75 HA GLU 75 -6.776 12.316 -4.225 603 HB2 GLU 75 HB2 GLU 75 -9.117 11.674 -3.987 604 HB3 GLU 75 HB3 GLU 75 -8.081 10.258 -3.901 605 HG2 GLU 75 HG2 GLU 75 -8.357 10.117 -1.541 606 HG3 GLU 75 HG3 GLU 75 -9.185 11.667 -1.491 607 H GLU 76 H GLU 76 -7.220 12.528 -0.729 608 HA GLU 76 HA GLU 76 -8.712 14.952 -0.827 609 HB2 GLU 76 HB2 GLU 76 -8.368 15.108 1.567 610 HB3 GLU 76 HB3 GLU 76 -8.794 13.462 1.135 611 HG2 GLU 76 HG2 GLU 76 -6.440 12.819 1.299 612 HG3 GLU 76 HG3 GLU 76 -6.032 14.470 1.759 613 H TYR 77 H TYR 77 -5.333 14.147 -0.826 614 HA TYR 77 HA TYR 77 -4.212 16.622 -0.153 615 HB2 TYR 77 HB2 TYR 77 -2.812 14.671 -0.299 616 HB3 TYR 77 HB3 TYR 77 -3.254 14.406 -1.978 617 HD1 TYR 77 HD1 TYR 77 -2.254 17.680 -0.513 618 HD2 TYR 77 HD2 TYR 77 -1.103 14.380 -2.943 619 HE1 TYR 77 HE1 TYR 77 -0.246 18.909 -1.216 620 HE2 TYR 77 HE2 TYR 77 0.909 15.601 -3.654 621 HH TYR 77 HH TYR 77 1.704 17.899 -3.828 622 H GLN 78 H GLN 78 -5.094 15.265 -3.310 623 HA GLN 78 HA GLN 78 -4.472 17.588 -4.808 624 HB2 GLN 78 HB2 GLN 78 -6.289 15.242 -5.402 625 HB3 GLN 78 HB3 GLN 78 -5.929 16.510 -6.564 626 HG2 GLN 78 HG2 GLN 78 -3.614 15.917 -6.595 627 HG3 GLN 78 HG3 GLN 78 -3.842 14.767 -5.275 628 HE21 GLN 78 HE21 GLN 78 -4.532 15.443 -8.631 629 HE22 GLN 78 HE22 GLN 78 -4.874 13.814 -9.095 630 H ARG 79 H ARG 79 -7.373 16.404 -3.239 631 HA ARG 79 HA ARG 79 -9.256 18.158 -4.313 632 HB2 ARG 79 HB2 ARG 79 -9.608 16.078 -2.868 633 HB3 ARG 79 HB3 ARG 79 -9.353 17.138 -1.488 634 HG2 ARG 79 HG2 ARG 79 -11.234 18.546 -2.303 635 HG3 ARG 79 HG3 ARG 79 -11.528 17.339 -3.560 636 HD2 ARG 79 HD2 ARG 79 -13.023 16.853 -1.779 637 HD3 ARG 79 HD3 ARG 79 -11.748 15.638 -1.722 638 HE ARG 79 HE ARG 79 -11.566 18.004 0.003 639 HH11 ARG 79 HH11 ARG 79 -11.993 14.530 -0.321 640 HH12 ARG 79 HH12 ARG 79 -11.716 14.224 1.366 641 HH21 ARG 79 HH21 ARG 79 -11.229 17.587 2.212 642 HH22 ARG 79 HH22 ARG 79 -11.277 15.950 2.797 643 H LEU 80 H LEU 80 -7.296 18.522 -1.350 644 HA LEU 80 HA LEU 80 -8.463 21.075 -0.767 645 HB2 LEU 80 HB2 LEU 80 -6.931 21.218 1.061 646 HB3 LEU 80 HB3 LEU 80 -7.576 19.594 0.995 647 HG LEU 80 HG LEU 80 -5.278 19.293 -0.441 648 HD11 LEU 80 HD11 LEU 80 -4.625 21.230 1.777 649 HD12 LEU 80 HD12 LEU 80 -4.581 21.605 0.052 650 HD13 LEU 80 HD13 LEU 80 -3.477 20.404 0.724 651 HD21 LEU 80 HD21 LEU 80 -4.357 18.288 1.608 652 HD22 LEU 80 HD22 LEU 80 -6.023 17.805 1.305 653 HD23 LEU 80 HD23 LEU 80 -5.661 19.019 2.535 654 H ARG 81 H ARG 81 -5.698 19.976 -2.566 655 HA ARG 81 HA ARG 81 -4.340 22.467 -2.602 656 HB2 ARG 81 HB2 ARG 81 -4.135 19.948 -4.216 657 HB3 ARG 81 HB3 ARG 81 -3.257 21.389 -4.716 658 HG2 ARG 81 HG2 ARG 81 -2.926 20.779 -1.888 659 HG3 ARG 81 HG3 ARG 81 -2.363 19.486 -2.947 660 HD2 ARG 81 HD2 ARG 81 -0.552 21.021 -2.483 661 HD3 ARG 81 HD3 ARG 81 -1.003 21.122 -4.184 662 HE ARG 81 HE ARG 81 -2.212 23.081 -2.408 663 HH11 ARG 81 HH11 ARG 81 0.351 22.329 -4.669 664 HH12 ARG 81 HH12 ARG 81 0.663 23.990 -5.063 665 HH21 ARG 81 HH21 ARG 81 -1.785 25.273 -2.905 666 HH22 ARG 81 HH22 ARG 81 -0.546 25.663 -4.054 667 H GLU 82 H GLU 82 -6.690 20.921 -4.745 668 HA GLU 82 HA GLU 82 -6.623 23.052 -6.672 669 HB2 GLU 82 HB2 GLU 82 -8.553 21.916 -7.692 670 HB3 GLU 82 HB3 GLU 82 -7.234 20.797 -7.375 671 HG2 GLU 82 HG2 GLU 82 -8.364 19.713 -5.708 672 HG3 GLU 82 HG3 GLU 82 -9.374 21.108 -5.334 673 H GLN 83 H GLN 83 -8.083 22.655 -3.644 674 HA GLN 83 HA GLN 83 -10.329 24.405 -4.211 675 HB2 GLN 83 HB2 GLN 83 -11.252 23.583 -2.321 676 HB3 GLN 83 HB3 GLN 83 -9.997 22.361 -2.424 677 HG2 GLN 83 HG2 GLN 83 -8.599 23.683 -0.917 678 HG3 GLN 83 HG3 GLN 83 -9.869 24.898 -0.808 679 HE21 GLN 83 HE21 GLN 83 -11.831 24.344 0.234 680 HE22 GLN 83 HE22 GLN 83 -11.888 23.057 1.388 681 H LEU 84 H LEU 84 -7.077 24.710 -3.339 682 HA LEU 84 HA LEU 84 -7.483 27.267 -1.982 683 HB2 LEU 84 HB2 LEU 84 -5.475 25.212 -1.889 684 HB3 LEU 84 HB3 LEU 84 -4.722 26.732 -2.316 685 HG LEU 84 HG LEU 84 -4.619 26.363 0.085 686 HD11 LEU 84 HD11 LEU 84 -5.450 28.465 0.850 687 HD12 LEU 84 HD12 LEU 84 -6.605 28.561 -0.474 688 HD13 LEU 84 HD13 LEU 84 -4.876 28.679 -0.803 689 HD21 LEU 84 HD21 LEU 84 -7.602 26.087 -0.145 690 HD22 LEU 84 HD22 LEU 84 -6.814 26.505 1.374 691 HD23 LEU 84 HD23 LEU 84 -6.441 24.975 0.579 692 H LYS 85 H LYS 85 -7.518 26.384 -5.046 693 HA LYS 85 HA LYS 85 -5.788 28.556 -6.014 694 HB2 LYS 85 HB2 LYS 85 -5.875 27.553 -8.171 695 HB3 LYS 85 HB3 LYS 85 -5.611 26.241 -7.029 696 HG2 LYS 85 HG2 LYS 85 -8.032 25.737 -7.103 697 HG3 LYS 85 HG3 LYS 85 -8.225 26.983 -8.334 698 HD2 LYS 85 HD2 LYS 85 -6.725 25.763 -9.819 699 HD3 LYS 85 HD3 LYS 85 -6.487 24.529 -8.580 700 HE2 LYS 85 HE2 LYS 85 -8.881 24.002 -8.652 701 HE3 LYS 85 HE3 LYS 85 -9.108 25.229 -9.896 702 HZ1 LYS 85 HZ1 LYS 85 -7.819 23.992 -11.419 703 HZ2 LYS 85 HZ2 LYS 85 -8.900 22.896 -10.718 704 HZ3 LYS 85 HZ3 LYS 85 -7.283 22.918 -10.226 705 H LYS 86 H LYS 86 -6.822 29.643 -8.072 706 HA LYS 86 HA LYS 86 -9.428 30.641 -7.194 707 HB2 LYS 86 HB2 LYS 86 -7.651 32.293 -7.614 708 HB3 LYS 86 HB3 LYS 86 -7.511 31.728 -9.272 709 HG2 LYS 86 HG2 LYS 86 -9.926 32.370 -9.574 710 HG3 LYS 86 HG3 LYS 86 -9.824 33.160 -8.000 711 HD2 LYS 86 HD2 LYS 86 -8.036 34.591 -8.815 712 HD3 LYS 86 HD3 LYS 86 -8.075 33.777 -10.377 713 HE2 LYS 86 HE2 LYS 86 -10.413 34.516 -10.665 714 HE3 LYS 86 HE3 LYS 86 -10.297 35.394 -9.144 715 HZ1 LYS 86 HZ1 LYS 86 -9.933 36.816 -11.081 716 HZ2 LYS 86 HZ2 LYS 86 -8.591 35.889 -11.516 717 HZ3 LYS 86 HZ3 LYS 86 -8.577 36.770 -10.072 718 H1 GLY 1 H1 GLY 1 -33.013 -9.999 17.736 719 H2 GLY 1 H2 GLY 1 -32.667 -11.600 17.327 720 H3 GLY 1 H3 GLY 1 -34.166 -10.934 16.927 721 HA2 GLY 1 HA3 GLY 1 -31.546 -10.104 15.825 722 HA3 GLY 1 HA2 GLY 1 -32.757 -11.060 14.985 723 H SER 2 H SER 2 -31.734 -7.912 15.895 724 HA SER 2 HA SER 2 -34.146 -6.750 14.671 725 HB2 SER 2 HB2 SER 2 -33.422 -6.145 17.098 726 HB3 SER 2 HB3 SER 2 -32.163 -5.190 16.319 727 HG SER 2 HG SER 2 -34.271 -4.143 16.845 728 H HIS 3 H HIS 3 -33.333 -4.329 13.902 729 HA HIS 3 HA HIS 3 -31.218 -4.896 11.928 730 HB2 HIS 3 HB2 HIS 3 -33.754 -3.298 11.752 731 HB3 HIS 3 HB3 HIS 3 -32.390 -2.881 10.719 732 HD1 HIS 3 HD1 HIS 3 -32.234 -4.136 8.576 733 HD2 HIS 3 HD2 HIS 3 -34.593 -6.110 11.370 734 HE1 HIS 3 HE1 HIS 3 -33.199 -6.117 7.367 735 HE2 HIS 3 HE2 HIS 3 -34.675 -7.262 9.058 736 H MET 4 H MET 4 -29.767 -3.177 11.376 737 HA MET 4 HA MET 4 -28.982 -1.618 13.659 738 HB2 MET 4 HB2 MET 4 -27.470 -2.763 11.904 739 HB3 MET 4 HB3 MET 4 -27.824 -1.373 10.890 740 HG2 MET 4 HG2 MET 4 -25.711 -1.113 12.051 741 HG3 MET 4 HG3 MET 4 -26.874 0.111 12.560 742 HE1 MET 4 HE1 MET 4 -24.038 -1.387 13.953 743 HE2 MET 4 HE2 MET 4 -24.449 -1.021 15.629 744 HE3 MET 4 HE3 MET 4 -24.660 0.208 14.379 745 H THR 5 H THR 5 -29.481 0.453 14.067 746 HA THR 5 HA THR 5 -31.165 1.869 12.160 747 HB THR 5 HB THR 5 -30.489 3.147 14.742 748 HG1 THR 5 HG1 THR 5 -32.224 0.886 14.680 749 HG21 THR 5 HG21 THR 5 -32.928 3.538 14.748 750 HG22 THR 5 HG22 THR 5 -33.073 2.579 13.277 751 HG23 THR 5 HG23 THR 5 -32.172 4.093 13.254 752 H GLU 6 H GLU 6 -28.287 1.584 11.646 753 HA GLU 6 HA GLU 6 -27.750 4.289 10.919 754 HB2 GLU 6 HB2 GLU 6 -25.635 4.542 12.123 755 HB3 GLU 6 HB3 GLU 6 -26.970 4.356 13.250 756 HG2 GLU 6 HG2 GLU 6 -26.369 2.058 13.650 757 HG3 GLU 6 HG3 GLU 6 -25.104 2.145 12.421 758 H GLN 7 H GLN 7 -25.569 4.419 9.789 759 HA GLN 7 HA GLN 7 -25.009 1.839 8.476 760 HB2 GLN 7 HB2 GLN 7 -26.225 3.665 7.131 761 HB3 GLN 7 HB3 GLN 7 -24.685 4.514 7.138 762 HG2 GLN 7 HG2 GLN 7 -23.622 2.712 5.963 763 HG3 GLN 7 HG3 GLN 7 -25.075 1.721 6.091 764 HE21 GLN 7 HE21 GLN 7 -23.650 2.560 3.705 765 HE22 GLN 7 HE22 GLN 7 -24.779 3.457 2.752 766 HA PRO 8 HA PRO 8 -20.935 3.003 10.063 767 HB2 PRO 8 HB2 PRO 8 -20.107 0.522 10.622 768 HB3 PRO 8 HB3 PRO 8 -21.323 1.312 11.627 769 HG2 PRO 8 HG2 PRO 8 -21.666 -0.777 9.525 770 HG3 PRO 8 HG3 PRO 8 -22.504 -0.591 11.076 771 HD2 PRO 8 HD2 PRO 8 -23.478 0.216 8.583 772 HD3 PRO 8 HD3 PRO 8 -24.093 0.749 10.160 773 H LYS 9 H LYS 9 -18.683 1.697 9.478 774 HA LYS 9 HA LYS 9 -18.350 2.059 6.696 775 HB2 LYS 9 HB2 LYS 9 -16.596 1.005 8.882 776 HB3 LYS 9 HB3 LYS 9 -16.103 0.807 7.207 777 HG2 LYS 9 HG2 LYS 9 -16.740 3.454 7.266 778 HG3 LYS 9 HG3 LYS 9 -16.127 3.202 8.901 779 HD2 LYS 9 HD2 LYS 9 -14.082 2.186 7.947 780 HD3 LYS 9 HD3 LYS 9 -14.691 2.519 6.325 781 HE2 LYS 9 HE2 LYS 9 -14.766 4.951 6.978 782 HE3 LYS 9 HE3 LYS 9 -13.914 4.506 8.455 783 HZ1 LYS 9 HZ1 LYS 9 -12.917 4.742 5.742 784 HZ2 LYS 9 HZ2 LYS 9 -12.371 3.373 6.578 785 HZ3 LYS 9 HZ3 LYS 9 -12.101 4.913 7.220 786 H THR 10 H THR 10 -19.256 0.740 5.255 787 HA THR 10 HA THR 10 -19.906 -1.975 5.843 788 HB THR 10 HB THR 10 -21.186 -0.357 4.318 789 HG1 THR 10 HG1 THR 10 -22.069 -2.076 3.289 790 HG21 THR 10 HG21 THR 10 -19.335 0.343 2.903 791 HG22 THR 10 HG22 THR 10 -20.580 -0.446 1.935 792 HG23 THR 10 HG23 THR 10 -19.104 -1.316 2.353 793 H ARG 11 H ARG 11 -19.369 -3.709 4.221 794 HA ARG 11 HA ARG 11 -16.484 -3.643 3.642 795 HB2 ARG 11 HB2 ARG 11 -16.683 -6.195 3.807 796 HB3 ARG 11 HB3 ARG 11 -16.755 -5.286 5.309 797 HG2 ARG 11 HG2 ARG 11 -19.162 -5.515 5.371 798 HG3 ARG 11 HG3 ARG 11 -19.147 -6.329 3.805 799 HD2 ARG 11 HD2 ARG 11 -17.763 -8.123 4.808 800 HD3 ARG 11 HD3 ARG 11 -17.909 -7.320 6.373 801 HE ARG 11 HE ARG 11 -20.457 -7.802 5.196 802 HH11 ARG 11 HH11 ARG 11 -17.873 -9.378 6.954 803 HH12 ARG 11 HH12 ARG 11 -18.910 -10.579 7.646 804 HH21 ARG 11 HH21 ARG 11 -21.816 -9.387 6.088 805 HH22 ARG 11 HH22 ARG 11 -21.156 -10.589 7.152 806 H VAL 12 H VAL 12 -15.825 -4.130 1.612 807 HA VAL 12 HA VAL 12 -17.970 -4.665 -0.331 808 HB VAL 12 HB VAL 12 -16.824 -2.464 -0.537 809 HG11 VAL 12 HG11 VAL 12 -14.429 -4.206 -1.018 810 HG12 VAL 12 HG12 VAL 12 -14.611 -2.873 0.121 811 HG13 VAL 12 HG13 VAL 12 -14.520 -2.549 -1.613 812 HG21 VAL 12 HG21 VAL 12 -16.483 -4.369 -2.849 813 HG22 VAL 12 HG22 VAL 12 -16.415 -2.611 -2.967 814 HG23 VAL 12 HG23 VAL 12 -17.910 -3.403 -2.473 815 H SER 13 H SER 13 -17.664 -6.141 -1.961 816 HA SER 13 HA SER 13 -15.552 -8.117 -1.490 817 HB2 SER 13 HB2 SER 13 -17.071 -9.498 -3.063 818 HB3 SER 13 HB3 SER 13 -17.665 -9.169 -1.434 819 HG SER 13 HG SER 13 -18.333 -7.737 -3.798 820 H VAL 14 H VAL 14 -13.863 -8.149 -2.861 821 HA VAL 14 HA VAL 14 -14.283 -7.183 -5.609 822 HB VAL 14 HB VAL 14 -12.054 -6.138 -5.589 823 HG11 VAL 14 HG11 VAL 14 -12.634 -4.164 -4.243 824 HG12 VAL 14 HG12 VAL 14 -13.930 -5.088 -3.485 825 HG13 VAL 14 HG13 VAL 14 -13.993 -4.740 -5.211 826 HG21 VAL 14 HG21 VAL 14 -11.058 -7.469 -3.786 827 HG22 VAL 14 HG22 VAL 14 -12.096 -6.650 -2.620 828 HG23 VAL 14 HG23 VAL 14 -10.872 -5.737 -3.502 829 H ARG 15 H ARG 15 -12.250 -7.776 -6.976 830 HA ARG 15 HA ARG 15 -11.312 -10.445 -6.190 831 HB2 ARG 15 HB2 ARG 15 -13.154 -10.463 -7.924 832 HB3 ARG 15 HB3 ARG 15 -12.035 -9.653 -9.011 833 HG2 ARG 15 HG2 ARG 15 -10.855 -11.526 -9.404 834 HG3 ARG 15 HG3 ARG 15 -11.021 -12.106 -7.745 835 HD2 ARG 15 HD2 ARG 15 -13.130 -12.213 -9.899 836 HD3 ARG 15 HD3 ARG 15 -12.198 -13.572 -9.276 837 HE ARG 15 HE ARG 15 -13.630 -12.209 -7.214 838 HH11 ARG 15 HH11 ARG 15 -13.941 -14.567 -9.776 839 HH12 ARG 15 HH12 ARG 15 -15.292 -15.376 -9.045 840 HH21 ARG 15 HH21 ARG 15 -15.403 -13.251 -6.233 841 HH22 ARG 15 HH22 ARG 15 -16.125 -14.624 -7.026 842 H ILE 16 H ILE 16 -9.181 -10.762 -6.377 843 HA ILE 16 HA ILE 16 -7.585 -8.961 -8.067 844 HB ILE 16 HB ILE 16 -6.768 -9.740 -5.261 845 HG12 ILE 16 HG12 ILE 16 -7.556 -6.961 -6.120 846 HG13 ILE 16 HG13 ILE 16 -8.744 -8.095 -5.484 847 HG21 ILE 16 HG21 ILE 16 -4.961 -8.160 -5.573 848 HG22 ILE 16 HG22 ILE 16 -5.579 -7.732 -7.168 849 HG23 ILE 16 HG23 ILE 16 -4.941 -9.351 -6.874 850 HD11 ILE 16 HD11 ILE 16 -8.009 -6.684 -3.712 851 HD12 ILE 16 HD12 ILE 16 -6.318 -7.020 -4.075 852 HD13 ILE 16 HD13 ILE 16 -7.350 -8.298 -3.436 853 H TYR 17 H TYR 17 -6.192 -10.058 -9.303 854 HA TYR 17 HA TYR 17 -5.035 -11.753 -10.254 855 HB2 TYR 17 HB2 TYR 17 -4.019 -11.493 -7.763 856 HB3 TYR 17 HB3 TYR 17 -4.542 -13.174 -7.704 857 HD1 TYR 17 HD1 TYR 17 -2.670 -10.866 -9.984 858 HD2 TYR 17 HD2 TYR 17 -3.030 -14.794 -8.381 859 HE1 TYR 17 HE1 TYR 17 -0.626 -11.532 -11.179 860 HE2 TYR 17 HE2 TYR 17 -0.985 -15.473 -9.570 861 HH TYR 17 HH TYR 17 1.180 -13.291 -10.925 862 H GLY 18 H GLY 18 -7.892 -12.066 -9.856 863 HA2 GLY 18 HA2 GLY 18 -9.359 -13.704 -10.588 864 HA3 GLY 18 HA3 GLY 18 -8.053 -14.873 -10.518 865 H GLN 19 H GLN 19 -8.114 -13.324 -7.580 866 HA GLN 19 HA GLN 19 -9.843 -15.429 -6.455 867 HB2 GLN 19 HB2 GLN 19 -7.361 -14.105 -5.389 868 HB3 GLN 19 HB3 GLN 19 -8.486 -14.936 -4.322 869 HG2 GLN 19 HG2 GLN 19 -7.026 -16.147 -6.658 870 HG3 GLN 19 HG3 GLN 19 -6.638 -16.385 -4.953 871 HE21 GLN 19 HE21 GLN 19 -8.819 -17.156 -7.534 872 HE22 GLN 19 HE22 GLN 19 -9.640 -18.448 -6.731 873 H ASP 20 H ASP 20 -11.242 -14.889 -4.726 874 HA ASP 20 HA ASP 20 -12.203 -12.144 -4.905 875 HB2 ASP 20 HB2 ASP 20 -13.679 -14.248 -5.040 876 HB3 ASP 20 HB3 ASP 20 -13.472 -14.345 -3.295 877 H TYR 21 H TYR 21 -12.199 -10.687 -3.285 878 HA TYR 21 HA TYR 21 -11.214 -11.513 -0.647 879 HB2 TYR 21 HB2 TYR 21 -10.152 -9.190 -2.277 880 HB3 TYR 21 HB3 TYR 21 -9.790 -9.457 -0.575 881 HD1 TYR 21 HD1 TYR 21 -8.436 -11.424 0.101 882 HD2 TYR 21 HD2 TYR 21 -9.049 -10.429 -3.986 883 HE1 TYR 21 HE1 TYR 21 -6.570 -12.892 -0.530 884 HE2 TYR 21 HE2 TYR 21 -7.186 -11.893 -4.629 885 HH TYR 21 HH TYR 21 -5.213 -12.886 -3.677 886 H THR 22 H THR 22 -11.880 -10.159 1.075 887 HA THR 22 HA THR 22 -13.940 -8.171 0.397 888 HB THR 22 HB THR 22 -14.199 -10.053 2.744 889 HG1 THR 22 HG1 THR 22 -14.360 -10.766 0.241 890 HG21 THR 22 HG21 THR 22 -16.214 -8.348 1.272 891 HG22 THR 22 HG22 THR 22 -15.482 -7.954 2.827 892 HG23 THR 22 HG23 THR 22 -16.537 -9.359 2.682 893 H ILE 23 H ILE 23 -13.478 -6.265 1.265 894 HA ILE 23 HA ILE 23 -12.080 -6.150 3.839 895 HB ILE 23 HB ILE 23 -10.629 -4.329 3.100 896 HG12 ILE 23 HG12 ILE 23 -12.174 -3.682 1.159 897 HG13 ILE 23 HG13 ILE 23 -10.442 -3.540 0.907 898 HG21 ILE 23 HG21 ILE 23 -10.387 -6.992 1.783 899 HG22 ILE 23 HG22 ILE 23 -9.474 -6.308 3.128 900 HG23 ILE 23 HG23 ILE 23 -9.183 -5.738 1.486 901 HD11 ILE 23 HD11 ILE 23 -12.115 -4.634 -0.861 902 HD12 ILE 23 HD12 ILE 23 -11.676 -6.081 0.043 903 HD13 ILE 23 HD13 ILE 23 -10.426 -5.102 -0.717 904 H VAL 24 H VAL 24 -12.016 -3.724 4.557 905 HA VAL 24 HA VAL 24 -14.769 -2.821 4.461 906 HB VAL 24 HB VAL 24 -12.437 -1.644 5.987 907 HG11 VAL 24 HG11 VAL 24 -15.413 -1.290 6.335 908 HG12 VAL 24 HG12 VAL 24 -14.292 -0.088 5.695 909 HG13 VAL 24 HG13 VAL 24 -14.164 -0.605 7.376 910 HG21 VAL 24 HG21 VAL 24 -13.341 -2.851 7.926 911 HG22 VAL 24 HG22 VAL 24 -12.806 -3.950 6.655 912 HG23 VAL 24 HG23 VAL 24 -14.526 -3.631 6.877 913 H GLY 25 H GLY 25 -15.484 -1.252 3.148 914 HA2 GLY 25 HA2 GLY 25 -13.624 0.813 2.236 915 HA3 GLY 25 HA3 GLY 25 -14.401 -0.176 1.004 916 H ALA 26 H ALA 26 -14.788 2.394 3.274 917 HA ALA 26 HA ALA 26 -17.543 2.777 2.286 918 HB1 ALA 26 HB1 ALA 26 -18.127 3.755 4.409 919 HB2 ALA 26 HB2 ALA 26 -16.470 3.576 4.981 920 HB3 ALA 26 HB3 ALA 26 -17.449 2.146 4.652 921 H GLU 27 H GLU 27 -14.580 3.934 1.838 922 HA GLU 27 HA GLU 27 -14.938 6.735 2.214 923 HB2 GLU 27 HB2 GLU 27 -12.903 4.996 0.888 924 HB3 GLU 27 HB3 GLU 27 -12.939 6.700 0.465 925 HG2 GLU 27 HG2 GLU 27 -11.344 6.021 2.295 926 HG3 GLU 27 HG3 GLU 27 -12.417 7.373 2.644 927 H SER 28 H SER 28 -14.774 4.724 -0.717 928 HA SER 28 HA SER 28 -16.947 6.135 -1.937 929 HB2 SER 28 HB2 SER 28 -15.257 6.526 -4.002 930 HB3 SER 28 HB3 SER 28 -15.584 7.760 -2.788 931 HG SER 28 HG SER 28 -13.608 7.599 -2.117 932 HA PRO 29 HA PRO 29 -17.334 1.865 -3.262 933 HB2 PRO 29 HB2 PRO 29 -19.245 2.507 -5.208 934 HB3 PRO 29 HB3 PRO 29 -19.566 2.008 -3.546 935 HG2 PRO 29 HG2 PRO 29 -19.506 4.740 -4.728 936 HG3 PRO 29 HG3 PRO 29 -20.528 4.093 -3.432 937 HD2 PRO 29 HD2 PRO 29 -18.473 5.724 -2.915 938 HD3 PRO 29 HD3 PRO 29 -18.884 4.383 -1.825 939 H ALA 30 H ALA 30 -17.050 4.539 -5.589 940 HA ALA 30 HA ALA 30 -16.299 2.882 -7.778 941 HB1 ALA 30 HB1 ALA 30 -15.896 5.836 -7.345 942 HB2 ALA 30 HB2 ALA 30 -17.274 5.072 -8.135 943 HB3 ALA 30 HB3 ALA 30 -15.676 4.990 -8.876 944 H HIS 31 H HIS 31 -14.469 4.794 -5.425 945 HA HIS 31 HA HIS 31 -11.938 4.364 -6.635 946 HB2 HIS 31 HB2 HIS 31 -12.820 5.349 -3.945 947 HB3 HIS 31 HB3 HIS 31 -11.123 4.981 -4.230 948 HD1 HIS 31 HD1 HIS 31 -11.064 7.722 -3.685 949 HD2 HIS 31 HD2 HIS 31 -12.554 6.487 -7.381 950 HE1 HIS 31 HE1 HIS 31 -10.953 9.738 -5.181 951 HE2 HIS 31 HE2 HIS 31 -11.882 8.983 -7.394 952 H ILE 32 H ILE 32 -13.557 2.789 -3.885 953 HA ILE 32 HA ILE 32 -11.460 1.011 -3.279 954 HB ILE 32 HB ILE 32 -13.079 -0.313 -2.024 955 HG12 ILE 32 HG12 ILE 32 -15.175 1.492 -3.258 956 HG13 ILE 32 HG13 ILE 32 -14.951 -0.211 -3.629 957 HG21 ILE 32 HG21 ILE 32 -13.670 2.616 -1.644 958 HG22 ILE 32 HG22 ILE 32 -12.153 1.850 -1.173 959 HG23 ILE 32 HG23 ILE 32 -13.663 1.342 -0.423 960 HD11 ILE 32 HD11 ILE 32 -15.405 -0.642 -1.171 961 HD12 ILE 32 HD12 ILE 32 -16.763 -0.118 -2.162 962 HD13 ILE 32 HD13 ILE 32 -15.959 1.031 -1.093 963 H ARG 33 H ARG 33 -13.942 0.868 -5.713 964 HA ARG 33 HA ARG 33 -13.719 -1.912 -6.289 965 HB2 ARG 33 HB2 ARG 33 -14.920 0.460 -7.636 966 HB3 ARG 33 HB3 ARG 33 -14.618 -0.967 -8.612 967 HG2 ARG 33 HG2 ARG 33 -16.036 -2.304 -7.213 968 HG3 ARG 33 HG3 ARG 33 -16.229 -0.970 -6.073 969 HD2 ARG 33 HD2 ARG 33 -18.154 -1.307 -7.657 970 HD3 ARG 33 HD3 ARG 33 -17.459 0.315 -7.644 971 HE ARG 33 HE ARG 33 -16.609 -1.620 -9.689 972 HH11 ARG 33 HH11 ARG 33 -18.221 1.383 -8.849 973 HH12 ARG 33 HH12 ARG 33 -18.259 1.962 -10.482 974 HH21 ARG 33 HH21 ARG 33 -16.690 -0.862 -11.841 975 HH22 ARG 33 HH22 ARG 33 -17.400 0.685 -12.181 976 H LEU 34 H LEU 34 -12.073 0.961 -7.366 977 HA LEU 34 HA LEU 34 -10.690 -0.362 -9.519 978 HB2 LEU 34 HB2 LEU 34 -10.774 1.769 -10.194 979 HB3 LEU 34 HB3 LEU 34 -11.040 2.372 -8.574 980 HG LEU 34 HG LEU 34 -8.301 1.564 -8.839 981 HD11 LEU 34 HD11 LEU 34 -9.292 3.516 -10.909 982 HD12 LEU 34 HD12 LEU 34 -8.620 1.916 -11.226 983 HD13 LEU 34 HD13 LEU 34 -7.602 3.179 -10.533 984 HD21 LEU 34 HD21 LEU 34 -9.624 4.253 -8.485 985 HD22 LEU 34 HD22 LEU 34 -7.922 3.895 -8.194 986 HD23 LEU 34 HD23 LEU 34 -9.164 3.142 -7.194 987 H VAL 35 H VAL 35 -10.117 0.241 -6.157 988 HA VAL 35 HA VAL 35 -7.336 0.166 -6.022 989 HB VAL 35 HB VAL 35 -9.292 -1.014 -4.028 990 HG11 VAL 35 HG11 VAL 35 -7.532 -0.813 -2.398 991 HG12 VAL 35 HG12 VAL 35 -6.452 -0.096 -3.594 992 HG13 VAL 35 HG13 VAL 35 -6.946 -1.781 -3.751 993 HG21 VAL 35 HG21 VAL 35 -9.199 1.104 -2.906 994 HG22 VAL 35 HG22 VAL 35 -9.632 1.394 -4.589 995 HG23 VAL 35 HG23 VAL 35 -7.988 1.705 -4.035 996 H ALA 36 H ALA 36 -9.654 -2.457 -6.285 997 HA ALA 36 HA ALA 36 -7.946 -4.618 -5.792 998 HB1 ALA 36 HB1 ALA 36 -10.273 -4.627 -7.699 999 HB2 ALA 36 HB2 ALA 36 -10.443 -4.665 -5.946 1000 HB3 ALA 36 HB3 ALA 36 -9.620 -5.985 -6.781 1001 H ALA 37 H ALA 37 -8.790 -3.013 -8.841 1002 HA ALA 37 HA ALA 37 -7.220 -4.696 -10.496 1003 HB1 ALA 37 HB1 ALA 37 -9.083 -3.344 -11.351 1004 HB2 ALA 37 HB2 ALA 37 -7.587 -3.026 -12.227 1005 HB3 ALA 37 HB3 ALA 37 -8.160 -1.876 -11.020 1006 H PHE 38 H PHE 38 -6.542 -1.867 -8.595 1007 HA PHE 38 HA PHE 38 -4.109 -1.104 -9.820 1008 HB2 PHE 38 HB2 PHE 38 -5.348 0.412 -8.365 1009 HB3 PHE 38 HB3 PHE 38 -5.113 -0.668 -6.997 1010 HD1 PHE 38 HD2 PHE 38 -2.996 1.028 -9.571 1011 HD2 PHE 38 HD1 PHE 38 -3.537 -0.016 -5.477 1012 HE1 PHE 38 HE2 PHE 38 -0.925 2.227 -8.995 1013 HE2 PHE 38 HE1 PHE 38 -1.465 1.181 -4.892 1014 HZ PHE 38 HZ PHE 38 -0.157 2.303 -6.655 1015 H VAL 39 H VAL 39 -4.874 -3.195 -7.070 1016 HA VAL 39 HA VAL 39 -2.149 -3.851 -6.504 1017 HB VAL 39 HB VAL 39 -4.663 -5.344 -5.705 1018 HG11 VAL 39 HG11 VAL 39 -2.662 -6.722 -5.493 1019 HG12 VAL 39 HG12 VAL 39 -3.276 -6.270 -3.902 1020 HG13 VAL 39 HG13 VAL 39 -1.866 -5.448 -4.569 1021 HG21 VAL 39 HG21 VAL 39 -3.618 -3.976 -3.515 1022 HG22 VAL 39 HG22 VAL 39 -5.085 -3.582 -4.412 1023 HG23 VAL 39 HG23 VAL 39 -3.554 -2.821 -4.845 1024 H ASP 40 H ASP 40 -4.753 -5.328 -8.351 1025 HA ASP 40 HA ASP 40 -3.632 -7.791 -8.973 1026 HB2 ASP 40 HB2 ASP 40 -5.950 -7.185 -9.503 1027 HB3 ASP 40 HB3 ASP 40 -5.388 -6.009 -10.683 1028 H ASP 41 H ASP 41 -3.272 -4.676 -10.606 1029 HA ASP 41 HA ASP 41 -1.616 -5.618 -12.702 1030 HB2 ASP 41 HB2 ASP 41 -2.791 -3.571 -13.034 1031 HB3 ASP 41 HB3 ASP 41 -2.108 -2.864 -11.574 1032 H LYS 42 H LYS 42 -0.918 -4.121 -9.579 1033 HA LYS 42 HA LYS 42 1.855 -3.849 -9.966 1034 HB2 LYS 42 HB2 LYS 42 0.095 -3.897 -7.548 1035 HB3 LYS 42 HB3 LYS 42 1.844 -3.903 -7.360 1036 HG2 LYS 42 HG2 LYS 42 1.101 -1.874 -9.239 1037 HG3 LYS 42 HG3 LYS 42 0.148 -1.690 -7.765 1038 HD2 LYS 42 HD2 LYS 42 2.175 -0.399 -7.571 1039 HD3 LYS 42 HD3 LYS 42 2.246 -1.757 -6.451 1040 HE2 LYS 42 HE2 LYS 42 4.044 -2.630 -7.458 1041 HE3 LYS 42 HE3 LYS 42 3.361 -2.390 -9.064 1042 HZ1 LYS 42 HZ1 LYS 42 5.427 -1.119 -8.642 1043 HZ2 LYS 42 HZ2 LYS 42 4.609 -0.220 -7.459 1044 HZ3 LYS 42 HZ3 LYS 42 4.113 -0.147 -9.079 1045 H MET 43 H MET 43 -0.011 -6.465 -8.388 1046 HA MET 43 HA MET 43 2.356 -7.957 -7.799 1047 HB2 MET 43 HB2 MET 43 0.905 -9.709 -7.041 1048 HB3 MET 43 HB3 MET 43 0.246 -8.174 -6.500 1049 HG2 MET 43 HG2 MET 43 -1.347 -8.250 -8.400 1050 HG3 MET 43 HG3 MET 43 -0.737 -9.859 -8.789 1051 HE1 MET 43 HE1 MET 43 -1.699 -11.848 -5.527 1052 HE2 MET 43 HE2 MET 43 -0.255 -10.838 -5.583 1053 HE3 MET 43 HE3 MET 43 -0.699 -11.817 -6.981 1054 H HIS 44 H HIS 44 0.442 -7.540 -10.585 1055 HA HIS 44 HA HIS 44 0.912 -10.027 -11.869 1056 HB2 HIS 44 HB2 HIS 44 -0.863 -8.419 -12.555 1057 HB3 HIS 44 HB3 HIS 44 0.388 -7.325 -13.133 1058 HD1 HIS 44 HD1 HIS 44 1.071 -7.599 -15.511 1059 HD2 HIS 44 HD2 HIS 44 -0.903 -10.953 -14.046 1060 HE1 HIS 44 HE1 HIS 44 0.749 -9.113 -17.492 1061 HE2 HIS 44 HE2 HIS 44 -0.608 -11.042 -16.614 1062 H GLU 45 H GLU 45 2.513 -6.848 -12.117 1063 HA GLU 45 HA GLU 45 4.542 -7.804 -13.885 1064 HB2 GLU 45 HB2 GLU 45 5.636 -5.652 -13.512 1065 HB3 GLU 45 HB3 GLU 45 3.919 -5.437 -13.826 1066 HG2 GLU 45 HG2 GLU 45 3.663 -4.334 -11.907 1067 HG3 GLU 45 HG3 GLU 45 4.354 -5.681 -11.000 1068 H PHE 46 H PHE 46 4.053 -8.051 -10.530 1069 HA PHE 46 HA PHE 46 6.821 -8.284 -9.805 1070 HB2 PHE 46 HB2 PHE 46 4.219 -8.574 -8.399 1071 HB3 PHE 46 HB3 PHE 46 5.612 -9.399 -7.705 1072 HD1 PHE 46 HD2 PHE 46 5.610 -6.156 -9.505 1073 HD2 PHE 46 HD1 PHE 46 5.984 -8.145 -5.764 1074 HE1 PHE 46 HE2 PHE 46 6.335 -4.051 -8.463 1075 HE2 PHE 46 HE1 PHE 46 6.716 -6.042 -4.716 1076 HZ PHE 46 HZ PHE 46 6.887 -3.996 -6.064 1077 H SER 47 H SER 47 4.397 -10.353 -11.067 1078 HA SER 47 HA SER 47 5.433 -12.843 -10.209 1079 HB2 SER 47 HB2 SER 47 3.856 -12.284 -12.732 1080 HB3 SER 47 HB3 SER 47 3.994 -13.825 -11.886 1081 HG SER 47 HG SER 47 3.088 -11.716 -10.339 1082 H GLU 48 H GLU 48 6.513 -10.554 -12.468 1083 HA GLU 48 HA GLU 48 8.086 -12.411 -14.049 1084 HB2 GLU 48 HB2 GLU 48 7.021 -10.361 -15.020 1085 HB3 GLU 48 HB3 GLU 48 8.096 -9.383 -14.033 1086 HG2 GLU 48 HG2 GLU 48 9.063 -9.426 -16.163 1087 HG3 GLU 48 HG3 GLU 48 10.013 -10.558 -15.198 1088 H LYS 49 H LYS 49 8.354 -10.719 -11.136 1089 HA LYS 49 HA LYS 49 11.224 -10.336 -11.206 1090 HB2 LYS 49 HB2 LYS 49 9.395 -10.114 -8.807 1091 HB3 LYS 49 HB3 LYS 49 11.001 -9.425 -8.987 1092 HG2 LYS 49 HG2 LYS 49 8.738 -8.612 -10.778 1093 HG3 LYS 49 HG3 LYS 49 8.988 -7.870 -9.201 1094 HD2 LYS 49 HD2 LYS 49 11.276 -7.248 -9.904 1095 HD3 LYS 49 HD3 LYS 49 10.943 -7.927 -11.499 1096 HE2 LYS 49 HE2 LYS 49 9.389 -5.680 -10.212 1097 HE3 LYS 49 HE3 LYS 49 10.666 -5.466 -11.407 1098 HZ1 LYS 49 HZ1 LYS 49 8.419 -7.229 -12.076 1099 HZ2 LYS 49 HZ2 LYS 49 9.355 -6.243 -13.081 1100 HZ3 LYS 49 HZ3 LYS 49 8.157 -5.555 -12.102 1101 H GLN 50 H GLN 50 8.933 -12.304 -9.337 1102 HA GLN 50 HA GLN 50 9.113 -14.255 -8.213 1103 HB2 GLN 50 HB2 GLN 50 11.265 -14.743 -10.276 1104 HB3 GLN 50 HB3 GLN 50 10.599 -15.982 -9.220 1105 HG2 GLN 50 HG2 GLN 50 8.640 -16.095 -10.353 1106 HG3 GLN 50 HG3 GLN 50 8.680 -14.396 -10.814 1107 HE21 GLN 50 HE21 GLN 50 8.188 -14.827 -12.934 1108 HE22 GLN 50 HE22 GLN 50 9.314 -15.558 -14.030 1109 HA PRO 51 HA PRO 51 12.640 -12.930 -5.594 1110 HB2 PRO 51 HB2 PRO 51 11.263 -12.837 -3.260 1111 HB3 PRO 51 HB3 PRO 51 11.320 -11.489 -4.398 1112 HG2 PRO 51 HG2 PRO 51 9.148 -13.455 -3.890 1113 HG3 PRO 51 HG3 PRO 51 9.043 -11.753 -4.352 1114 HD2 PRO 51 HD2 PRO 51 8.716 -13.904 -6.080 1115 HD3 PRO 51 HD3 PRO 51 9.084 -12.240 -6.570 1116 H MET 52 H MET 52 10.119 -15.233 -4.579 1117 HA MET 52 HA MET 52 12.223 -17.178 -3.937 1118 HB2 MET 52 HB2 MET 52 9.847 -16.410 -2.244 1119 HB3 MET 52 HB3 MET 52 10.686 -17.936 -2.037 1120 HG2 MET 52 HG2 MET 52 12.768 -16.685 -1.573 1121 HG3 MET 52 HG3 MET 52 11.848 -15.184 -1.680 1122 HE1 MET 52 HE1 MET 52 12.426 -15.322 2.136 1123 HE2 MET 52 HE2 MET 52 12.784 -14.524 0.606 1124 HE3 MET 52 HE3 MET 52 13.584 -16.040 1.017 1125 H LEU 53 H LEU 53 10.182 -16.653 -6.146 1126 HA LEU 53 HA LEU 53 8.617 -17.708 -7.408 1127 HB2 LEU 53 HB2 LEU 53 10.557 -19.808 -6.578 1128 HB3 LEU 53 HB3 LEU 53 9.127 -20.304 -7.460 1129 HG LEU 53 HG LEU 53 10.968 -18.165 -8.498 1130 HD11 LEU 53 HD11 LEU 53 11.095 -21.136 -8.981 1131 HD12 LEU 53 HD12 LEU 53 12.308 -20.149 -8.165 1132 HD13 LEU 53 HD13 LEU 53 11.994 -19.917 -9.884 1133 HD21 LEU 53 HD21 LEU 53 8.805 -18.200 -9.541 1134 HD22 LEU 53 HD22 LEU 53 8.896 -19.947 -9.763 1135 HD23 LEU 53 HD23 LEU 53 9.982 -18.886 -10.659 1136 H ASP 54 H ASP 54 7.321 -17.060 -5.226 1137 HA ASP 54 HA ASP 54 5.516 -19.289 -4.835 1138 HB2 ASP 54 HB2 ASP 54 7.395 -19.226 -2.998 1139 HB3 ASP 54 HB3 ASP 54 6.423 -17.915 -2.340 1140 H VAL 55 H VAL 55 3.470 -18.679 -4.186 1141 HA VAL 55 HA VAL 55 2.611 -16.147 -5.030 1142 HB VAL 55 HB VAL 55 1.052 -18.056 -3.296 1143 HG11 VAL 55 HG11 VAL 55 0.131 -15.986 -5.287 1144 HG12 VAL 55 HG12 VAL 55 0.066 -15.816 -3.535 1145 HG13 VAL 55 HG13 VAL 55 -0.905 -17.049 -4.338 1146 HG21 VAL 55 HG21 VAL 55 0.204 -18.991 -5.408 1147 HG22 VAL 55 HG22 VAL 55 1.937 -19.249 -5.208 1148 HG23 VAL 55 HG23 VAL 55 1.353 -17.990 -6.293 1149 HA PRO 56 HA PRO 56 1.778 -15.051 -0.356 1150 HB2 PRO 56 HB2 PRO 56 3.404 -16.297 1.463 1151 HB3 PRO 56 HB3 PRO 56 1.766 -16.828 1.072 1152 HG2 PRO 56 HG2 PRO 56 4.387 -17.860 0.070 1153 HG3 PRO 56 HG3 PRO 56 2.939 -18.759 0.561 1154 HD2 PRO 56 HD2 PRO 56 3.544 -18.337 -2.024 1155 HD3 PRO 56 HD3 PRO 56 1.865 -18.375 -1.452 1156 H LYS 57 H LYS 57 5.004 -15.916 -1.452 1157 HA LYS 57 HA LYS 57 6.243 -13.753 0.018 1158 HB2 LYS 57 HB2 LYS 57 7.209 -15.986 -1.695 1159 HB3 LYS 57 HB3 LYS 57 8.229 -14.560 -1.579 1160 HG2 LYS 57 HG2 LYS 57 9.028 -15.954 0.099 1161 HG3 LYS 57 HG3 LYS 57 7.990 -14.821 0.958 1162 HD2 LYS 57 HD2 LYS 57 7.368 -16.854 1.871 1163 HD3 LYS 57 HD3 LYS 57 6.155 -16.620 0.610 1164 HE2 LYS 57 HE2 LYS 57 6.778 -18.794 0.217 1165 HE3 LYS 57 HE3 LYS 57 7.867 -17.931 -0.864 1166 HZ1 LYS 57 HZ1 LYS 57 9.616 -18.116 0.775 1167 HZ2 LYS 57 HZ2 LYS 57 9.005 -19.649 0.404 1168 HZ3 LYS 57 HZ3 LYS 57 8.567 -18.895 1.852 1169 H LEU 58 H LEU 58 4.463 -13.922 -2.752 1170 HA LEU 58 HA LEU 58 5.992 -11.870 -4.173 1171 HB2 LEU 58 HB2 LEU 58 4.974 -13.885 -5.347 1172 HB3 LEU 58 HB3 LEU 58 3.407 -13.157 -5.046 1173 HG LEU 58 HG LEU 58 4.631 -11.081 -6.236 1174 HD11 LEU 58 HD11 LEU 58 5.822 -13.525 -7.527 1175 HD12 LEU 58 HD12 LEU 58 6.706 -12.358 -6.547 1176 HD13 LEU 58 HD13 LEU 58 5.986 -11.858 -8.077 1177 HD21 LEU 58 HD21 LEU 58 2.487 -11.970 -6.896 1178 HD22 LEU 58 HD22 LEU 58 3.258 -13.393 -7.598 1179 HD23 LEU 58 HD23 LEU 58 3.517 -11.804 -8.318 1180 H ALA 59 H ALA 59 2.741 -12.444 -2.895 1181 HA ALA 59 HA ALA 59 1.642 -9.943 -3.444 1182 HB1 ALA 59 HB1 ALA 59 0.319 -11.875 -2.819 1183 HB2 ALA 59 HB2 ALA 59 -0.031 -10.510 -1.756 1184 HB3 ALA 59 HB3 ALA 59 0.993 -11.830 -1.193 1185 H VAL 60 H VAL 60 3.208 -11.081 -0.448 1186 HA VAL 60 HA VAL 60 2.907 -8.648 0.944 1187 HB VAL 60 HB VAL 60 3.411 -10.816 2.042 1188 HG11 VAL 60 HG11 VAL 60 6.136 -10.376 0.851 1189 HG12 VAL 60 HG12 VAL 60 5.060 -11.754 0.616 1190 HG13 VAL 60 HG13 VAL 60 5.817 -11.484 2.184 1191 HG21 VAL 60 HG21 VAL 60 3.685 -8.800 3.317 1192 HG22 VAL 60 HG22 VAL 60 5.289 -8.533 2.635 1193 HG23 VAL 60 HG23 VAL 60 5.007 -9.900 3.713 1194 H LEU 61 H LEU 61 5.220 -9.735 -1.405 1195 HA LEU 61 HA LEU 61 7.250 -7.820 -0.893 1196 HB2 LEU 61 HB2 LEU 61 7.570 -9.896 -2.227 1197 HB3 LEU 61 HB3 LEU 61 6.567 -9.208 -3.488 1198 HG LEU 61 HG LEU 61 8.326 -7.275 -3.470 1199 HD11 LEU 61 HD11 LEU 61 9.880 -9.540 -2.233 1200 HD12 LEU 61 HD12 LEU 61 9.551 -7.964 -1.516 1201 HD13 LEU 61 HD13 LEU 61 10.590 -8.086 -2.934 1202 HD21 LEU 61 HD21 LEU 61 9.826 -8.855 -4.942 1203 HD22 LEU 61 HD22 LEU 61 8.203 -8.397 -5.457 1204 HD23 LEU 61 HD23 LEU 61 8.481 -9.971 -4.716 1205 H THR 62 H THR 62 4.303 -7.867 -2.762 1206 HA THR 62 HA THR 62 4.794 -5.405 -4.131 1207 HB THR 62 HB THR 62 2.027 -6.449 -3.697 1208 HG1 THR 62 HG1 THR 62 4.037 -7.982 -4.557 1209 HG21 THR 62 HG21 THR 62 2.445 -4.421 -5.043 1210 HG22 THR 62 HG22 THR 62 1.728 -5.724 -5.991 1211 HG23 THR 62 HG23 THR 62 3.453 -5.377 -6.130 1212 H ALA 63 H ALA 63 3.039 -6.409 -1.251 1213 HA ALA 63 HA ALA 63 1.719 -4.045 -0.630 1214 HB1 ALA 63 HB1 ALA 63 1.571 -4.887 1.636 1215 HB2 ALA 63 HB2 ALA 63 2.860 -6.047 1.315 1216 HB3 ALA 63 HB3 ALA 63 1.312 -6.199 0.486 1217 H VAL 64 H VAL 64 4.968 -5.106 0.377 1218 HA VAL 64 HA VAL 64 5.491 -2.783 1.907 1219 HB VAL 64 HB VAL 64 6.711 -4.922 2.222 1220 HG11 VAL 64 HG11 VAL 64 7.111 -5.582 -0.055 1221 HG12 VAL 64 HG12 VAL 64 8.658 -5.386 0.771 1222 HG13 VAL 64 HG13 VAL 64 8.088 -4.139 -0.338 1223 HG21 VAL 64 HG21 VAL 64 8.908 -3.901 2.636 1224 HG22 VAL 64 HG22 VAL 64 7.580 -2.887 3.195 1225 HG23 VAL 64 HG23 VAL 64 8.417 -2.494 1.695 1226 H GLN 65 H GLN 65 6.089 -3.557 -1.496 1227 HA GLN 65 HA GLN 65 7.668 -1.226 -1.921 1228 HB2 GLN 65 HB2 GLN 65 7.547 -3.370 -3.378 1229 HB3 GLN 65 HB3 GLN 65 6.151 -2.593 -4.121 1230 HG2 GLN 65 HG2 GLN 65 7.430 -0.846 -4.999 1231 HG3 GLN 65 HG3 GLN 65 8.755 -1.127 -3.869 1232 HE21 GLN 65 HE21 GLN 65 8.645 -0.936 -6.828 1233 HE22 GLN 65 HE22 GLN 65 9.402 -2.379 -7.401 1234 H ILE 66 H ILE 66 4.231 -2.000 -2.348 1235 HA ILE 66 HA ILE 66 3.440 0.423 -3.534 1236 HB ILE 66 HB ILE 66 1.921 -1.482 -1.741 1237 HG12 ILE 66 HG12 ILE 66 1.596 -0.930 -4.692 1238 HG13 ILE 66 HG13 ILE 66 2.643 -2.196 -4.062 1239 HG21 ILE 66 HG21 ILE 66 -0.113 -0.321 -2.242 1240 HG22 ILE 66 HG22 ILE 66 0.732 0.801 -3.308 1241 HG23 ILE 66 HG23 ILE 66 1.031 0.842 -1.572 1242 HD11 ILE 66 HD11 ILE 66 -0.347 -1.999 -3.815 1243 HD12 ILE 66 HD12 ILE 66 0.635 -3.181 -2.951 1244 HD13 ILE 66 HD13 ILE 66 0.587 -3.193 -4.715 1245 H ALA 67 H ALA 67 3.698 -0.570 -0.155 1246 HA ALA 67 HA ALA 67 2.767 1.771 1.043 1247 HB1 ALA 67 HB1 ALA 67 3.159 -0.365 2.235 1248 HB2 ALA 67 HB2 ALA 67 3.883 1.021 3.052 1249 HB3 ALA 67 HB3 ALA 67 4.896 -0.079 2.116 1250 H SER 68 H SER 68 6.016 0.849 -0.005 1251 HA SER 68 HA SER 68 7.368 3.111 0.981 1252 HB2 SER 68 HB2 SER 68 8.081 1.428 -1.429 1253 HB3 SER 68 HB3 SER 68 9.179 2.456 -0.509 1254 HG SER 68 HG SER 68 7.880 0.079 0.346 1255 H GLU 69 H GLU 69 5.943 2.423 -2.192 1256 HA GLU 69 HA GLU 69 6.745 4.732 -3.531 1257 HB2 GLU 69 HB2 GLU 69 4.288 3.019 -3.877 1258 HB3 GLU 69 HB3 GLU 69 4.722 4.314 -4.980 1259 HG2 GLU 69 HG2 GLU 69 6.892 3.135 -5.372 1260 HG3 GLU 69 HG3 GLU 69 6.255 1.788 -4.430 1261 H TYR 70 H TYR 70 3.833 4.163 -1.573 1262 HA TYR 70 HA TYR 70 2.961 6.888 -2.073 1263 HB2 TYR 70 HB2 TYR 70 1.728 4.460 -0.869 1264 HB3 TYR 70 HB3 TYR 70 1.070 6.039 -0.444 1265 HD1 TYR 70 HD1 TYR 70 2.531 5.229 -3.739 1266 HD2 TYR 70 HD2 TYR 70 -1.051 5.772 -1.518 1267 HE1 TYR 70 HE1 TYR 70 1.246 5.271 -5.832 1268 HE2 TYR 70 HE2 TYR 70 -2.346 5.806 -3.598 1269 HH TYR 70 HH TYR 70 -0.971 4.972 -6.651 1270 H LEU 71 H LEU 71 4.710 5.204 0.386 1271 HA LEU 71 HA LEU 71 4.024 6.824 2.594 1272 HB2 LEU 71 HB2 LEU 71 5.229 4.695 2.831 1273 HB3 LEU 71 HB3 LEU 71 6.619 5.388 2.024 1274 HG LEU 71 HG LEU 71 6.884 7.003 3.896 1275 HD11 LEU 71 HD11 LEU 71 4.577 5.471 5.080 1276 HD12 LEU 71 HD12 LEU 71 4.680 7.202 4.747 1277 HD13 LEU 71 HD13 LEU 71 5.668 6.490 6.020 1278 HD21 LEU 71 HD21 LEU 71 8.152 4.903 3.920 1279 HD22 LEU 71 HD22 LEU 71 6.830 4.122 4.797 1280 HD23 LEU 71 HD23 LEU 71 7.730 5.436 5.546 1281 H LYS 72 H LYS 72 6.505 7.131 0.095 1282 HA LYS 72 HA LYS 72 7.724 9.433 1.201 1283 HB2 LYS 72 HB2 LYS 72 8.968 9.577 -0.797 1284 HB3 LYS 72 HB3 LYS 72 8.689 7.860 -0.565 1285 HG2 LYS 72 HG2 LYS 72 8.141 7.929 -2.740 1286 HG3 LYS 72 HG3 LYS 72 6.580 8.470 -2.121 1287 HD2 LYS 72 HD2 LYS 72 7.411 10.826 -2.348 1288 HD3 LYS 72 HD3 LYS 72 8.830 10.178 -3.180 1289 HE2 LYS 72 HE2 LYS 72 7.463 9.291 -4.933 1290 HE3 LYS 72 HE3 LYS 72 5.986 9.690 -4.056 1291 HZ1 LYS 72 HZ1 LYS 72 6.406 11.296 -5.790 1292 HZ2 LYS 72 HZ2 LYS 72 7.941 11.633 -5.169 1293 HZ3 LYS 72 HZ3 LYS 72 6.560 12.044 -4.276 1294 H LEU 73 H LEU 73 4.966 8.895 -0.836 1295 HA LEU 73 HA LEU 73 4.635 11.575 -1.719 1296 HB2 LEU 73 HB2 LEU 73 3.653 9.680 -2.908 1297 HB3 LEU 73 HB3 LEU 73 2.651 9.307 -1.520 1298 HG LEU 73 HG LEU 73 1.563 11.564 -1.820 1299 HD11 LEU 73 HD11 LEU 73 1.753 12.569 -4.069 1300 HD12 LEU 73 HD12 LEU 73 3.089 11.472 -4.417 1301 HD13 LEU 73 HD13 LEU 73 3.245 12.675 -3.136 1302 HD21 LEU 73 HD21 LEU 73 0.156 10.816 -3.699 1303 HD22 LEU 73 HD22 LEU 73 0.451 9.534 -2.524 1304 HD23 LEU 73 HD23 LEU 73 1.331 9.549 -4.052 1305 H LYS 74 H LYS 74 3.207 9.661 0.913 1306 HA LYS 74 HA LYS 74 1.557 11.788 1.833 1307 HB2 LYS 74 HB2 LYS 74 0.774 10.328 3.397 1308 HB3 LYS 74 HB3 LYS 74 1.463 9.174 2.272 1309 HG2 LYS 74 HG2 LYS 74 3.453 8.969 3.641 1310 HG3 LYS 74 HG3 LYS 74 2.839 10.195 4.748 1311 HD2 LYS 74 HD2 LYS 74 1.261 7.708 4.182 1312 HD3 LYS 74 HD3 LYS 74 2.554 7.702 5.376 1313 HE2 LYS 74 HE2 LYS 74 0.240 9.628 5.411 1314 HE3 LYS 74 HE3 LYS 74 0.277 8.112 6.305 1315 HZ1 LYS 74 HZ1 LYS 74 2.536 9.917 6.682 1316 HZ2 LYS 74 HZ2 LYS 74 1.737 8.930 7.803 1317 HZ3 LYS 74 HZ3 LYS 74 1.059 10.407 7.338 1318 H GLU 75 H GLU 75 4.863 10.964 2.281 1319 HA GLU 75 HA GLU 75 5.238 12.447 4.710 1320 HB2 GLU 75 HB2 GLU 75 6.696 10.528 3.853 1321 HB3 GLU 75 HB3 GLU 75 7.400 11.699 2.746 1322 HG2 GLU 75 HG2 GLU 75 8.860 11.648 4.564 1323 HG3 GLU 75 HG3 GLU 75 7.897 13.102 4.816 1324 H GLU 76 H GLU 76 6.071 12.984 1.291 1325 HA GLU 76 HA GLU 76 7.069 15.602 1.683 1326 HB2 GLU 76 HB2 GLU 76 7.030 15.814 -0.723 1327 HB3 GLU 76 HB3 GLU 76 7.590 14.203 -0.303 1328 HG2 GLU 76 HG2 GLU 76 5.454 13.258 -0.853 1329 HG3 GLU 76 HG3 GLU 76 4.770 14.861 -1.119 1330 H TYR 77 H TYR 77 3.933 14.276 1.441 1331 HA TYR 77 HA TYR 77 2.393 16.398 0.548 1332 HB2 TYR 77 HB2 TYR 77 1.252 14.376 0.782 1333 HB3 TYR 77 HB3 TYR 77 1.891 14.086 2.392 1334 HD1 TYR 77 HD1 TYR 77 -0.196 16.689 0.698 1335 HD2 TYR 77 HD2 TYR 77 0.345 14.185 4.092 1336 HE1 TYR 77 HE1 TYR 77 -2.276 17.564 1.660 1337 HE2 TYR 77 HE2 TYR 77 -1.738 15.051 5.070 1338 HH TYR 77 HH TYR 77 -3.965 16.949 3.277 1339 H GLN 78 H GLN 78 3.804 15.792 3.704 1340 HA GLN 78 HA GLN 78 2.445 18.062 4.881 1341 HB2 GLN 78 HB2 GLN 78 4.354 15.980 5.861 1342 HB3 GLN 78 HB3 GLN 78 4.142 17.458 6.787 1343 HG2 GLN 78 HG2 GLN 78 1.871 17.005 7.187 1344 HG3 GLN 78 HG3 GLN 78 1.829 15.735 5.965 1345 HE21 GLN 78 HE21 GLN 78 2.956 16.606 9.154 1346 HE22 GLN 78 HE22 GLN 78 3.212 14.990 9.716 1347 H ARG 79 H ARG 79 5.543 17.273 3.501 1348 HA ARG 79 HA ARG 79 7.062 19.395 4.519 1349 HB2 ARG 79 HB2 ARG 79 8.020 17.404 3.405 1350 HB3 ARG 79 HB3 ARG 79 7.417 17.999 1.864 1351 HG2 ARG 79 HG2 ARG 79 8.798 20.036 2.169 1352 HG3 ARG 79 HG3 ARG 79 9.479 19.308 3.622 1353 HD2 ARG 79 HD2 ARG 79 10.437 17.515 2.351 1354 HD3 ARG 79 HD3 ARG 79 9.611 18.052 0.886 1355 HE ARG 79 HE ARG 79 11.135 20.192 1.724 1356 HH11 ARG 79 HH11 ARG 79 11.757 16.886 0.751 1357 HH12 ARG 79 HH12 ARG 79 13.325 17.240 0.106 1358 HH21 ARG 79 HH21 ARG 79 13.187 20.661 0.877 1359 HH22 ARG 79 HH22 ARG 79 14.142 19.395 0.175 1360 H LEU 80 H LEU 80 5.391 19.182 1.336 1361 HA LEU 80 HA LEU 80 6.100 21.890 0.770 1362 HB2 LEU 80 HB2 LEU 80 5.159 21.668 -1.312 1363 HB3 LEU 80 HB3 LEU 80 5.665 20.042 -0.940 1364 HG LEU 80 HG LEU 80 3.633 19.774 -2.016 1365 HD11 LEU 80 HD11 LEU 80 1.975 19.066 -0.315 1366 HD12 LEU 80 HD12 LEU 80 3.050 19.718 0.918 1367 HD13 LEU 80 HD13 LEU 80 3.590 18.392 -0.110 1368 HD21 LEU 80 HD21 LEU 80 1.582 21.051 -1.484 1369 HD22 LEU 80 HD22 LEU 80 2.889 22.037 -2.139 1370 HD23 LEU 80 HD23 LEU 80 2.540 22.071 -0.411 1371 H ARG 81 H ARG 81 3.779 20.625 2.793 1372 HA ARG 81 HA ARG 81 1.921 22.838 2.426 1373 HB2 ARG 81 HB2 ARG 81 1.906 20.411 4.210 1374 HB3 ARG 81 HB3 ARG 81 0.749 21.721 4.417 1375 HG2 ARG 81 HG2 ARG 81 0.985 20.680 1.681 1376 HG3 ARG 81 HG3 ARG 81 0.338 19.548 2.869 1377 HD2 ARG 81 HD2 ARG 81 -1.480 20.741 1.853 1378 HD3 ARG 81 HD3 ARG 81 -1.316 21.262 3.524 1379 HE ARG 81 HE ARG 81 0.006 22.906 1.526 1380 HH11 ARG 81 HH11 ARG 81 -2.777 22.411 3.586 1381 HH12 ARG 81 HH12 ARG 81 -3.315 24.054 3.474 1382 HH21 ARG 81 HH21 ARG 81 -0.716 25.089 1.371 1383 HH22 ARG 81 HH22 ARG 81 -2.147 25.571 2.226 1384 H GLU 82 H GLU 82 4.251 21.611 4.793 1385 HA GLU 82 HA GLU 82 3.835 23.713 6.666 1386 HB2 GLU 82 HB2 GLU 82 5.834 22.918 7.781 1387 HB3 GLU 82 HB3 GLU 82 4.848 21.546 7.305 1388 HG2 GLU 82 HG2 GLU 82 6.352 21.342 5.282 1389 HG3 GLU 82 HG3 GLU 82 7.405 22.513 6.070 1390 H GLN 83 H GLN 83 5.729 23.341 3.795 1391 HA GLN 83 HA GLN 83 7.487 25.547 4.203 1392 HB2 GLN 83 HB2 GLN 83 7.995 23.713 2.646 1393 HB3 GLN 83 HB3 GLN 83 6.616 24.162 1.655 1394 HG2 GLN 83 HG2 GLN 83 8.575 24.984 0.599 1395 HG3 GLN 83 HG3 GLN 83 7.705 26.365 1.265 1396 HE21 GLN 83 HE21 GLN 83 9.514 27.668 1.363 1397 HE22 GLN 83 HE22 GLN 83 10.799 27.402 2.491 1398 H LEU 84 H LEU 84 4.210 25.274 3.442 1399 HA LEU 84 HA LEU 84 4.069 27.866 2.102 1400 HB2 LEU 84 HB2 LEU 84 2.486 25.452 2.082 1401 HB3 LEU 84 HB3 LEU 84 1.479 26.820 2.501 1402 HG LEU 84 HG LEU 84 1.437 26.319 0.094 1403 HD11 LEU 84 HD11 LEU 84 2.138 28.651 -0.689 1404 HD12 LEU 84 HD12 LEU 84 2.541 28.955 1.000 1405 HD13 LEU 84 HD13 LEU 84 0.891 28.533 0.548 1406 HD21 LEU 84 HD21 LEU 84 3.729 25.462 -0.136 1407 HD22 LEU 84 HD22 LEU 84 4.356 27.093 0.098 1408 HD23 LEU 84 HD23 LEU 84 3.367 26.723 -1.313 1409 H LYS 85 H LYS 85 4.286 26.863 5.155 1410 HA LYS 85 HA LYS 85 2.287 28.736 6.211 1411 HB2 LYS 85 HB2 LYS 85 3.861 26.547 7.581 1412 HB3 LYS 85 HB3 LYS 85 2.789 27.665 8.414 1413 HG2 LYS 85 HG2 LYS 85 0.901 26.836 7.092 1414 HG3 LYS 85 HG3 LYS 85 1.977 25.701 6.274 1415 HD2 LYS 85 HD2 LYS 85 2.437 24.584 8.383 1416 HD3 LYS 85 HD3 LYS 85 1.447 25.760 9.245 1417 HE2 LYS 85 HE2 LYS 85 -0.510 25.032 7.933 1418 HE3 LYS 85 HE3 LYS 85 0.493 23.808 7.156 1419 HZ1 LYS 85 HZ1 LYS 85 -0.778 22.879 8.982 1420 HZ2 LYS 85 HZ2 LYS 85 -0.086 23.978 10.063 1421 HZ3 LYS 85 HZ3 LYS 85 0.879 22.803 9.321 1422 H LYS 86 H LYS 86 3.242 29.566 8.512 1423 HA LYS 86 HA LYS 86 5.978 30.400 8.412 1424 HB2 LYS 86 HB2 LYS 86 4.855 31.959 6.785 1425 HB3 LYS 86 HB3 LYS 86 3.846 32.527 8.106 1426 HG2 LYS 86 HG2 LYS 86 6.041 33.098 9.295 1427 HG3 LYS 86 HG3 LYS 86 6.792 32.896 7.712 1428 HD2 LYS 86 HD2 LYS 86 5.287 34.585 6.778 1429 HD3 LYS 86 HD3 LYS 86 4.526 34.780 8.357 1430 HE2 LYS 86 HE2 LYS 86 6.840 35.367 9.227 1431 HE3 LYS 86 HE3 LYS 86 7.325 35.498 7.538 1432 HZ1 LYS 86 HZ1 LYS 86 5.124 37.041 8.797 1433 HZ2 LYS 86 HZ2 LYS 86 5.685 37.214 7.213 1434 HZ3 LYS 86 HZ3 LYS 86 6.679 37.636 8.514 Start of MODEL 20 1 H1 GLY 1 H1 GLY 1 39.963 -4.940 -6.149 2 H2 GLY 1 H2 GLY 1 38.374 -4.995 -5.570 3 H3 GLY 1 H3 GLY 1 39.538 -4.083 -4.753 4 HA2 GLY 1 HA3 GLY 1 39.741 -2.590 -6.636 5 HA3 GLY 1 HA2 GLY 1 38.538 -3.545 -7.491 6 H SER 2 H SER 2 38.738 -0.684 -6.276 7 HA SER 2 HA SER 2 36.392 -0.762 -4.543 8 HB2 SER 2 HB2 SER 2 38.162 1.568 -5.311 9 HB3 SER 2 HB3 SER 2 36.904 1.585 -4.074 10 HG SER 2 HG SER 2 38.778 -0.425 -3.787 11 H HIS 3 H HIS 3 34.705 0.938 -4.895 12 HA HIS 3 HA HIS 3 34.293 1.537 -7.739 13 HB2 HIS 3 HB2 HIS 3 32.668 -0.196 -6.034 14 HB3 HIS 3 HB3 HIS 3 31.736 1.076 -6.812 15 HD1 HIS 3 HD1 HIS 3 31.795 -2.126 -7.438 16 HD2 HIS 3 HD2 HIS 3 33.407 0.957 -9.717 17 HE1 HIS 3 HE1 HIS 3 31.946 -3.020 -9.782 18 HE2 HIS 3 HE2 HIS 3 32.736 -1.072 -11.169 19 H MET 4 H MET 4 34.296 3.673 -7.830 20 HA MET 4 HA MET 4 32.911 5.183 -5.713 21 HB2 MET 4 HB2 MET 4 35.295 5.861 -7.416 22 HB3 MET 4 HB3 MET 4 34.334 7.127 -6.670 23 HG2 MET 4 HG2 MET 4 36.174 6.727 -5.251 24 HG3 MET 4 HG3 MET 4 34.764 6.027 -4.463 25 HE1 MET 4 HE1 MET 4 36.897 4.451 -7.486 26 HE2 MET 4 HE2 MET 4 38.140 3.657 -6.521 27 HE3 MET 4 HE3 MET 4 37.984 5.412 -6.486 28 H THR 5 H THR 5 30.895 5.465 -6.480 29 HA THR 5 HA THR 5 30.602 6.972 -8.963 30 HB THR 5 HB THR 5 28.426 5.163 -8.906 31 HG1 THR 5 HG1 THR 5 29.660 3.697 -7.713 32 HG21 THR 5 HG21 THR 5 30.837 5.275 -10.721 33 HG22 THR 5 HG22 THR 5 29.366 6.233 -10.896 34 HG23 THR 5 HG23 THR 5 29.305 4.480 -11.087 35 H GLU 6 H GLU 6 27.877 7.084 -9.101 36 HA GLU 6 HA GLU 6 27.245 8.709 -6.795 37 HB2 GLU 6 HB2 GLU 6 25.264 9.369 -8.051 38 HB3 GLU 6 HB3 GLU 6 26.689 9.490 -9.072 39 HG2 GLU 6 HG2 GLU 6 26.106 7.326 -10.098 40 HG3 GLU 6 HG3 GLU 6 24.649 7.269 -9.109 41 H GLN 7 H GLN 7 24.619 8.437 -6.342 42 HA GLN 7 HA GLN 7 24.348 5.620 -5.531 43 HB2 GLN 7 HB2 GLN 7 24.339 7.868 -3.933 44 HB3 GLN 7 HB3 GLN 7 22.626 7.536 -4.144 45 HG2 GLN 7 HG2 GLN 7 23.387 6.430 -2.165 46 HG3 GLN 7 HG3 GLN 7 23.028 5.212 -3.387 47 HE21 GLN 7 HE21 GLN 7 25.906 7.218 -3.341 48 HE22 GLN 7 HE22 GLN 7 27.022 5.935 -3.027 49 HA PRO 8 HA PRO 8 20.891 6.154 -8.428 50 HB2 PRO 8 HB2 PRO 8 21.099 3.773 -9.626 51 HB3 PRO 8 HB3 PRO 8 22.233 5.076 -9.992 52 HG2 PRO 8 HG2 PRO 8 22.594 2.683 -8.236 53 HG3 PRO 8 HG3 PRO 8 23.739 3.428 -9.365 54 HD2 PRO 8 HD2 PRO 8 23.704 3.838 -6.621 55 HD3 PRO 8 HD3 PRO 8 24.466 4.920 -7.803 56 H LYS 9 H LYS 9 19.099 4.296 -8.930 57 HA LYS 9 HA LYS 9 17.825 3.815 -6.455 58 HB2 LYS 9 HB2 LYS 9 17.239 3.115 -9.292 59 HB3 LYS 9 HB3 LYS 9 16.353 2.283 -8.025 60 HG2 LYS 9 HG2 LYS 9 15.451 4.318 -7.198 61 HG3 LYS 9 HG3 LYS 9 16.521 5.276 -8.219 62 HD2 LYS 9 HD2 LYS 9 14.580 3.342 -9.422 63 HD3 LYS 9 HD3 LYS 9 14.063 4.956 -8.937 64 HE2 LYS 9 HE2 LYS 9 16.189 4.236 -10.940 65 HE3 LYS 9 HE3 LYS 9 14.641 5.014 -11.256 66 HZ1 LYS 9 HZ1 LYS 9 16.918 6.178 -9.745 67 HZ2 LYS 9 HZ2 LYS 9 15.411 6.921 -9.932 68 HZ3 LYS 9 HZ3 LYS 9 16.389 6.640 -11.281 69 H THR 10 H THR 10 18.989 2.551 -5.118 70 HA THR 10 HA THR 10 19.880 -0.056 -6.044 71 HB THR 10 HB THR 10 21.363 1.484 -4.663 72 HG1 THR 10 HG1 THR 10 21.992 -0.392 -3.254 73 HG21 THR 10 HG21 THR 10 21.072 1.410 -2.227 74 HG22 THR 10 HG22 THR 10 19.546 0.553 -2.440 75 HG23 THR 10 HG23 THR 10 19.715 2.209 -3.023 76 H ARG 11 H ARG 11 19.480 -1.935 -4.595 77 HA ARG 11 HA ARG 11 16.695 -1.861 -3.677 78 HB2 ARG 11 HB2 ARG 11 18.421 -4.202 -4.498 79 HB3 ARG 11 HB3 ARG 11 16.776 -4.334 -3.903 80 HG2 ARG 11 HG2 ARG 11 15.983 -3.022 -5.812 81 HG3 ARG 11 HG3 ARG 11 17.636 -2.929 -6.420 82 HD2 ARG 11 HD2 ARG 11 17.705 -5.383 -6.561 83 HD3 ARG 11 HD3 ARG 11 16.036 -5.447 -5.996 84 HE ARG 11 HE ARG 11 15.913 -3.832 -8.178 85 HH11 ARG 11 HH11 ARG 11 17.178 -7.046 -7.607 86 HH12 ARG 11 HH12 ARG 11 16.877 -7.589 -9.226 87 HH21 ARG 11 HH21 ARG 11 15.509 -4.545 -10.312 88 HH22 ARG 11 HH22 ARG 11 15.926 -6.167 -10.768 89 H VAL 12 H VAL 12 16.186 -2.265 -1.611 90 HA VAL 12 HA VAL 12 18.409 -2.836 0.229 91 HB VAL 12 HB VAL 12 17.195 -0.672 0.534 92 HG11 VAL 12 HG11 VAL 12 14.951 -0.866 1.718 93 HG12 VAL 12 HG12 VAL 12 14.886 -2.507 1.076 94 HG13 VAL 12 HG13 VAL 12 14.971 -1.132 -0.025 95 HG21 VAL 12 HG21 VAL 12 16.849 -0.946 2.996 96 HG22 VAL 12 HG22 VAL 12 18.397 -1.541 2.397 97 HG23 VAL 12 HG23 VAL 12 17.103 -2.677 2.776 98 H SER 13 H SER 13 18.243 -4.473 1.719 99 HA SER 13 HA SER 13 16.148 -6.433 1.202 100 HB2 SER 13 HB2 SER 13 17.715 -7.855 2.700 101 HB3 SER 13 HB3 SER 13 18.273 -7.436 1.079 102 HG SER 13 HG SER 13 18.960 -6.159 3.520 103 H VAL 14 H VAL 14 14.402 -6.341 2.478 104 HA VAL 14 HA VAL 14 14.807 -5.619 5.305 105 HB VAL 14 HB VAL 14 12.435 -4.737 5.263 106 HG11 VAL 14 HG11 VAL 14 14.560 -3.287 3.699 107 HG12 VAL 14 HG12 VAL 14 14.333 -3.259 5.446 108 HG13 VAL 14 HG13 VAL 14 13.124 -2.534 4.388 109 HG21 VAL 14 HG21 VAL 14 12.897 -4.557 2.290 110 HG22 VAL 14 HG22 VAL 14 11.471 -4.034 3.184 111 HG23 VAL 14 HG23 VAL 14 11.848 -5.752 3.057 112 H ARG 15 H ARG 15 13.588 -6.693 6.834 113 HA ARG 15 HA ARG 15 12.635 -9.311 5.988 114 HB2 ARG 15 HB2 ARG 15 14.175 -9.297 7.838 115 HB3 ARG 15 HB3 ARG 15 13.200 -8.116 8.699 116 HG2 ARG 15 HG2 ARG 15 11.421 -10.161 8.328 117 HG3 ARG 15 HG3 ARG 15 12.941 -11.023 8.571 118 HD2 ARG 15 HD2 ARG 15 11.762 -10.654 10.690 119 HD3 ARG 15 HD3 ARG 15 13.311 -9.812 10.657 120 HE ARG 15 HE ARG 15 12.197 -7.777 10.623 121 HH11 ARG 15 HH11 ARG 15 9.919 -10.438 10.458 122 HH12 ARG 15 HH12 ARG 15 8.523 -9.429 10.702 123 HH21 ARG 15 HH21 ARG 15 10.368 -6.464 11.008 124 HH22 ARG 15 HH22 ARG 15 8.791 -7.186 11.055 125 H ILE 16 H ILE 16 10.540 -9.766 5.733 126 HA ILE 16 HA ILE 16 8.553 -8.227 7.269 127 HB ILE 16 HB ILE 16 7.924 -9.120 4.477 128 HG12 ILE 16 HG12 ILE 16 9.028 -6.383 5.125 129 HG13 ILE 16 HG13 ILE 16 10.009 -7.681 4.451 130 HG21 ILE 16 HG21 ILE 16 6.125 -8.431 5.997 131 HG22 ILE 16 HG22 ILE 16 6.268 -7.352 4.610 132 HG23 ILE 16 HG23 ILE 16 6.894 -6.854 6.181 133 HD11 ILE 16 HD11 ILE 16 8.252 -7.746 2.581 134 HD12 ILE 16 HD12 ILE 16 9.412 -6.419 2.608 135 HD13 ILE 16 HD13 ILE 16 7.767 -6.165 3.190 136 H TYR 17 H TYR 17 7.352 -9.537 8.447 137 HA TYR 17 HA TYR 17 6.127 -11.289 9.164 138 HB2 TYR 17 HB2 TYR 17 5.357 -11.194 6.676 139 HB3 TYR 17 HB3 TYR 17 6.307 -12.666 6.510 140 HD1 TYR 17 HD1 TYR 17 3.771 -11.242 8.867 141 HD2 TYR 17 HD2 TYR 17 5.142 -14.649 6.719 142 HE1 TYR 17 HE1 TYR 17 1.871 -12.542 9.723 143 HE2 TYR 17 HE2 TYR 17 3.243 -15.956 7.572 144 HH TYR 17 HH TYR 17 0.570 -14.552 9.058 145 H GLY 18 H GLY 18 9.234 -11.664 7.933 146 HA2 GLY 18 HA2 GLY 18 10.442 -13.183 9.664 147 HA3 GLY 18 HA3 GLY 18 9.451 -14.423 8.913 148 H GLN 19 H GLN 19 9.725 -13.032 6.272 149 HA GLN 19 HA GLN 19 12.417 -14.051 5.664 150 HB2 GLN 19 HB2 GLN 19 9.988 -13.748 3.883 151 HB3 GLN 19 HB3 GLN 19 11.565 -14.297 3.333 152 HG2 GLN 19 HG2 GLN 19 9.925 -15.691 5.435 153 HG3 GLN 19 HG3 GLN 19 9.930 -16.119 3.727 154 HE21 GLN 19 HE21 GLN 19 11.750 -16.117 6.687 155 HE22 GLN 19 HE22 GLN 19 12.983 -17.205 6.158 156 H ASP 20 H ASP 20 13.761 -12.855 4.242 157 HA ASP 20 HA ASP 20 13.101 -10.003 4.228 158 HB2 ASP 20 HB2 ASP 20 15.306 -9.493 4.538 159 HB3 ASP 20 HB3 ASP 20 15.303 -11.091 5.272 160 H TYR 21 H TYR 21 13.127 -8.806 2.400 161 HA TYR 21 HA TYR 21 13.618 -10.228 -0.132 162 HB2 TYR 21 HB2 TYR 21 11.380 -8.244 0.292 163 HB3 TYR 21 HB3 TYR 21 11.660 -9.253 -1.124 164 HD1 TYR 21 HD2 TYR 21 11.332 -11.740 -0.916 165 HD2 TYR 21 HD1 TYR 21 10.124 -9.017 2.120 166 HE1 TYR 21 HE2 TYR 21 9.862 -13.467 0.034 167 HE2 TYR 21 HE1 TYR 21 8.651 -10.738 3.080 168 HH TYR 21 HH TYR 21 7.532 -12.758 2.455 169 H THR 22 H THR 22 14.190 -8.862 -1.911 170 HA THR 22 HA THR 22 15.548 -6.418 -1.033 171 HB THR 22 HB THR 22 16.081 -7.329 -3.763 172 HG1 THR 22 HG1 THR 22 16.489 -9.053 -1.540 173 HG21 THR 22 HG21 THR 22 17.400 -5.644 -2.467 174 HG22 THR 22 HG22 THR 22 18.368 -6.969 -3.112 175 HG23 THR 22 HG23 THR 22 17.928 -6.952 -1.404 176 H ILE 23 H ILE 23 14.218 -4.732 -1.236 177 HA ILE 23 HA ILE 23 12.627 -4.481 -3.710 178 HB ILE 23 HB ILE 23 11.123 -2.996 -2.472 179 HG12 ILE 23 HG12 ILE 23 12.727 -3.739 -0.015 180 HG13 ILE 23 HG13 ILE 23 12.836 -2.186 -0.834 181 HG21 ILE 23 HG21 ILE 23 10.713 -5.431 -2.595 182 HG22 ILE 23 HG22 ILE 23 10.016 -4.681 -1.160 183 HG23 ILE 23 HG23 ILE 23 11.507 -5.612 -1.030 184 HD11 ILE 23 HD11 ILE 23 10.559 -3.339 0.725 185 HD12 ILE 23 HD12 ILE 23 10.331 -1.994 -0.397 186 HD13 ILE 23 HD13 ILE 23 11.425 -1.823 0.979 187 H VAL 24 H VAL 24 12.255 -2.188 -4.402 188 HA VAL 24 HA VAL 24 14.799 -0.817 -4.485 189 HB VAL 24 HB VAL 24 12.170 0.042 -5.716 190 HG11 VAL 24 HG11 VAL 24 13.605 1.351 -7.235 191 HG12 VAL 24 HG12 VAL 24 15.018 0.853 -6.304 192 HG13 VAL 24 HG13 VAL 24 13.776 1.855 -5.552 193 HG21 VAL 24 HG21 VAL 24 12.721 -2.132 -6.584 194 HG22 VAL 24 HG22 VAL 24 14.393 -1.647 -6.858 195 HG23 VAL 24 HG23 VAL 24 13.100 -0.927 -7.814 196 H GLY 25 H GLY 25 15.373 0.819 -3.164 197 HA2 GLY 25 HA2 GLY 25 13.290 2.497 -1.991 198 HA3 GLY 25 HA3 GLY 25 14.305 1.595 -0.878 199 H ALA 26 H ALA 26 14.316 4.062 -3.391 200 HA ALA 26 HA ALA 26 16.914 4.989 -2.354 201 HB1 ALA 26 HB1 ALA 26 17.592 5.193 -4.450 202 HB2 ALA 26 HB2 ALA 26 16.233 6.253 -4.825 203 HB3 ALA 26 HB3 ALA 26 16.057 4.506 -4.987 204 H GLU 27 H GLU 27 13.682 5.684 -2.161 205 HA GLU 27 HA GLU 27 13.764 8.521 -2.428 206 HB2 GLU 27 HB2 GLU 27 11.747 6.659 -2.247 207 HB3 GLU 27 HB3 GLU 27 11.655 7.459 -0.687 208 HG2 GLU 27 HG2 GLU 27 10.182 8.508 -2.294 209 HG3 GLU 27 HG3 GLU 27 11.458 9.617 -1.795 210 H SER 28 H SER 28 14.291 6.288 0.214 211 HA SER 28 HA SER 28 15.720 8.143 1.755 212 HB2 SER 28 HB2 SER 28 13.598 9.188 2.275 213 HB3 SER 28 HB3 SER 28 12.876 7.627 2.669 214 HG SER 28 HG SER 28 14.459 9.278 4.192 215 HA PRO 29 HA PRO 29 16.941 3.972 2.868 216 HB2 PRO 29 HB2 PRO 29 18.970 4.723 4.548 217 HB3 PRO 29 HB3 PRO 29 19.126 4.636 2.791 218 HG2 PRO 29 HG2 PRO 29 18.629 7.016 4.535 219 HG3 PRO 29 HG3 PRO 29 19.695 6.866 3.125 220 HD2 PRO 29 HD2 PRO 29 17.281 8.050 2.970 221 HD3 PRO 29 HD3 PRO 29 17.943 7.097 1.624 222 H ALA 30 H ALA 30 16.065 6.523 5.085 223 HA ALA 30 HA ALA 30 15.888 4.681 7.333 224 HB1 ALA 30 HB1 ALA 30 15.332 6.640 8.657 225 HB2 ALA 30 HB2 ALA 30 15.224 7.621 7.195 226 HB3 ALA 30 HB3 ALA 30 16.775 6.945 7.688 227 H HIS 31 H HIS 31 13.811 6.404 5.093 228 HA HIS 31 HA HIS 31 11.396 5.846 6.520 229 HB2 HIS 31 HB2 HIS 31 12.040 7.602 4.537 230 HB3 HIS 31 HB3 HIS 31 11.151 6.377 3.635 231 HD1 HIS 31 HD1 HIS 31 8.761 6.955 3.454 232 HD2 HIS 31 HD2 HIS 31 10.393 8.287 7.031 233 HE1 HIS 31 HE1 HIS 31 6.890 8.127 4.649 234 HE2 HIS 31 HE2 HIS 31 7.868 8.808 6.870 235 H ILE 32 H ILE 32 13.086 4.339 3.807 236 HA ILE 32 HA ILE 32 11.049 2.508 3.107 237 HB ILE 32 HB ILE 32 12.775 1.235 1.923 238 HG12 ILE 32 HG12 ILE 32 14.748 3.188 3.139 239 HG13 ILE 32 HG13 ILE 32 14.587 1.503 3.605 240 HG21 ILE 32 HG21 ILE 32 13.477 3.032 0.389 241 HG22 ILE 32 HG22 ILE 32 12.966 4.223 1.582 242 HG23 ILE 32 HG23 ILE 32 11.780 3.147 0.846 243 HD11 ILE 32 HD11 ILE 32 15.704 2.684 1.105 244 HD12 ILE 32 HD12 ILE 32 15.077 1.034 1.111 245 HD13 ILE 32 HD13 ILE 32 16.394 1.480 2.195 246 H ARG 33 H ARG 33 13.333 2.499 5.685 247 HA ARG 33 HA ARG 33 13.314 -0.312 6.152 248 HB2 ARG 33 HB2 ARG 33 14.284 2.078 7.658 249 HB3 ARG 33 HB3 ARG 33 14.149 0.537 8.493 250 HG2 ARG 33 HG2 ARG 33 15.662 -0.502 6.935 251 HG3 ARG 33 HG3 ARG 33 15.718 0.963 5.958 252 HD2 ARG 33 HD2 ARG 33 17.693 0.626 7.465 253 HD3 ARG 33 HD3 ARG 33 16.855 2.164 7.673 254 HE ARG 33 HE ARG 33 15.815 0.247 9.468 255 HH11 ARG 33 HH11 ARG 33 18.659 2.197 8.929 256 HH12 ARG 33 HH12 ARG 33 19.054 2.314 10.610 257 HH21 ARG 33 HH21 ARG 33 16.334 0.398 11.696 258 HH22 ARG 33 HH22 ARG 33 17.747 1.286 12.180 259 H LEU 34 H LEU 34 11.507 2.419 7.512 260 HA LEU 34 HA LEU 34 10.148 0.769 9.416 261 HB2 LEU 34 HB2 LEU 34 8.782 2.730 9.901 262 HB3 LEU 34 HB3 LEU 34 10.489 3.109 9.909 263 HG LEU 34 HG LEU 34 9.874 3.819 7.374 264 HD11 LEU 34 HD11 LEU 34 7.405 4.406 8.998 265 HD12 LEU 34 HD12 LEU 34 7.507 3.281 7.643 266 HD13 LEU 34 HD13 LEU 34 7.752 5.007 7.376 267 HD21 LEU 34 HD21 LEU 34 11.064 5.208 8.940 268 HD22 LEU 34 HD22 LEU 34 9.595 5.467 9.882 269 HD23 LEU 34 HD23 LEU 34 9.724 6.129 8.253 270 H VAL 35 H VAL 35 9.784 1.241 6.109 271 HA VAL 35 HA VAL 35 6.977 1.041 5.818 272 HB VAL 35 HB VAL 35 9.157 0.127 3.923 273 HG11 VAL 35 HG11 VAL 35 6.264 0.718 3.313 274 HG12 VAL 35 HG12 VAL 35 6.934 -0.902 3.500 275 HG13 VAL 35 HG13 VAL 35 7.493 0.138 2.190 276 HG21 VAL 35 HG21 VAL 35 9.139 2.557 4.579 277 HG22 VAL 35 HG22 VAL 35 7.553 2.672 3.823 278 HG23 VAL 35 HG23 VAL 35 8.961 2.238 2.857 279 H ALA 36 H ALA 36 9.565 -1.373 5.821 280 HA ALA 36 HA ALA 36 8.000 -3.647 5.367 281 HB1 ALA 36 HB1 ALA 36 9.869 -4.895 6.404 282 HB2 ALA 36 HB2 ALA 36 10.574 -3.357 6.906 283 HB3 ALA 36 HB3 ALA 36 10.394 -3.728 5.192 284 H ALA 37 H ALA 37 8.903 -2.028 8.377 285 HA ALA 37 HA ALA 37 7.733 -3.897 10.132 286 HB1 ALA 37 HB1 ALA 37 8.303 -0.964 10.522 287 HB2 ALA 37 HB2 ALA 37 9.367 -2.311 10.924 288 HB3 ALA 37 HB3 ALA 37 7.857 -2.084 11.806 289 H PHE 38 H PHE 38 6.435 -1.183 8.355 290 HA PHE 38 HA PHE 38 4.000 -0.914 9.763 291 HB2 PHE 38 HB2 PHE 38 5.007 0.744 8.135 292 HB3 PHE 38 HB3 PHE 38 4.464 -0.312 6.837 293 HD1 PHE 38 HD1 PHE 38 3.326 1.816 9.631 294 HD2 PHE 38 HD2 PHE 38 2.226 -0.281 6.093 295 HE1 PHE 38 HE1 PHE 38 1.134 2.933 9.653 296 HE2 PHE 38 HE2 PHE 38 0.033 0.833 6.110 297 HZ PHE 38 HZ PHE 38 -0.516 2.442 7.892 298 H VAL 39 H VAL 39 4.922 -2.751 6.873 299 HA VAL 39 HA VAL 39 2.314 -3.880 6.502 300 HB VAL 39 HB VAL 39 4.940 -4.853 5.356 301 HG11 VAL 39 HG11 VAL 39 2.115 -5.268 4.374 302 HG12 VAL 39 HG12 VAL 39 3.090 -6.476 5.214 303 HG13 VAL 39 HG13 VAL 39 3.589 -5.887 3.627 304 HG21 VAL 39 HG21 VAL 39 4.818 -2.656 4.605 305 HG22 VAL 39 HG22 VAL 39 3.060 -2.691 4.483 306 HG23 VAL 39 HG23 VAL 39 4.041 -3.564 3.307 307 H ASP 40 H ASP 40 5.357 -4.984 7.907 308 HA ASP 40 HA ASP 40 4.738 -7.644 8.433 309 HB2 ASP 40 HB2 ASP 40 6.976 -6.726 8.704 310 HB3 ASP 40 HB3 ASP 40 6.425 -5.699 10.020 311 H ASP 41 H ASP 41 4.166 -4.763 10.402 312 HA ASP 41 HA ASP 41 2.969 -6.112 12.586 313 HB2 ASP 41 HB2 ASP 41 3.769 -3.962 13.063 314 HB3 ASP 41 HB3 ASP 41 2.999 -3.257 11.648 315 H LYS 42 H LYS 42 1.659 -4.634 9.667 316 HA LYS 42 HA LYS 42 -1.064 -4.873 10.357 317 HB2 LYS 42 HB2 LYS 42 0.128 -3.577 8.390 318 HB3 LYS 42 HB3 LYS 42 -0.179 -5.062 7.503 319 HG2 LYS 42 HG2 LYS 42 -2.259 -4.426 7.119 320 HG3 LYS 42 HG3 LYS 42 -2.571 -4.321 8.853 321 HD2 LYS 42 HD2 LYS 42 -1.092 -2.037 8.269 322 HD3 LYS 42 HD3 LYS 42 -2.196 -2.210 6.905 323 HE2 LYS 42 HE2 LYS 42 -3.365 -0.912 8.466 324 HE3 LYS 42 HE3 LYS 42 -4.031 -2.534 8.640 325 HZ1 LYS 42 HZ1 LYS 42 -2.747 -2.883 10.602 326 HZ2 LYS 42 HZ2 LYS 42 -3.540 -1.398 10.769 327 HZ3 LYS 42 HZ3 LYS 42 -1.897 -1.436 10.383 328 H MET 43 H MET 43 1.199 -7.050 8.745 329 HA MET 43 HA MET 43 -0.737 -9.022 8.055 330 HB2 MET 43 HB2 MET 43 2.260 -9.077 8.333 331 HB3 MET 43 HB3 MET 43 1.346 -10.529 7.952 332 HG2 MET 43 HG2 MET 43 0.395 -9.230 5.986 333 HG3 MET 43 HG3 MET 43 1.642 -8.030 6.317 334 HE1 MET 43 HE1 MET 43 1.730 -12.017 6.477 335 HE2 MET 43 HE2 MET 43 2.365 -12.344 4.865 336 HE3 MET 43 HE3 MET 43 0.786 -11.578 5.055 337 H HIS 44 H HIS 44 0.913 -8.188 10.938 338 HA HIS 44 HA HIS 44 0.646 -10.730 12.229 339 HB2 HIS 44 HB2 HIS 44 2.396 -9.008 12.779 340 HB3 HIS 44 HB3 HIS 44 1.126 -8.041 13.519 341 HD1 HIS 44 HD1 HIS 44 0.655 -8.495 15.924 342 HD2 HIS 44 HD2 HIS 44 2.741 -11.602 14.109 343 HE1 HIS 44 HE1 HIS 44 1.225 -10.105 17.774 344 HE2 HIS 44 HE2 HIS 44 2.583 -11.921 16.665 345 H GLU 45 H GLU 45 -1.219 -7.722 12.194 346 HA GLU 45 HA GLU 45 -2.975 -8.544 14.292 347 HB2 GLU 45 HB2 GLU 45 -4.212 -6.556 13.852 348 HB3 GLU 45 HB3 GLU 45 -2.508 -6.164 13.682 349 HG2 GLU 45 HG2 GLU 45 -2.869 -6.558 11.167 350 HG3 GLU 45 HG3 GLU 45 -4.590 -6.456 11.540 351 H PHE 46 H PHE 46 -3.036 -8.852 10.787 352 HA PHE 46 HA PHE 46 -5.785 -9.789 10.835 353 HB2 PHE 46 HB2 PHE 46 -3.786 -9.312 8.643 354 HB3 PHE 46 HB3 PHE 46 -5.283 -10.183 8.333 355 HD1 PHE 46 HD1 PHE 46 -7.442 -8.942 9.264 356 HD2 PHE 46 HD2 PHE 46 -3.765 -7.048 8.256 357 HE1 PHE 46 HE1 PHE 46 -8.629 -6.808 8.964 358 HE2 PHE 46 HE2 PHE 46 -4.945 -4.908 7.956 359 HZ PHE 46 HZ PHE 46 -7.378 -4.787 8.311 360 H SER 47 H SER 47 -2.974 -11.220 11.659 361 HA SER 47 HA SER 47 -3.213 -13.702 10.243 362 HB2 SER 47 HB2 SER 47 -1.400 -14.486 11.626 363 HB3 SER 47 HB3 SER 47 -1.045 -12.822 11.170 364 HG SER 47 HG SER 47 -1.575 -12.144 13.209 365 H GLU 48 H GLU 48 -4.760 -12.338 12.938 366 HA GLU 48 HA GLU 48 -5.381 -14.866 14.203 367 HB2 GLU 48 HB2 GLU 48 -6.521 -12.142 14.824 368 HB3 GLU 48 HB3 GLU 48 -6.533 -13.565 15.860 369 HG2 GLU 48 HG2 GLU 48 -4.051 -13.463 15.925 370 HG3 GLU 48 HG3 GLU 48 -4.132 -11.951 15.024 371 H LYS 49 H LYS 49 -6.546 -13.182 11.584 372 HA LYS 49 HA LYS 49 -9.346 -13.751 11.921 373 HB2 LYS 49 HB2 LYS 49 -7.699 -12.757 9.595 374 HB3 LYS 49 HB3 LYS 49 -9.414 -13.113 9.439 375 HG2 LYS 49 HG2 LYS 49 -8.327 -11.176 11.467 376 HG3 LYS 49 HG3 LYS 49 -8.801 -10.699 9.832 377 HD2 LYS 49 HD2 LYS 49 -11.061 -11.656 10.285 378 HD3 LYS 49 HD3 LYS 49 -10.558 -11.939 11.951 379 HE2 LYS 49 HE2 LYS 49 -10.140 -9.528 12.208 380 HE3 LYS 49 HE3 LYS 49 -10.716 -9.266 10.562 381 HZ1 LYS 49 HZ1 LYS 49 -12.291 -10.309 12.854 382 HZ2 LYS 49 HZ2 LYS 49 -12.863 -10.229 11.264 383 HZ3 LYS 49 HZ3 LYS 49 -12.475 -8.808 12.095 384 H GLN 50 H GLN 50 -6.890 -14.898 9.626 385 HA GLN 50 HA GLN 50 -6.695 -16.799 8.397 386 HB2 GLN 50 HB2 GLN 50 -7.696 -17.845 11.036 387 HB3 GLN 50 HB3 GLN 50 -7.251 -18.921 9.720 388 HG2 GLN 50 HG2 GLN 50 -5.012 -18.334 9.827 389 HG3 GLN 50 HG3 GLN 50 -5.347 -16.837 10.698 390 HE21 GLN 50 HE21 GLN 50 -3.520 -19.027 11.334 391 HE22 GLN 50 HE22 GLN 50 -3.975 -19.584 12.907 392 HA PRO 51 HA PRO 51 -11.262 -16.910 7.350 393 HB2 PRO 51 HB2 PRO 51 -10.530 -15.854 4.750 394 HB3 PRO 51 HB3 PRO 51 -11.631 -15.178 5.950 395 HG2 PRO 51 HG2 PRO 51 -9.211 -14.077 5.303 396 HG3 PRO 51 HG3 PRO 51 -10.018 -13.854 6.866 397 HD2 PRO 51 HD2 PRO 51 -7.741 -15.640 6.141 398 HD3 PRO 51 HD3 PRO 51 -8.049 -14.755 7.648 399 H MET 52 H MET 52 -8.543 -17.416 5.127 400 HA MET 52 HA MET 52 -9.823 -19.901 4.201 401 HB2 MET 52 HB2 MET 52 -7.728 -18.206 2.817 402 HB3 MET 52 HB3 MET 52 -8.449 -19.672 2.172 403 HG2 MET 52 HG2 MET 52 -9.836 -17.056 2.708 404 HG3 MET 52 HG3 MET 52 -9.461 -17.764 1.136 405 HE1 MET 52 HE1 MET 52 -12.332 -16.783 1.490 406 HE2 MET 52 HE2 MET 52 -13.270 -18.179 0.963 407 HE3 MET 52 HE3 MET 52 -11.796 -17.735 0.105 408 H LEU 53 H LEU 53 -7.648 -18.920 6.355 409 HA LEU 53 HA LEU 53 -5.788 -19.730 7.365 410 HB2 LEU 53 HB2 LEU 53 -7.202 -22.168 6.374 411 HB3 LEU 53 HB3 LEU 53 -5.638 -22.339 7.148 412 HG LEU 53 HG LEU 53 -7.881 -20.862 8.498 413 HD11 LEU 53 HD11 LEU 53 -7.332 -23.821 8.597 414 HD12 LEU 53 HD12 LEU 53 -8.771 -23.039 7.943 415 HD13 LEU 53 HD13 LEU 53 -8.424 -22.946 9.670 416 HD21 LEU 53 HD21 LEU 53 -5.629 -20.589 9.404 417 HD22 LEU 53 HD22 LEU 53 -5.465 -22.340 9.533 418 HD23 LEU 53 HD23 LEU 53 -6.659 -21.492 10.513 419 H ASP 54 H ASP 54 -5.343 -18.725 4.755 420 HA ASP 54 HA ASP 54 -3.046 -20.379 3.952 421 HB2 ASP 54 HB2 ASP 54 -5.107 -20.246 2.349 422 HB3 ASP 54 HB3 ASP 54 -4.501 -18.634 1.985 423 H VAL 55 H VAL 55 -1.144 -19.334 3.701 424 HA VAL 55 HA VAL 55 -0.747 -16.880 4.975 425 HB VAL 55 HB VAL 55 1.156 -18.155 3.017 426 HG11 VAL 55 HG11 VAL 55 1.627 -16.329 5.372 427 HG12 VAL 55 HG12 VAL 55 1.760 -15.887 3.670 428 HG13 VAL 55 HG13 VAL 55 2.877 -17.059 4.366 429 HG21 VAL 55 HG21 VAL 55 0.761 -18.692 5.959 430 HG22 VAL 55 HG22 VAL 55 2.106 -19.297 4.990 431 HG23 VAL 55 HG23 VAL 55 0.457 -19.813 4.631 432 HA PRO 56 HA PRO 56 -0.069 -14.862 0.567 433 HB2 PRO 56 HB2 PRO 56 -1.735 -15.941 -1.364 434 HB3 PRO 56 HB3 PRO 56 -0.007 -16.273 -1.215 435 HG2 PRO 56 HG2 PRO 56 -2.337 -17.879 -0.273 436 HG3 PRO 56 HG3 PRO 56 -0.815 -18.428 -1.000 437 HD2 PRO 56 HD2 PRO 56 -1.250 -18.606 1.635 438 HD3 PRO 56 HD3 PRO 56 0.358 -18.215 0.992 439 H LYS 57 H LYS 57 -3.099 -16.226 1.657 440 HA LYS 57 HA LYS 57 -4.792 -14.214 0.602 441 HB2 LYS 57 HB2 LYS 57 -5.162 -16.601 2.030 442 HB3 LYS 57 HB3 LYS 57 -5.810 -15.349 3.072 443 HG2 LYS 57 HG2 LYS 57 -6.629 -15.938 0.233 444 HG3 LYS 57 HG3 LYS 57 -7.557 -16.284 1.690 445 HD2 LYS 57 HD2 LYS 57 -6.758 -13.500 0.859 446 HD3 LYS 57 HD3 LYS 57 -8.271 -14.253 0.380 447 HE2 LYS 57 HE2 LYS 57 -9.201 -13.956 2.402 448 HE3 LYS 57 HE3 LYS 57 -7.716 -14.351 3.261 449 HZ1 LYS 57 HZ1 LYS 57 -8.310 -11.758 1.940 450 HZ2 LYS 57 HZ2 LYS 57 -6.872 -12.140 2.753 451 HZ3 LYS 57 HZ3 LYS 57 -8.332 -12.047 3.609 452 H LEU 58 H LEU 58 -2.644 -14.296 3.232 453 HA LEU 58 HA LEU 58 -3.919 -12.186 4.748 454 HB2 LEU 58 HB2 LEU 58 -2.325 -14.213 5.485 455 HB3 LEU 58 HB3 LEU 58 -1.095 -12.994 5.223 456 HG LEU 58 HG LEU 58 -3.429 -12.708 7.119 457 HD11 LEU 58 HD11 LEU 58 -1.571 -12.862 8.829 458 HD12 LEU 58 HD12 LEU 58 -0.563 -13.500 7.532 459 HD13 LEU 58 HD13 LEU 58 -2.021 -14.363 8.020 460 HD21 LEU 58 HD21 LEU 58 -2.051 -10.803 7.979 461 HD22 LEU 58 HD22 LEU 58 -2.738 -10.551 6.374 462 HD23 LEU 58 HD23 LEU 58 -1.036 -10.974 6.550 463 H ALA 59 H ALA 59 -0.846 -12.613 3.036 464 HA ALA 59 HA ALA 59 0.095 -10.009 3.205 465 HB1 ALA 59 HB1 ALA 59 0.582 -12.040 1.035 466 HB2 ALA 59 HB2 ALA 59 1.481 -11.881 2.542 467 HB3 ALA 59 HB3 ALA 59 1.557 -10.602 1.332 468 H VAL 60 H VAL 60 -1.927 -11.474 0.675 469 HA VAL 60 HA VAL 60 -1.939 -9.147 -0.960 470 HB VAL 60 HB VAL 60 -2.455 -11.488 -1.744 471 HG11 VAL 60 HG11 VAL 60 -4.024 -12.098 0.036 472 HG12 VAL 60 HG12 VAL 60 -4.728 -12.309 -1.566 473 HG13 VAL 60 HG13 VAL 60 -5.177 -10.915 -0.584 474 HG21 VAL 60 HG21 VAL 60 -2.853 -9.490 -3.115 475 HG22 VAL 60 HG22 VAL 60 -4.485 -9.380 -2.459 476 HG23 VAL 60 HG23 VAL 60 -4.022 -10.769 -3.443 477 H LEU 61 H LEU 61 -3.788 -10.134 1.804 478 HA LEU 61 HA LEU 61 -6.002 -8.375 1.363 479 HB2 LEU 61 HB2 LEU 61 -6.163 -10.392 2.784 480 HB3 LEU 61 HB3 LEU 61 -5.034 -9.673 3.914 481 HG LEU 61 HG LEU 61 -6.713 -7.809 4.244 482 HD11 LEU 61 HD11 LEU 61 -8.044 -8.070 2.264 483 HD12 LEU 61 HD12 LEU 61 -9.058 -8.374 3.673 484 HD13 LEU 61 HD13 LEU 61 -8.459 -9.725 2.709 485 HD21 LEU 61 HD21 LEU 61 -6.400 -9.595 5.868 486 HD22 LEU 61 HD22 LEU 61 -7.551 -10.605 4.995 487 HD23 LEU 61 HD23 LEU 61 -8.096 -9.121 5.772 488 H THR 62 H THR 62 -3.034 -8.272 3.285 489 HA THR 62 HA THR 62 -3.549 -5.755 4.465 490 HB THR 62 HB THR 62 -0.969 -5.770 4.742 491 HG1 THR 62 HG1 THR 62 -0.669 -7.387 3.052 492 HG21 THR 62 HG21 THR 62 -2.663 -7.985 5.891 493 HG22 THR 62 HG22 THR 62 -2.547 -6.337 6.509 494 HG23 THR 62 HG23 THR 62 -1.140 -7.398 6.560 495 H ALA 63 H ALA 63 -2.115 -6.759 1.442 496 HA ALA 63 HA ALA 63 -0.859 -4.373 0.689 497 HB1 ALA 63 HB1 ALA 63 -0.585 -6.593 -0.409 498 HB2 ALA 63 HB2 ALA 63 -0.841 -5.261 -1.534 499 HB3 ALA 63 HB3 ALA 63 -2.163 -6.365 -1.158 500 H VAL 64 H VAL 64 -4.104 -5.582 -0.140 501 HA VAL 64 HA VAL 64 -4.840 -3.211 -1.511 502 HB VAL 64 HB VAL 64 -5.871 -5.425 -1.950 503 HG11 VAL 64 HG11 VAL 64 -7.248 -4.943 0.684 504 HG12 VAL 64 HG12 VAL 64 -6.186 -6.285 0.263 505 HG13 VAL 64 HG13 VAL 64 -7.763 -6.136 -0.507 506 HG21 VAL 64 HG21 VAL 64 -6.934 -3.436 -2.789 507 HG22 VAL 64 HG22 VAL 64 -7.763 -3.188 -1.253 508 HG23 VAL 64 HG23 VAL 64 -8.166 -4.579 -2.260 509 H GLN 65 H GLN 65 -5.129 -4.221 1.832 510 HA GLN 65 HA GLN 65 -7.027 -2.261 2.618 511 HB2 GLN 65 HB2 GLN 65 -6.109 -4.421 3.853 512 HB3 GLN 65 HB3 GLN 65 -4.963 -3.274 4.534 513 HG2 GLN 65 HG2 GLN 65 -7.772 -2.418 4.666 514 HG3 GLN 65 HG3 GLN 65 -7.390 -3.855 5.614 515 HE21 GLN 65 HE21 GLN 65 -6.859 -0.447 5.214 516 HE22 GLN 65 HE22 GLN 65 -6.087 -0.187 6.740 517 H ILE 66 H ILE 66 -3.498 -2.349 2.599 518 HA ILE 66 HA ILE 66 -3.129 0.203 3.791 519 HB ILE 66 HB ILE 66 -1.327 -1.565 2.142 520 HG12 ILE 66 HG12 ILE 66 -1.160 -0.747 5.049 521 HG13 ILE 66 HG13 ILE 66 -1.964 -2.209 4.489 522 HG21 ILE 66 HG21 ILE 66 -0.617 1.075 3.417 523 HG22 ILE 66 HG22 ILE 66 -0.643 0.715 1.690 524 HG23 ILE 66 HG23 ILE 66 0.539 -0.073 2.736 525 HD11 ILE 66 HD11 ILE 66 0.882 -1.646 4.839 526 HD12 ILE 66 HD12 ILE 66 0.480 -2.449 3.322 527 HD13 ILE 66 HD13 ILE 66 0.008 -3.180 4.856 528 H ALA 67 H ALA 67 -3.224 -0.941 0.441 529 HA ALA 67 HA ALA 67 -2.539 1.459 -0.815 530 HB1 ALA 67 HB1 ALA 67 -3.511 0.495 -2.832 531 HB2 ALA 67 HB2 ALA 67 -4.302 -0.749 -1.862 532 HB3 ALA 67 HB3 ALA 67 -2.541 -0.693 -1.959 533 H SER 68 H SER 68 -5.770 0.212 0.057 534 HA SER 68 HA SER 68 -7.212 2.281 -1.203 535 HB2 SER 68 HB2 SER 68 -9.008 1.558 0.567 536 HB3 SER 68 HB3 SER 68 -8.529 0.438 -0.708 537 HG SER 68 HG SER 68 -7.383 -0.736 0.716 538 H GLU 69 H GLU 69 -6.175 1.906 2.174 539 HA GLU 69 HA GLU 69 -7.330 4.281 3.124 540 HB2 GLU 69 HB2 GLU 69 -5.137 2.493 4.089 541 HB3 GLU 69 HB3 GLU 69 -5.452 4.013 4.914 542 HG2 GLU 69 HG2 GLU 69 -7.439 1.787 4.487 543 HG3 GLU 69 HG3 GLU 69 -6.598 2.158 5.992 544 H TYR 70 H TYR 70 -4.279 3.689 1.512 545 HA TYR 70 HA TYR 70 -3.312 6.353 2.095 546 HB2 TYR 70 HB2 TYR 70 -2.211 3.963 0.692 547 HB3 TYR 70 HB3 TYR 70 -1.521 5.543 0.333 548 HD1 TYR 70 HD2 TYR 70 -2.611 3.704 3.414 549 HD2 TYR 70 HD1 TYR 70 0.388 6.032 1.502 550 HE1 TYR 70 HE2 TYR 70 -1.229 3.577 5.446 551 HE2 TYR 70 HE1 TYR 70 1.777 5.912 3.522 552 HH TYR 70 HH TYR 70 1.196 3.771 6.051 553 H LEU 71 H LEU 71 -4.901 4.681 -0.529 554 HA LEU 71 HA LEU 71 -4.397 6.591 -2.544 555 HB2 LEU 71 HB2 LEU 71 -6.331 4.368 -2.179 556 HB3 LEU 71 HB3 LEU 71 -6.721 5.572 -3.392 557 HG LEU 71 HG LEU 71 -4.045 4.180 -3.373 558 HD11 LEU 71 HD11 LEU 71 -4.941 2.631 -5.068 559 HD12 LEU 71 HD12 LEU 71 -6.563 3.234 -4.739 560 HD13 LEU 71 HD13 LEU 71 -5.662 2.388 -3.478 561 HD21 LEU 71 HD21 LEU 71 -5.613 5.412 -5.637 562 HD22 LEU 71 HD22 LEU 71 -3.958 4.807 -5.688 563 HD23 LEU 71 HD23 LEU 71 -4.342 6.238 -4.737 564 H LYS 72 H LYS 72 -6.790 6.396 -0.002 565 HA LYS 72 HA LYS 72 -8.446 8.480 -1.035 566 HB2 LYS 72 HB2 LYS 72 -9.722 8.252 0.902 567 HB3 LYS 72 HB3 LYS 72 -9.045 6.644 0.685 568 HG2 LYS 72 HG2 LYS 72 -7.308 7.181 2.352 569 HG3 LYS 72 HG3 LYS 72 -8.059 8.759 2.599 570 HD2 LYS 72 HD2 LYS 72 -10.188 7.464 3.171 571 HD3 LYS 72 HD3 LYS 72 -9.156 6.033 3.261 572 HE2 LYS 72 HE2 LYS 72 -7.713 7.403 4.865 573 HE3 LYS 72 HE3 LYS 72 -9.075 8.518 4.953 574 HZ1 LYS 72 HZ1 LYS 72 -9.459 7.115 6.710 575 HZ2 LYS 72 HZ2 LYS 72 -8.877 5.739 5.913 576 HZ3 LYS 72 HZ3 LYS 72 -10.394 6.378 5.510 577 H LEU 73 H LEU 73 -5.465 8.413 0.604 578 HA LEU 73 HA LEU 73 -5.730 11.055 1.764 579 HB2 LEU 73 HB2 LEU 73 -4.494 9.277 2.942 580 HB3 LEU 73 HB3 LEU 73 -3.354 9.196 1.615 581 HG LEU 73 HG LEU 73 -2.709 11.562 2.104 582 HD11 LEU 73 HD11 LEU 73 -4.515 11.130 4.476 583 HD12 LEU 73 HD12 LEU 73 -4.638 12.382 3.240 584 HD13 LEU 73 HD13 LEU 73 -3.297 12.402 4.384 585 HD21 LEU 73 HD21 LEU 73 -2.376 9.604 4.372 586 HD22 LEU 73 HD22 LEU 73 -1.357 11.008 4.054 587 HD23 LEU 73 HD23 LEU 73 -1.391 9.667 2.910 588 H LYS 74 H LYS 74 -4.133 9.505 -0.987 589 HA LYS 74 HA LYS 74 -2.580 11.764 -1.714 590 HB2 LYS 74 HB2 LYS 74 -2.002 10.616 -3.680 591 HB3 LYS 74 HB3 LYS 74 -2.239 9.353 -2.483 592 HG2 LYS 74 HG2 LYS 74 -4.038 8.493 -3.546 593 HG3 LYS 74 HG3 LYS 74 -4.600 10.066 -4.104 594 HD2 LYS 74 HD2 LYS 74 -3.917 8.760 -6.008 595 HD3 LYS 74 HD3 LYS 74 -2.769 10.074 -5.776 596 HE2 LYS 74 HE2 LYS 74 -1.163 8.610 -4.809 597 HE3 LYS 74 HE3 LYS 74 -2.330 7.295 -4.725 598 HZ1 LYS 74 HZ1 LYS 74 -2.392 7.724 -7.307 599 HZ2 LYS 74 HZ2 LYS 74 -1.241 6.704 -6.602 600 HZ3 LYS 74 HZ3 LYS 74 -0.828 8.294 -7.015 601 H GLU 75 H GLU 75 -5.896 10.898 -2.257 602 HA GLU 75 HA GLU 75 -6.239 12.804 -4.384 603 HB2 GLU 75 HB2 GLU 75 -8.325 11.940 -4.670 604 HB3 GLU 75 HB3 GLU 75 -7.608 10.594 -3.798 605 HG2 GLU 75 HG2 GLU 75 -8.875 10.932 -1.962 606 HG3 GLU 75 HG3 GLU 75 -8.907 12.685 -2.169 607 H GLU 76 H GLU 76 -6.359 12.816 -0.948 608 HA GLU 76 HA GLU 76 -8.008 15.081 -0.548 609 HB2 GLU 76 HB2 GLU 76 -7.387 13.480 1.246 610 HB3 GLU 76 HB3 GLU 76 -5.731 14.064 1.174 611 HG2 GLU 76 HG2 GLU 76 -6.515 15.263 2.943 612 HG3 GLU 76 HG3 GLU 76 -6.867 16.383 1.628 613 H TYR 77 H TYR 77 -4.572 14.637 -1.105 614 HA TYR 77 HA TYR 77 -3.681 17.236 -0.608 615 HB2 TYR 77 HB2 TYR 77 -2.082 15.463 -0.854 616 HB3 TYR 77 HB3 TYR 77 -2.648 15.095 -2.477 617 HD1 TYR 77 HD2 TYR 77 -1.932 18.476 -1.113 618 HD2 TYR 77 HD1 TYR 77 -0.649 15.353 -3.702 619 HE1 TYR 77 HE2 TYR 77 -0.220 19.966 -2.044 620 HE2 TYR 77 HE1 TYR 77 1.073 16.833 -4.643 621 HH TYR 77 HH TYR 77 1.746 19.008 -4.806 622 H GLN 78 H GLN 78 -4.593 15.751 -3.717 623 HA GLN 78 HA GLN 78 -4.347 18.170 -5.172 624 HB2 GLN 78 HB2 GLN 78 -5.347 16.979 -7.022 625 HB3 GLN 78 HB3 GLN 78 -4.184 15.938 -6.216 626 HG2 GLN 78 HG2 GLN 78 -6.090 14.871 -5.015 627 HG3 GLN 78 HG3 GLN 78 -7.182 15.816 -6.027 628 HE21 GLN 78 HE21 GLN 78 -4.897 13.202 -5.932 629 HE22 GLN 78 HE22 GLN 78 -5.278 12.544 -7.484 630 H ARG 79 H ARG 79 -6.851 16.851 -3.216 631 HA ARG 79 HA ARG 79 -9.052 18.266 -4.361 632 HB2 ARG 79 HB2 ARG 79 -9.186 16.193 -2.920 633 HB3 ARG 79 HB3 ARG 79 -8.782 17.207 -1.543 634 HG2 ARG 79 HG2 ARG 79 -11.080 17.062 -1.426 635 HG3 ARG 79 HG3 ARG 79 -10.828 18.602 -2.251 636 HD2 ARG 79 HD2 ARG 79 -11.007 16.279 -4.031 637 HD3 ARG 79 HD3 ARG 79 -12.477 16.613 -3.117 638 HE ARG 79 HE ARG 79 -11.331 18.202 -5.240 639 HH11 ARG 79 HH11 ARG 79 -13.509 18.161 -2.490 640 HH12 ARG 79 HH12 ARG 79 -14.436 19.521 -3.039 641 HH21 ARG 79 HH21 ARG 79 -12.571 19.979 -5.988 642 HH22 ARG 79 HH22 ARG 79 -13.905 20.553 -5.022 643 H LEU 80 H LEU 80 -6.846 18.759 -1.686 644 HA LEU 80 HA LEU 80 -8.027 21.169 -0.736 645 HB2 LEU 80 HB2 LEU 80 -6.750 19.841 0.772 646 HB3 LEU 80 HB3 LEU 80 -5.362 19.839 -0.301 647 HG LEU 80 HG LEU 80 -5.366 22.415 0.104 648 HD11 LEU 80 HD11 LEU 80 -7.505 22.509 1.249 649 HD12 LEU 80 HD12 LEU 80 -6.202 23.042 2.315 650 HD13 LEU 80 HD13 LEU 80 -6.897 21.432 2.506 651 HD21 LEU 80 HD21 LEU 80 -3.562 20.991 0.810 652 HD22 LEU 80 HD22 LEU 80 -4.508 20.400 2.179 653 HD23 LEU 80 HD23 LEU 80 -3.977 22.081 2.133 654 H ARG 81 H ARG 81 -5.528 20.403 -3.064 655 HA ARG 81 HA ARG 81 -4.572 23.103 -3.218 656 HB2 ARG 81 HB2 ARG 81 -3.928 20.543 -4.592 657 HB3 ARG 81 HB3 ARG 81 -3.448 22.052 -5.363 658 HG2 ARG 81 HG2 ARG 81 -2.791 21.792 -2.500 659 HG3 ARG 81 HG3 ARG 81 -1.913 20.729 -3.602 660 HD2 ARG 81 HD2 ARG 81 -0.723 22.841 -3.207 661 HD3 ARG 81 HD3 ARG 81 -1.179 22.648 -4.899 662 HE ARG 81 HE ARG 81 -2.956 24.216 -3.194 663 HH11 ARG 81 HH11 ARG 81 -0.489 24.167 -5.672 664 HH12 ARG 81 HH12 ARG 81 -0.777 25.801 -6.172 665 HH21 ARG 81 HH21 ARG 81 -3.337 26.381 -3.867 666 HH22 ARG 81 HH22 ARG 81 -2.396 27.051 -5.155 667 H GLU 82 H GLU 82 -6.795 21.119 -5.127 668 HA GLU 82 HA GLU 82 -6.974 22.901 -7.312 669 HB2 GLU 82 HB2 GLU 82 -8.989 21.702 -7.950 670 HB3 GLU 82 HB3 GLU 82 -7.748 20.570 -7.435 671 HG2 GLU 82 HG2 GLU 82 -8.833 20.206 -5.355 672 HG3 GLU 82 HG3 GLU 82 -9.966 21.521 -5.649 673 H GLN 83 H GLN 83 -8.668 22.770 -4.238 674 HA GLN 83 HA GLN 83 -10.499 24.875 -4.993 675 HB2 GLN 83 HB2 GLN 83 -11.348 24.720 -2.727 676 HB3 GLN 83 HB3 GLN 83 -11.170 23.102 -3.395 677 HG2 GLN 83 HG2 GLN 83 -9.244 22.676 -2.098 678 HG3 GLN 83 HG3 GLN 83 -9.085 24.372 -1.650 679 HE21 GLN 83 HE21 GLN 83 -9.090 23.867 0.536 680 HE22 GLN 83 HE22 GLN 83 -10.529 23.402 1.371 681 H LEU 84 H LEU 84 -7.308 24.739 -4.061 682 HA LEU 84 HA LEU 84 -7.344 27.325 -2.692 683 HB2 LEU 84 HB2 LEU 84 -5.861 24.991 -2.324 684 HB3 LEU 84 HB3 LEU 84 -4.734 26.120 -3.045 685 HG LEU 84 HG LEU 84 -6.303 26.564 -0.498 686 HD11 LEU 84 HD11 LEU 84 -3.356 26.097 -0.936 687 HD12 LEU 84 HD12 LEU 84 -4.496 24.975 -0.190 688 HD13 LEU 84 HD13 LEU 84 -4.120 26.504 0.599 689 HD21 LEU 84 HD21 LEU 84 -4.284 28.352 -1.852 690 HD22 LEU 84 HD22 LEU 84 -4.969 28.612 -0.250 691 HD23 LEU 84 HD23 LEU 84 -6.008 28.671 -1.673 692 H LYS 85 H LYS 85 -7.569 26.546 -5.681 693 HA LYS 85 HA LYS 85 -5.874 28.731 -6.630 694 HB2 LYS 85 HB2 LYS 85 -5.165 27.434 -8.597 695 HB3 LYS 85 HB3 LYS 85 -4.582 26.701 -7.108 696 HG2 LYS 85 HG2 LYS 85 -6.216 24.985 -7.215 697 HG3 LYS 85 HG3 LYS 85 -7.072 25.798 -8.524 698 HD2 LYS 85 HD2 LYS 85 -4.221 24.964 -8.872 699 HD3 LYS 85 HD3 LYS 85 -5.523 23.788 -9.065 700 HE2 LYS 85 HE2 LYS 85 -5.271 26.391 -10.568 701 HE3 LYS 85 HE3 LYS 85 -4.858 24.801 -11.205 702 HZ1 LYS 85 HZ1 LYS 85 -7.415 26.074 -11.005 703 HZ2 LYS 85 HZ2 LYS 85 -7.427 24.529 -10.303 704 HZ3 LYS 85 HZ3 LYS 85 -6.950 24.720 -11.913 705 H LYS 86 H LYS 86 -6.491 29.134 -9.073 706 HA LYS 86 HA LYS 86 -9.348 29.499 -9.105 707 HB2 LYS 86 HB2 LYS 86 -7.238 30.208 -11.152 708 HB3 LYS 86 HB3 LYS 86 -8.928 30.685 -11.239 709 HG2 LYS 86 HG2 LYS 86 -7.004 31.484 -9.063 710 HG3 LYS 86 HG3 LYS 86 -7.486 32.492 -10.428 711 HD2 LYS 86 HD2 LYS 86 -9.890 31.689 -9.351 712 HD3 LYS 86 HD3 LYS 86 -8.875 31.933 -7.929 713 HE2 LYS 86 HE2 LYS 86 -9.987 33.993 -8.413 714 HE3 LYS 86 HE3 LYS 86 -8.286 34.179 -8.838 715 HZ1 LYS 86 HZ1 LYS 86 -9.662 35.103 -10.556 716 HZ2 LYS 86 HZ2 LYS 86 -10.526 33.663 -10.712 717 HZ3 LYS 86 HZ3 LYS 86 -8.898 33.724 -11.161 718 H1 GLY 1 H1 GLY 1 -37.118 -8.625 6.985 719 H2 GLY 1 H2 GLY 1 -37.809 -8.694 5.444 720 H3 GLY 1 H3 GLY 1 -38.769 -8.947 6.812 721 HA2 GLY 1 HA3 GLY 1 -39.087 -6.730 5.841 722 HA3 GLY 1 HA2 GLY 1 -38.519 -6.689 7.505 723 H SER 2 H SER 2 -38.235 -4.894 5.011 724 HA SER 2 HA SER 2 -35.465 -4.846 4.385 725 HB2 SER 2 HB2 SER 2 -36.844 -2.303 4.035 726 HB3 SER 2 HB3 SER 2 -36.132 -3.366 2.824 727 HG SER 2 HG SER 2 -38.617 -2.955 3.054 728 H HIS 3 H HIS 3 -33.815 -3.656 5.242 729 HA HIS 3 HA HIS 3 -34.412 -2.232 7.746 730 HB2 HIS 3 HB2 HIS 3 -31.933 -3.639 6.769 731 HB3 HIS 3 HB3 HIS 3 -31.890 -2.516 8.123 732 HD1 HIS 3 HD1 HIS 3 -32.190 -5.989 7.450 733 HD2 HIS 3 HD2 HIS 3 -33.927 -3.391 10.193 734 HE1 HIS 3 HE1 HIS 3 -33.077 -7.449 9.298 735 HE2 HIS 3 HE2 HIS 3 -34.140 -5.857 10.939 736 H MET 4 H MET 4 -34.349 -0.095 7.687 737 HA MET 4 HA MET 4 -32.750 1.205 5.588 738 HB2 MET 4 HB2 MET 4 -35.391 1.862 6.819 739 HB3 MET 4 HB3 MET 4 -34.368 3.191 6.296 740 HG2 MET 4 HG2 MET 4 -35.884 2.675 4.539 741 HG3 MET 4 HG3 MET 4 -34.272 2.165 4.046 742 HE1 MET 4 HE1 MET 4 -36.856 0.277 6.485 743 HE2 MET 4 HE2 MET 4 -37.742 -0.620 5.250 744 HE3 MET 4 HE3 MET 4 -37.776 1.144 5.256 745 H THR 5 H THR 5 -30.828 1.399 6.687 746 HA THR 5 HA THR 5 -30.882 3.120 9.072 747 HB THR 5 HB THR 5 -28.413 1.708 8.940 748 HG1 THR 5 HG1 THR 5 -30.127 -0.324 9.388 749 HG21 THR 5 HG21 THR 5 -29.174 0.836 11.125 750 HG22 THR 5 HG22 THR 5 -30.782 1.484 10.801 751 HG23 THR 5 HG23 THR 5 -29.409 2.577 10.977 752 H GLU 6 H GLU 6 -28.392 3.955 9.330 753 HA GLU 6 HA GLU 6 -28.028 5.748 7.134 754 HB2 GLU 6 HB2 GLU 6 -26.159 6.632 8.453 755 HB3 GLU 6 HB3 GLU 6 -27.603 6.450 9.436 756 HG2 GLU 6 HG2 GLU 6 -26.053 4.057 9.582 757 HG3 GLU 6 HG3 GLU 6 -25.027 5.445 9.936 758 H GLN 7 H GLN 7 -25.408 6.053 6.668 759 HA GLN 7 HA GLN 7 -24.564 3.425 5.652 760 HB2 GLN 7 HB2 GLN 7 -23.473 4.752 3.764 761 HB3 GLN 7 HB3 GLN 7 -25.221 4.595 3.728 762 HG2 GLN 7 HG2 GLN 7 -25.463 6.850 4.608 763 HG3 GLN 7 HG3 GLN 7 -23.710 7.009 4.713 764 HE21 GLN 7 HE21 GLN 7 -25.441 5.442 2.099 765 HE22 GLN 7 HE22 GLN 7 -25.032 6.600 0.884 766 HA PRO 8 HA PRO 8 -21.032 4.953 8.106 767 HB2 PRO 8 HB2 PRO 8 -20.901 2.846 9.808 768 HB3 PRO 8 HB3 PRO 8 -22.006 4.199 10.055 769 HG2 PRO 8 HG2 PRO 8 -22.585 1.438 9.265 770 HG3 PRO 8 HG3 PRO 8 -23.674 2.671 9.916 771 HD2 PRO 8 HD2 PRO 8 -23.301 1.855 7.163 772 HD3 PRO 8 HD3 PRO 8 -24.493 2.985 7.835 773 H LYS 9 H LYS 9 -19.021 3.361 8.855 774 HA LYS 9 HA LYS 9 -17.755 2.532 6.522 775 HB2 LYS 9 HB2 LYS 9 -17.264 1.825 9.411 776 HB3 LYS 9 HB3 LYS 9 -16.226 1.248 8.117 777 HG2 LYS 9 HG2 LYS 9 -15.810 3.620 7.487 778 HG3 LYS 9 HG3 LYS 9 -16.712 4.106 8.918 779 HD2 LYS 9 HD2 LYS 9 -14.421 2.198 9.150 780 HD3 LYS 9 HD3 LYS 9 -14.127 3.933 9.042 781 HE2 LYS 9 HE2 LYS 9 -16.020 2.730 11.047 782 HE3 LYS 9 HE3 LYS 9 -14.301 2.940 11.375 783 HZ1 LYS 9 HZ1 LYS 9 -14.597 5.326 10.889 784 HZ2 LYS 9 HZ2 LYS 9 -15.491 4.809 12.227 785 HZ3 LYS 9 HZ3 LYS 9 -16.265 5.074 10.748 786 H THR 10 H THR 10 -18.698 1.048 5.227 787 HA THR 10 HA THR 10 -19.596 -1.475 6.427 788 HB THR 10 HB THR 10 -21.231 -0.104 5.057 789 HG1 THR 10 HG1 THR 10 -22.106 -1.963 4.136 790 HG21 THR 10 HG21 THR 10 -19.679 0.584 3.272 791 HG22 THR 10 HG22 THR 10 -21.093 -0.250 2.628 792 HG23 THR 10 HG23 THR 10 -19.549 -1.095 2.750 793 H ARG 11 H ARG 11 -19.304 -3.404 4.917 794 HA ARG 11 HA ARG 11 -16.518 -3.392 4.015 795 HB2 ARG 11 HB2 ARG 11 -18.338 -5.755 4.484 796 HB3 ARG 11 HB3 ARG 11 -16.612 -5.811 4.176 797 HG2 ARG 11 HG2 ARG 11 -16.119 -4.846 6.296 798 HG3 ARG 11 HG3 ARG 11 -17.821 -4.475 6.584 799 HD2 ARG 11 HD2 ARG 11 -18.283 -6.929 6.500 800 HD3 ARG 11 HD3 ARG 11 -16.545 -7.200 6.429 801 HE ARG 11 HE ARG 11 -16.349 -6.376 8.639 802 HH11 ARG 11 HH11 ARG 11 -19.670 -6.619 7.551 803 HH12 ARG 11 HH12 ARG 11 -20.325 -6.646 9.157 804 HH21 ARG 11 HH21 ARG 11 -17.211 -6.405 10.757 805 HH22 ARG 11 HH22 ARG 11 -18.925 -6.530 10.981 806 H VAL 12 H VAL 12 -15.931 -4.278 2.020 807 HA VAL 12 HA VAL 12 -18.106 -4.657 0.075 808 HB VAL 12 HB VAL 12 -17.144 -2.347 -0.117 809 HG11 VAL 12 HG11 VAL 12 -14.628 -3.885 -0.689 810 HG12 VAL 12 HG12 VAL 12 -14.880 -2.569 0.459 811 HG13 VAL 12 HG13 VAL 12 -14.877 -2.241 -1.276 812 HG21 VAL 12 HG21 VAL 12 -16.684 -4.173 -2.468 813 HG22 VAL 12 HG22 VAL 12 -16.836 -2.418 -2.548 814 HG23 VAL 12 HG23 VAL 12 -18.206 -3.399 -2.027 815 H SER 13 H SER 13 -17.633 -6.119 -1.584 816 HA SER 13 HA SER 13 -15.319 -7.827 -1.054 817 HB2 SER 13 HB2 SER 13 -17.810 -8.393 -2.682 818 HB3 SER 13 HB3 SER 13 -16.531 -9.549 -2.312 819 HG SER 13 HG SER 13 -17.632 -9.956 -0.582 820 H VAL 14 H VAL 14 -13.672 -7.913 -2.446 821 HA VAL 14 HA VAL 14 -14.059 -6.827 -5.157 822 HB VAL 14 HB VAL 14 -11.685 -6.002 -5.028 823 HG11 VAL 14 HG11 VAL 14 -12.264 -3.945 -3.787 824 HG12 VAL 14 HG12 VAL 14 -13.709 -4.751 -3.179 825 HG13 VAL 14 HG13 VAL 14 -13.531 -4.448 -4.907 826 HG21 VAL 14 HG21 VAL 14 -12.046 -6.279 -2.050 827 HG22 VAL 14 HG22 VAL 14 -10.632 -5.669 -2.906 828 HG23 VAL 14 HG23 VAL 14 -11.068 -7.373 -3.031 829 H ARG 15 H ARG 15 -12.660 -7.736 -6.770 830 HA ARG 15 HA ARG 15 -11.702 -10.403 -6.004 831 HB2 ARG 15 HB2 ARG 15 -13.611 -10.017 -7.752 832 HB3 ARG 15 HB3 ARG 15 -12.282 -9.633 -8.838 833 HG2 ARG 15 HG2 ARG 15 -11.507 -11.777 -8.877 834 HG3 ARG 15 HG3 ARG 15 -12.134 -12.150 -7.268 835 HD2 ARG 15 HD2 ARG 15 -13.681 -11.915 -9.842 836 HD3 ARG 15 HD3 ARG 15 -13.440 -13.360 -8.858 837 HE ARG 15 HE ARG 15 -14.693 -11.876 -7.094 838 HH11 ARG 15 HH11 ARG 15 -15.405 -12.264 -10.503 839 HH12 ARG 15 HH12 ARG 15 -17.075 -11.836 -10.326 840 HH21 ARG 15 HH21 ARG 15 -16.860 -11.313 -6.854 841 HH22 ARG 15 HH22 ARG 15 -17.915 -11.302 -8.238 842 H ILE 16 H ILE 16 -9.573 -10.450 -5.762 843 HA ILE 16 HA ILE 16 -7.900 -9.051 -7.746 844 HB ILE 16 HB ILE 16 -7.293 -9.406 -4.806 845 HG12 ILE 16 HG12 ILE 16 -7.708 -6.830 -6.311 846 HG13 ILE 16 HG13 ILE 16 -8.996 -7.642 -5.428 847 HG21 ILE 16 HG21 ILE 16 -5.266 -8.171 -5.209 848 HG22 ILE 16 HG22 ILE 16 -5.684 -7.974 -6.910 849 HG23 ILE 16 HG23 ILE 16 -5.313 -9.576 -6.273 850 HD11 ILE 16 HD11 ILE 16 -8.225 -6.039 -3.941 851 HD12 ILE 16 HD12 ILE 16 -6.536 -6.314 -4.369 852 HD13 ILE 16 HD13 ILE 16 -7.409 -7.512 -3.413 853 H TYR 17 H TYR 17 -6.499 -10.331 -8.763 854 HA TYR 17 HA TYR 17 -5.319 -12.151 -9.415 855 HB2 TYR 17 HB2 TYR 17 -4.451 -11.752 -6.934 856 HB3 TYR 17 HB3 TYR 17 -5.257 -13.291 -6.654 857 HD1 TYR 17 HD1 TYR 17 -2.744 -11.676 -8.883 858 HD2 TYR 17 HD2 TYR 17 -4.132 -15.285 -7.111 859 HE1 TYR 17 HE1 TYR 17 -0.770 -12.855 -9.753 860 HE2 TYR 17 HE2 TYR 17 -2.161 -16.473 -7.977 861 HH TYR 17 HH TYR 17 -0.537 -16.062 -10.060 862 H GLY 18 H GLY 18 -8.223 -12.186 -9.268 863 HA2 GLY 18 HA2 GLY 18 -9.768 -13.735 -10.033 864 HA3 GLY 18 HA3 GLY 18 -8.595 -15.008 -9.755 865 H GLN 19 H GLN 19 -8.493 -13.633 -6.893 866 HA GLN 19 HA GLN 19 -10.624 -15.361 -5.860 867 HB2 GLN 19 HB2 GLN 19 -8.342 -14.129 -4.323 868 HB3 GLN 19 HB3 GLN 19 -9.426 -15.401 -3.779 869 HG2 GLN 19 HG2 GLN 19 -7.554 -15.704 -6.113 870 HG3 GLN 19 HG3 GLN 19 -7.139 -16.151 -4.459 871 HE21 GLN 19 HE21 GLN 19 -7.414 -17.769 -6.915 872 HE22 GLN 19 HE22 GLN 19 -8.539 -19.018 -6.506 873 H ASP 20 H ASP 20 -12.078 -14.643 -4.289 874 HA ASP 20 HA ASP 20 -12.651 -11.784 -4.438 875 HB2 ASP 20 HB2 ASP 20 -14.281 -13.960 -4.588 876 HB3 ASP 20 HB3 ASP 20 -14.450 -13.540 -2.889 877 H TYR 21 H TYR 21 -12.106 -10.423 -2.848 878 HA TYR 21 HA TYR 21 -11.669 -11.527 -0.144 879 HB2 TYR 21 HB2 TYR 21 -10.216 -9.153 -1.329 880 HB3 TYR 21 HB3 TYR 21 -9.895 -9.933 0.213 881 HD1 TYR 21 HD2 TYR 21 -9.963 -12.810 -0.698 882 HD2 TYR 21 HD1 TYR 21 -8.151 -9.357 -2.403 883 HE1 TYR 21 HE2 TYR 21 -8.284 -14.235 -1.785 884 HE2 TYR 21 HE1 TYR 21 -6.464 -10.786 -3.489 885 HH TYR 21 HH TYR 21 -6.203 -13.090 -4.222 886 H THR 22 H THR 22 -12.303 -10.222 1.605 887 HA THR 22 HA THR 22 -14.206 -8.102 0.891 888 HB THR 22 HB THR 22 -14.181 -9.290 3.620 889 HG1 THR 22 HG1 THR 22 -14.976 -10.638 1.246 890 HG21 THR 22 HG21 THR 22 -16.386 -8.479 1.716 891 HG22 THR 22 HG22 THR 22 -15.748 -7.498 3.035 892 HG23 THR 22 HG23 THR 22 -16.609 -8.997 3.387 893 H ILE 23 H ILE 23 -13.759 -6.077 1.470 894 HA ILE 23 HA ILE 23 -11.854 -5.595 3.659 895 HB ILE 23 HB ILE 23 -10.950 -3.646 2.331 896 HG12 ILE 23 HG12 ILE 23 -12.205 -5.136 0.011 897 HG13 ILE 23 HG13 ILE 23 -12.795 -3.610 0.659 898 HG21 ILE 23 HG21 ILE 23 -10.398 -6.364 1.144 899 HG22 ILE 23 HG22 ILE 23 -9.752 -5.787 2.680 900 HG23 ILE 23 HG23 ILE 23 -9.313 -4.973 1.182 901 HD11 ILE 23 HD11 ILE 23 -11.567 -2.979 -1.192 902 HD12 ILE 23 HD12 ILE 23 -10.299 -4.163 -0.880 903 HD13 ILE 23 HD13 ILE 23 -10.438 -2.729 0.140 904 H VAL 24 H VAL 24 -11.877 -3.027 4.049 905 HA VAL 24 HA VAL 24 -14.720 -2.333 4.316 906 HB VAL 24 HB VAL 24 -12.387 -1.130 5.809 907 HG11 VAL 24 HG11 VAL 24 -14.069 -0.200 7.278 908 HG12 VAL 24 HG12 VAL 24 -15.348 -0.985 6.351 909 HG13 VAL 24 HG13 VAL 24 -14.384 0.298 5.615 910 HG21 VAL 24 HG21 VAL 24 -14.326 -3.250 6.723 911 HG22 VAL 24 HG22 VAL 24 -13.093 -2.480 7.719 912 HG23 VAL 24 HG23 VAL 24 -12.622 -3.500 6.360 913 H GLY 25 H GLY 25 -15.510 -0.767 3.051 914 HA2 GLY 25 HA2 GLY 25 -13.601 1.199 1.943 915 HA3 GLY 25 HA3 GLY 25 -14.920 0.517 0.997 916 H ALA 26 H ALA 26 -13.981 2.954 3.199 917 HA ALA 26 HA ALA 26 -16.780 3.825 3.474 918 HB1 ALA 26 HB1 ALA 26 -15.574 3.308 5.578 919 HB2 ALA 26 HB2 ALA 26 -16.163 4.966 5.485 920 HB3 ALA 26 HB3 ALA 26 -14.454 4.620 5.210 921 H GLU 27 H GLU 27 -14.486 4.379 1.392 922 HA GLU 27 HA GLU 27 -14.536 7.303 1.551 923 HB2 GLU 27 HB2 GLU 27 -12.414 5.797 1.096 924 HB3 GLU 27 HB3 GLU 27 -13.003 5.828 -0.558 925 HG2 GLU 27 HG2 GLU 27 -12.385 8.258 1.100 926 HG3 GLU 27 HG3 GLU 27 -11.314 7.546 -0.105 927 H SER 28 H SER 28 -14.827 4.859 -1.031 928 HA SER 28 HA SER 28 -17.308 5.816 -1.965 929 HB2 SER 28 HB2 SER 28 -16.398 7.667 -2.999 930 HB3 SER 28 HB3 SER 28 -14.818 6.917 -3.189 931 HG SER 28 HG SER 28 -16.789 7.126 -4.973 932 HA PRO 29 HA PRO 29 -17.236 1.662 -3.474 933 HB2 PRO 29 HB2 PRO 29 -19.020 2.002 -5.580 934 HB3 PRO 29 HB3 PRO 29 -19.466 1.660 -3.904 935 HG2 PRO 29 HG2 PRO 29 -19.409 4.257 -5.360 936 HG3 PRO 29 HG3 PRO 29 -20.566 3.674 -4.153 937 HD2 PRO 29 HD2 PRO 29 -18.671 5.466 -3.528 938 HD3 PRO 29 HD3 PRO 29 -19.170 4.206 -2.379 939 H ALA 30 H ALA 30 -16.910 4.333 -5.776 940 HA ALA 30 HA ALA 30 -15.745 2.681 -7.820 941 HB1 ALA 30 HB1 ALA 30 -15.814 5.684 -7.573 942 HB2 ALA 30 HB2 ALA 30 -17.013 4.690 -8.399 943 HB3 ALA 30 HB3 ALA 30 -15.363 4.774 -9.014 944 H HIS 31 H HIS 31 -14.585 4.886 -5.352 945 HA HIS 31 HA HIS 31 -11.878 4.980 -6.144 946 HB2 HIS 31 HB2 HIS 31 -13.405 6.063 -4.047 947 HB3 HIS 31 HB3 HIS 31 -12.136 5.130 -3.272 948 HD1 HIS 31 HD1 HIS 31 -9.724 6.011 -3.497 949 HD2 HIS 31 HD2 HIS 31 -12.558 8.319 -5.459 950 HE1 HIS 31 HE1 HIS 31 -8.566 8.172 -4.046 951 HE2 HIS 31 HE2 HIS 31 -10.395 9.644 -4.972 952 H ILE 32 H ILE 32 -13.570 2.913 -3.829 953 HA ILE 32 HA ILE 32 -11.234 1.410 -3.147 954 HB ILE 32 HB ILE 32 -12.690 -0.031 -1.880 955 HG12 ILE 32 HG12 ILE 32 -14.947 1.347 -3.364 956 HG13 ILE 32 HG13 ILE 32 -14.553 -0.363 -3.368 957 HG21 ILE 32 HG21 ILE 32 -13.486 1.549 -0.309 958 HG22 ILE 32 HG22 ILE 32 -13.732 2.773 -1.553 959 HG23 ILE 32 HG23 ILE 32 -12.098 2.296 -1.096 960 HD11 ILE 32 HD11 ILE 32 -15.118 -0.340 -0.897 961 HD12 ILE 32 HD12 ILE 32 -16.452 -0.149 -2.031 962 HD13 ILE 32 HD13 ILE 32 -15.810 1.257 -1.183 963 H ARG 33 H ARG 33 -13.446 1.258 -5.742 964 HA ARG 33 HA ARG 33 -13.168 -1.543 -6.271 965 HB2 ARG 33 HB2 ARG 33 -14.964 0.299 -7.072 966 HB3 ARG 33 HB3 ARG 33 -13.910 0.289 -8.480 967 HG2 ARG 33 HG2 ARG 33 -14.459 -1.858 -9.047 968 HG3 ARG 33 HG3 ARG 33 -14.846 -2.312 -7.385 969 HD2 ARG 33 HD2 ARG 33 -16.877 -2.213 -8.687 970 HD3 ARG 33 HD3 ARG 33 -16.866 -0.907 -7.503 971 HE ARG 33 HE ARG 33 -15.896 -0.229 -10.149 972 HH11 ARG 33 HH11 ARG 33 -18.599 -0.262 -7.928 973 HH12 ARG 33 HH12 ARG 33 -19.493 0.944 -8.801 974 HH21 ARG 33 HH21 ARG 33 -17.062 1.341 -11.306 975 HH22 ARG 33 HH22 ARG 33 -18.626 1.840 -10.742 976 H LEU 34 H LEU 34 -11.677 1.424 -7.510 977 HA LEU 34 HA LEU 34 -10.119 0.089 -9.482 978 HB2 LEU 34 HB2 LEU 34 -8.889 2.178 -9.705 979 HB3 LEU 34 HB3 LEU 34 -10.617 2.452 -9.706 980 HG LEU 34 HG LEU 34 -10.102 2.885 -7.096 981 HD11 LEU 34 HD11 LEU 34 -8.038 4.212 -6.928 982 HD12 LEU 34 HD12 LEU 34 -7.612 3.739 -8.573 983 HD13 LEU 34 HD13 LEU 34 -7.712 2.520 -7.303 984 HD21 LEU 34 HD21 LEU 34 -10.066 5.288 -7.681 985 HD22 LEU 34 HD22 LEU 34 -11.320 4.386 -8.531 986 HD23 LEU 34 HD23 LEU 34 -9.840 4.841 -9.372 987 H VAL 35 H VAL 35 -9.771 0.456 -6.094 988 HA VAL 35 HA VAL 35 -6.967 0.290 -5.834 989 HB VAL 35 HB VAL 35 -9.035 -0.834 -3.927 990 HG11 VAL 35 HG11 VAL 35 -7.339 -0.610 -2.229 991 HG12 VAL 35 HG12 VAL 35 -6.224 0.112 -3.386 992 HG13 VAL 35 HG13 VAL 35 -6.700 -1.575 -3.561 993 HG21 VAL 35 HG21 VAL 35 -7.798 1.915 -3.943 994 HG22 VAL 35 HG22 VAL 35 -8.959 1.292 -2.772 995 HG23 VAL 35 HG23 VAL 35 -9.443 1.542 -4.449 996 H ALA 36 H ALA 36 -9.496 -2.128 -6.119 997 HA ALA 36 HA ALA 36 -7.995 -4.433 -5.628 998 HB1 ALA 36 HB1 ALA 36 -10.275 -4.249 -7.580 999 HB2 ALA 36 HB2 ALA 36 -10.498 -4.233 -5.833 1000 HB3 ALA 36 HB3 ALA 36 -9.774 -5.640 -6.614 1001 H ALA 37 H ALA 37 -8.757 -2.841 -8.706 1002 HA ALA 37 HA ALA 37 -7.297 -4.634 -10.328 1003 HB1 ALA 37 HB1 ALA 37 -9.086 -3.194 -11.185 1004 HB2 ALA 37 HB2 ALA 37 -7.588 -2.986 -12.092 1005 HB3 ALA 37 HB3 ALA 37 -8.075 -1.778 -10.901 1006 H PHE 38 H PHE 38 -6.405 -1.826 -8.484 1007 HA PHE 38 HA PHE 38 -3.944 -1.257 -9.768 1008 HB2 PHE 38 HB2 PHE 38 -5.236 0.269 -8.211 1009 HB3 PHE 38 HB3 PHE 38 -4.636 -0.706 -6.875 1010 HD1 PHE 38 HD2 PHE 38 -3.181 0.902 -9.921 1011 HD2 PHE 38 HD1 PHE 38 -2.899 0.246 -5.727 1012 HE1 PHE 38 HE2 PHE 38 -1.143 2.282 -9.847 1013 HE2 PHE 38 HE1 PHE 38 -0.864 1.626 -5.646 1014 HZ PHE 38 HZ PHE 38 0.016 2.643 -7.708 1015 H VAL 39 H VAL 39 -4.799 -3.224 -6.944 1016 HA VAL 39 HA VAL 39 -2.119 -3.993 -6.344 1017 HB VAL 39 HB VAL 39 -4.723 -5.344 -5.594 1018 HG11 VAL 39 HG11 VAL 39 -2.838 -6.883 -5.428 1019 HG12 VAL 39 HG12 VAL 39 -3.438 -6.441 -3.827 1020 HG13 VAL 39 HG13 VAL 39 -1.957 -5.711 -4.447 1021 HG21 VAL 39 HG21 VAL 39 -3.004 -3.368 -4.102 1022 HG22 VAL 39 HG22 VAL 39 -4.372 -4.242 -3.416 1023 HG23 VAL 39 HG23 VAL 39 -4.629 -3.096 -4.729 1024 H ASP 40 H ASP 40 -4.792 -5.514 -8.090 1025 HA ASP 40 HA ASP 40 -3.560 -7.948 -8.712 1026 HB2 ASP 40 HB2 ASP 40 -5.934 -7.663 -9.047 1027 HB3 ASP 40 HB3 ASP 40 -5.663 -6.359 -10.196 1028 H ASP 41 H ASP 41 -3.448 -4.821 -10.293 1029 HA ASP 41 HA ASP 41 -2.141 -5.555 -12.660 1030 HB2 ASP 41 HB2 ASP 41 -3.232 -3.370 -12.306 1031 HB3 ASP 41 HB3 ASP 41 -1.988 -2.940 -11.138 1032 H LYS 42 H LYS 42 -0.857 -4.538 -9.521 1033 HA LYS 42 HA LYS 42 1.865 -4.602 -10.374 1034 HB2 LYS 42 HB2 LYS 42 0.853 -3.266 -8.440 1035 HB3 LYS 42 HB3 LYS 42 0.926 -4.762 -7.520 1036 HG2 LYS 42 HG2 LYS 42 3.029 -4.334 -6.999 1037 HG3 LYS 42 HG3 LYS 42 3.463 -4.395 -8.707 1038 HD2 LYS 42 HD2 LYS 42 2.204 -1.893 -7.764 1039 HD3 LYS 42 HD3 LYS 42 3.820 -2.231 -7.143 1040 HE2 LYS 42 HE2 LYS 42 4.101 -0.941 -9.111 1041 HE3 LYS 42 HE3 LYS 42 4.543 -2.595 -9.525 1042 HZ1 LYS 42 HZ1 LYS 42 2.801 -1.033 -10.892 1043 HZ2 LYS 42 HZ2 LYS 42 1.769 -2.024 -9.998 1044 HZ3 LYS 42 HZ3 LYS 42 2.925 -2.687 -11.032 1045 H MET 43 H MET 43 -0.261 -6.907 -8.737 1046 HA MET 43 HA MET 43 1.825 -8.753 -8.129 1047 HB2 MET 43 HB2 MET 43 -1.163 -8.884 -8.115 1048 HB3 MET 43 HB3 MET 43 -0.233 -10.371 -7.989 1049 HG2 MET 43 HG2 MET 43 0.957 -9.373 -6.036 1050 HG3 MET 43 HG3 MET 43 -0.167 -8.018 -6.119 1051 HE1 MET 43 HE1 MET 43 0.356 -11.771 -5.229 1052 HE2 MET 43 HE2 MET 43 -0.692 -11.903 -6.644 1053 HE3 MET 43 HE3 MET 43 -1.298 -12.359 -5.052 1054 H HIS 44 H HIS 44 -0.172 -8.187 -10.914 1055 HA HIS 44 HA HIS 44 0.330 -10.747 -12.106 1056 HB2 HIS 44 HB2 HIS 44 -1.560 -8.864 -12.509 1057 HB3 HIS 44 HB3 HIS 44 -0.477 -8.507 -13.850 1058 HD1 HIS 44 HD1 HIS 44 -2.628 -9.331 -15.272 1059 HD2 HIS 44 HD2 HIS 44 -0.573 -12.246 -13.137 1060 HE1 HIS 44 HE1 HIS 44 -3.356 -11.527 -16.253 1061 HE2 HIS 44 HE2 HIS 44 -1.987 -13.262 -15.045 1062 H GLU 45 H GLU 45 2.204 -7.923 -11.850 1063 HA GLU 45 HA GLU 45 3.681 -8.580 -14.295 1064 HB2 GLU 45 HB2 GLU 45 4.780 -6.439 -14.071 1065 HB3 GLU 45 HB3 GLU 45 3.038 -6.226 -13.967 1066 HG2 GLU 45 HG2 GLU 45 3.168 -5.975 -11.570 1067 HG3 GLU 45 HG3 GLU 45 4.895 -6.334 -11.595 1068 H PHE 46 H PHE 46 3.913 -8.792 -10.852 1069 HA PHE 46 HA PHE 46 6.780 -9.202 -10.917 1070 HB2 PHE 46 HB2 PHE 46 4.735 -8.996 -8.750 1071 HB3 PHE 46 HB3 PHE 46 6.266 -9.793 -8.401 1072 HD1 PHE 46 HD1 PHE 46 8.403 -8.441 -9.193 1073 HD2 PHE 46 HD2 PHE 46 4.582 -6.735 -8.382 1074 HE1 PHE 46 HE1 PHE 46 9.460 -6.250 -8.817 1075 HE2 PHE 46 HE2 PHE 46 5.638 -4.548 -8.008 1076 HZ PHE 46 HZ PHE 46 8.076 -4.304 -8.228 1077 H SER 47 H SER 47 3.981 -11.091 -11.256 1078 HA SER 47 HA SER 47 4.827 -13.527 -10.140 1079 HB2 SER 47 HB2 SER 47 3.206 -14.289 -12.196 1080 HB3 SER 47 HB3 SER 47 2.619 -13.714 -10.633 1081 HG SER 47 HG SER 47 2.476 -12.537 -13.094 1082 H GLU 48 H GLU 48 5.623 -11.934 -13.123 1083 HA GLU 48 HA GLU 48 6.657 -14.239 -14.460 1084 HB2 GLU 48 HB2 GLU 48 5.877 -12.146 -15.603 1085 HB3 GLU 48 HB3 GLU 48 7.310 -11.335 -14.985 1086 HG2 GLU 48 HG2 GLU 48 8.727 -12.906 -16.215 1087 HG3 GLU 48 HG3 GLU 48 7.286 -13.705 -16.843 1088 H LYS 49 H LYS 49 7.812 -12.207 -11.988 1089 HA LYS 49 HA LYS 49 10.625 -12.730 -12.541 1090 HB2 LYS 49 HB2 LYS 49 9.568 -11.412 -10.046 1091 HB3 LYS 49 HB3 LYS 49 11.140 -11.213 -10.801 1092 HG2 LYS 49 HG2 LYS 49 8.513 -10.156 -11.834 1093 HG3 LYS 49 HG3 LYS 49 9.805 -9.220 -11.092 1094 HD2 LYS 49 HD2 LYS 49 10.245 -10.842 -13.581 1095 HD3 LYS 49 HD3 LYS 49 9.627 -9.192 -13.642 1096 HE2 LYS 49 HE2 LYS 49 11.645 -8.517 -12.287 1097 HE3 LYS 49 HE3 LYS 49 12.275 -10.140 -12.566 1098 HZ1 LYS 49 HZ1 LYS 49 13.139 -8.558 -14.174 1099 HZ2 LYS 49 HZ2 LYS 49 11.569 -8.174 -14.676 1100 HZ3 LYS 49 HZ3 LYS 49 12.185 -9.726 -14.943 1101 H GLN 50 H GLN 50 8.307 -13.295 -9.920 1102 HA GLN 50 HA GLN 50 8.266 -14.762 -8.181 1103 HB2 GLN 50 HB2 GLN 50 8.657 -16.247 -10.670 1104 HB3 GLN 50 HB3 GLN 50 9.096 -17.153 -9.230 1105 HG2 GLN 50 HG2 GLN 50 6.934 -17.003 -8.339 1106 HG3 GLN 50 HG3 GLN 50 6.469 -15.730 -9.467 1107 HE21 GLN 50 HE21 GLN 50 5.171 -18.281 -8.929 1108 HE22 GLN 50 HE22 GLN 50 5.135 -19.133 -10.433 1109 HA PRO 51 HA PRO 51 12.869 -14.449 -7.373 1110 HB2 PRO 51 HB2 PRO 51 12.505 -13.435 -4.837 1111 HB3 PRO 51 HB3 PRO 51 12.727 -12.450 -6.286 1112 HG2 PRO 51 HG2 PRO 51 10.201 -13.190 -4.867 1113 HG3 PRO 51 HG3 PRO 51 10.666 -11.642 -5.595 1114 HD2 PRO 51 HD2 PRO 51 8.978 -13.328 -6.828 1115 HD3 PRO 51 HD3 PRO 51 10.143 -12.346 -7.739 1116 H MET 52 H MET 52 10.270 -15.405 -5.140 1117 HA MET 52 HA MET 52 12.000 -17.571 -4.152 1118 HB2 MET 52 HB2 MET 52 9.507 -16.399 -2.906 1119 HB3 MET 52 HB3 MET 52 10.489 -17.680 -2.212 1120 HG2 MET 52 HG2 MET 52 11.384 -14.853 -2.722 1121 HG3 MET 52 HG3 MET 52 10.937 -15.536 -1.161 1122 HE1 MET 52 HE1 MET 52 13.552 -14.101 -1.118 1123 HE2 MET 52 HE2 MET 52 14.690 -15.283 -0.471 1124 HE3 MET 52 HE3 MET 52 13.066 -15.163 0.207 1125 H LEU 53 H LEU 53 9.745 -17.089 -6.413 1126 HA LEU 53 HA LEU 53 8.121 -18.284 -7.460 1127 HB2 LEU 53 HB2 LEU 53 10.040 -20.407 -6.543 1128 HB3 LEU 53 HB3 LEU 53 8.640 -20.797 -7.525 1129 HG LEU 53 HG LEU 53 10.389 -18.627 -8.529 1130 HD11 LEU 53 HD11 LEU 53 11.206 -21.521 -8.633 1131 HD12 LEU 53 HD12 LEU 53 12.026 -20.246 -7.733 1132 HD13 LEU 53 HD13 LEU 53 11.976 -20.191 -9.494 1133 HD21 LEU 53 HD21 LEU 53 8.387 -19.358 -9.734 1134 HD22 LEU 53 HD22 LEU 53 9.047 -20.991 -9.835 1135 HD23 LEU 53 HD23 LEU 53 9.855 -19.661 -10.664 1136 H ASP 54 H ASP 54 7.256 -17.463 -5.048 1137 HA ASP 54 HA ASP 54 5.434 -19.605 -4.267 1138 HB2 ASP 54 HB2 ASP 54 7.463 -19.395 -2.679 1139 HB3 ASP 54 HB3 ASP 54 6.735 -17.876 -2.172 1140 H VAL 55 H VAL 55 3.392 -18.884 -3.909 1141 HA VAL 55 HA VAL 55 2.600 -16.389 -4.868 1142 HB VAL 55 HB VAL 55 0.962 -18.104 -3.007 1143 HG11 VAL 55 HG11 VAL 55 -0.942 -17.127 -4.125 1144 HG12 VAL 55 HG12 VAL 55 0.114 -16.225 -5.211 1145 HG13 VAL 55 HG13 VAL 55 0.087 -15.844 -3.489 1146 HG21 VAL 55 HG21 VAL 55 0.107 -19.185 -5.055 1147 HG22 VAL 55 HG22 VAL 55 1.821 -19.499 -4.787 1148 HG23 VAL 55 HG23 VAL 55 1.320 -18.317 -5.995 1149 HA PRO 56 HA PRO 56 1.756 -14.978 -0.248 1150 HB2 PRO 56 HB2 PRO 56 3.529 -16.121 1.550 1151 HB3 PRO 56 HB3 PRO 56 1.833 -16.581 1.358 1152 HG2 PRO 56 HG2 PRO 56 4.287 -17.864 0.244 1153 HG3 PRO 56 HG3 PRO 56 2.815 -18.620 0.879 1154 HD2 PRO 56 HD2 PRO 56 3.275 -18.438 -1.753 1155 HD3 PRO 56 HD3 PRO 56 1.637 -18.264 -1.087 1156 H LYS 57 H LYS 57 4.952 -15.907 -1.376 1157 HA LYS 57 HA LYS 57 6.288 -13.717 -0.081 1158 HB2 LYS 57 HB2 LYS 57 7.094 -15.828 -2.042 1159 HB3 LYS 57 HB3 LYS 57 8.141 -14.439 -1.798 1160 HG2 LYS 57 HG2 LYS 57 8.881 -16.267 -0.417 1161 HG3 LYS 57 HG3 LYS 57 8.258 -14.973 0.606 1162 HD2 LYS 57 HD2 LYS 57 6.304 -16.161 1.116 1163 HD3 LYS 57 HD3 LYS 57 6.523 -17.271 -0.239 1164 HE2 LYS 57 HE2 LYS 57 8.582 -18.121 0.916 1165 HE3 LYS 57 HE3 LYS 57 8.124 -17.148 2.313 1166 HZ1 LYS 57 HZ1 LYS 57 6.145 -18.399 2.578 1167 HZ2 LYS 57 HZ2 LYS 57 7.396 -19.522 2.394 1168 HZ3 LYS 57 HZ3 LYS 57 6.354 -19.199 1.097 1169 H LEU 58 H LEU 58 4.431 -14.054 -2.890 1170 HA LEU 58 HA LEU 58 5.684 -11.818 -4.276 1171 HB2 LEU 58 HB2 LEU 58 4.670 -13.975 -5.337 1172 HB3 LEU 58 HB3 LEU 58 3.135 -13.157 -5.121 1173 HG LEU 58 HG LEU 58 4.394 -11.202 -6.398 1174 HD11 LEU 58 HD11 LEU 58 5.811 -13.688 -7.336 1175 HD12 LEU 58 HD12 LEU 58 6.541 -12.317 -6.502 1176 HD13 LEU 58 HD13 LEU 58 5.879 -12.113 -8.123 1177 HD21 LEU 58 HD21 LEU 58 3.455 -12.068 -8.490 1178 HD22 LEU 58 HD22 LEU 58 2.338 -12.265 -7.140 1179 HD23 LEU 58 HD23 LEU 58 3.251 -13.650 -7.738 1180 H ALA 59 H ALA 59 2.641 -12.665 -2.710 1181 HA ALA 59 HA ALA 59 1.282 -10.254 -3.195 1182 HB1 ALA 59 HB1 ALA 59 0.928 -12.292 -1.004 1183 HB2 ALA 59 HB2 ALA 59 0.075 -12.218 -2.546 1184 HB3 ALA 59 HB3 ALA 59 -0.193 -10.969 -1.332 1185 H VAL 60 H VAL 60 3.563 -11.160 -0.685 1186 HA VAL 60 HA VAL 60 3.023 -8.807 0.893 1187 HB VAL 60 HB VAL 60 3.838 -10.970 1.889 1188 HG11 VAL 60 HG11 VAL 60 6.282 -11.372 1.861 1189 HG12 VAL 60 HG12 VAL 60 6.439 -10.131 0.619 1190 HG13 VAL 60 HG13 VAL 60 5.518 -11.599 0.287 1191 HG21 VAL 60 HG21 VAL 60 5.316 -9.896 3.524 1192 HG22 VAL 60 HG22 VAL 60 3.917 -8.891 3.144 1193 HG23 VAL 60 HG23 VAL 60 5.492 -8.510 2.448 1194 H LEU 61 H LEU 61 5.102 -9.697 -1.712 1195 HA LEU 61 HA LEU 61 7.094 -7.710 -1.381 1196 HB2 LEU 61 HB2 LEU 61 7.293 -9.774 -2.777 1197 HB3 LEU 61 HB3 LEU 61 6.192 -9.051 -3.930 1198 HG LEU 61 HG LEU 61 7.904 -7.149 -4.110 1199 HD11 LEU 61 HD11 LEU 61 9.215 -7.669 -2.138 1200 HD12 LEU 61 HD12 LEU 61 10.217 -7.807 -3.583 1201 HD13 LEU 61 HD13 LEU 61 9.606 -9.260 -2.792 1202 HD21 LEU 61 HD21 LEU 61 8.545 -9.928 -5.086 1203 HD22 LEU 61 HD22 LEU 61 9.263 -8.445 -5.714 1204 HD23 LEU 61 HD23 LEU 61 7.531 -8.731 -5.895 1205 H THR 62 H THR 62 4.080 -7.864 -3.212 1206 HA THR 62 HA THR 62 4.349 -5.324 -4.446 1207 HB THR 62 HB THR 62 1.823 -5.601 -4.764 1208 HG1 THR 62 HG1 THR 62 0.995 -7.092 -3.499 1209 HG21 THR 62 HG21 THR 62 3.249 -6.193 -6.557 1210 HG22 THR 62 HG22 THR 62 2.176 -7.570 -6.327 1211 HG23 THR 62 HG23 THR 62 3.829 -7.631 -5.721 1212 H ALA 63 H ALA 63 2.955 -6.450 -1.433 1213 HA ALA 63 HA ALA 63 1.507 -4.151 -0.724 1214 HB1 ALA 63 HB1 ALA 63 1.323 -6.402 0.340 1215 HB2 ALA 63 HB2 ALA 63 1.435 -5.062 1.483 1216 HB3 ALA 63 HB3 ALA 63 2.845 -6.075 1.168 1217 H VAL 64 H VAL 64 4.824 -5.141 0.123 1218 HA VAL 64 HA VAL 64 5.318 -2.796 1.652 1219 HB VAL 64 HB VAL 64 6.496 -4.993 1.929 1220 HG11 VAL 64 HG11 VAL 64 7.029 -5.521 -0.347 1221 HG12 VAL 64 HG12 VAL 64 8.524 -5.365 0.572 1222 HG13 VAL 64 HG13 VAL 64 8.009 -4.064 -0.501 1223 HG21 VAL 64 HG21 VAL 64 8.684 -3.934 2.472 1224 HG22 VAL 64 HG22 VAL 64 7.277 -3.084 3.110 1225 HG23 VAL 64 HG23 VAL 64 8.106 -2.465 1.680 1226 H GLN 65 H GLN 65 5.787 -3.605 -1.731 1227 HA GLN 65 HA GLN 65 7.448 -1.325 -2.261 1228 HB2 GLN 65 HB2 GLN 65 6.545 -3.614 -3.752 1229 HB3 GLN 65 HB3 GLN 65 6.226 -2.150 -4.678 1230 HG2 GLN 65 HG2 GLN 65 8.915 -2.721 -3.444 1231 HG3 GLN 65 HG3 GLN 65 8.476 -3.263 -5.066 1232 HE21 GLN 65 HE21 GLN 65 9.120 -0.493 -3.039 1233 HE22 GLN 65 HE22 GLN 65 9.347 0.640 -4.322 1234 H ILE 66 H ILE 66 4.014 -2.042 -2.470 1235 HA ILE 66 HA ILE 66 3.330 0.399 -3.772 1236 HB ILE 66 HB ILE 66 1.987 -1.915 -3.360 1237 HG12 ILE 66 HG12 ILE 66 -0.088 -0.539 -4.049 1238 HG13 ILE 66 HG13 ILE 66 1.000 0.845 -4.016 1239 HG21 ILE 66 HG21 ILE 66 0.016 -1.417 -1.945 1240 HG22 ILE 66 HG22 ILE 66 0.841 0.032 -1.368 1241 HG23 ILE 66 HG23 ILE 66 1.518 -1.561 -1.032 1242 HD11 ILE 66 HD11 ILE 66 0.699 -0.145 -6.258 1243 HD12 ILE 66 HD12 ILE 66 1.453 -1.626 -5.664 1244 HD13 ILE 66 HD13 ILE 66 2.377 -0.126 -5.715 1245 H ALA 67 H ALA 67 3.999 -0.508 -0.524 1246 HA ALA 67 HA ALA 67 2.675 1.796 0.627 1247 HB1 ALA 67 HB1 ALA 67 3.482 0.934 2.767 1248 HB2 ALA 67 HB2 ALA 67 4.409 -0.304 1.917 1249 HB3 ALA 67 HB3 ALA 67 2.649 -0.312 1.837 1250 H SER 68 H SER 68 5.975 0.822 -0.195 1251 HA SER 68 HA SER 68 7.304 2.798 1.299 1252 HB2 SER 68 HB2 SER 68 9.191 2.420 -0.327 1253 HB3 SER 68 HB3 SER 68 8.581 0.960 0.451 1254 HG SER 68 HG SER 68 8.462 1.758 -2.212 1255 H GLU 69 H GLU 69 6.383 2.791 -2.112 1256 HA GLU 69 HA GLU 69 7.284 5.421 -2.617 1257 HB2 GLU 69 HB2 GLU 69 5.154 3.943 -4.167 1258 HB3 GLU 69 HB3 GLU 69 6.195 5.231 -4.749 1259 HG2 GLU 69 HG2 GLU 69 6.888 2.369 -4.194 1260 HG3 GLU 69 HG3 GLU 69 7.070 3.284 -5.685 1261 H TYR 70 H TYR 70 4.219 4.107 -1.521 1262 HA TYR 70 HA TYR 70 2.825 6.595 -1.914 1263 HB2 TYR 70 HB2 TYR 70 2.093 3.880 -0.976 1264 HB3 TYR 70 HB3 TYR 70 1.099 5.217 -0.405 1265 HD1 TYR 70 HD2 TYR 70 2.770 5.210 -3.683 1266 HD2 TYR 70 HD1 TYR 70 -0.892 4.584 -1.615 1267 HE1 TYR 70 HE2 TYR 70 1.563 5.247 -5.822 1268 HE2 TYR 70 HE1 TYR 70 -2.105 4.625 -3.751 1269 HH TYR 70 HH TYR 70 -0.600 4.382 -6.736 1270 H LEU 71 H LEU 71 4.564 5.093 0.698 1271 HA LEU 71 HA LEU 71 3.442 6.730 2.758 1272 HB2 LEU 71 HB2 LEU 71 5.356 4.614 2.627 1273 HB3 LEU 71 HB3 LEU 71 6.098 5.967 3.458 1274 HG LEU 71 HG LEU 71 3.420 4.806 4.242 1275 HD11 LEU 71 HD11 LEU 71 6.145 4.193 5.376 1276 HD12 LEU 71 HD12 LEU 71 5.051 3.069 4.562 1277 HD13 LEU 71 HD13 LEU 71 4.609 3.755 6.124 1278 HD21 LEU 71 HD21 LEU 71 3.668 6.054 6.262 1279 HD22 LEU 71 HD22 LEU 71 3.922 7.159 4.911 1280 HD23 LEU 71 HD23 LEU 71 5.302 6.549 5.822 1281 H LYS 72 H LYS 72 5.825 7.148 0.334 1282 HA LYS 72 HA LYS 72 7.078 9.427 1.574 1283 HB2 LYS 72 HB2 LYS 72 7.360 7.959 -0.997 1284 HB3 LYS 72 HB3 LYS 72 7.884 9.634 -0.962 1285 HG2 LYS 72 HG2 LYS 72 8.804 7.584 1.025 1286 HG3 LYS 72 HG3 LYS 72 9.645 7.912 -0.487 1287 HD2 LYS 72 HD2 LYS 72 9.280 9.713 1.893 1288 HD3 LYS 72 HD3 LYS 72 10.773 9.247 1.079 1289 HE2 LYS 72 HE2 LYS 72 9.889 10.513 -0.941 1290 HE3 LYS 72 HE3 LYS 72 8.660 11.174 0.134 1291 HZ1 LYS 72 HZ1 LYS 72 11.597 11.470 0.461 1292 HZ2 LYS 72 HZ2 LYS 72 10.435 12.089 1.523 1293 HZ3 LYS 72 HZ3 LYS 72 10.532 12.670 -0.067 1294 H LEU 73 H LEU 73 4.280 8.840 -0.265 1295 HA LEU 73 HA LEU 73 4.040 11.321 -1.595 1296 HB2 LEU 73 HB2 LEU 73 2.748 9.117 -1.976 1297 HB3 LEU 73 HB3 LEU 73 1.721 9.637 -0.659 1298 HG LEU 73 HG LEU 73 0.824 10.055 -2.964 1299 HD11 LEU 73 HD11 LEU 73 1.189 12.511 -1.267 1300 HD12 LEU 73 HD12 LEU 73 -0.020 11.253 -1.010 1301 HD13 LEU 73 HD13 LEU 73 -0.070 12.239 -2.470 1302 HD21 LEU 73 HD21 LEU 73 1.675 11.700 -4.369 1303 HD22 LEU 73 HD22 LEU 73 3.099 10.798 -3.852 1304 HD23 LEU 73 HD23 LEU 73 2.727 12.362 -3.120 1305 H LYS 74 H LYS 74 2.798 10.117 1.509 1306 HA LYS 74 HA LYS 74 1.517 12.553 2.204 1307 HB2 LYS 74 HB2 LYS 74 1.255 11.619 4.429 1308 HB3 LYS 74 HB3 LYS 74 0.893 10.395 3.223 1309 HG2 LYS 74 HG2 LYS 74 2.881 9.228 3.648 1310 HG3 LYS 74 HG3 LYS 74 3.585 10.587 4.524 1311 HD2 LYS 74 HD2 LYS 74 2.932 8.982 6.155 1312 HD3 LYS 74 HD3 LYS 74 1.759 10.298 6.234 1313 HE2 LYS 74 HE2 LYS 74 0.197 8.990 4.895 1314 HE3 LYS 74 HE3 LYS 74 1.373 7.684 4.777 1315 HZ1 LYS 74 HZ1 LYS 74 1.280 7.688 7.310 1316 HZ2 LYS 74 HZ2 LYS 74 -0.050 7.050 6.484 1317 HZ3 LYS 74 HZ3 LYS 74 -0.134 8.603 7.147 1318 H GLU 75 H GLU 75 4.770 11.366 2.513 1319 HA GLU 75 HA GLU 75 5.677 13.206 4.469 1320 HB2 GLU 75 HB2 GLU 75 6.840 11.074 3.662 1321 HB3 GLU 75 HB3 GLU 75 7.356 12.009 2.265 1322 HG2 GLU 75 HG2 GLU 75 8.380 13.637 3.903 1323 HG3 GLU 75 HG3 GLU 75 8.089 12.422 5.146 1324 H GLU 76 H GLU 76 5.659 13.179 0.942 1325 HA GLU 76 HA GLU 76 6.914 15.658 0.512 1326 HB2 GLU 76 HB2 GLU 76 6.577 13.942 -1.235 1327 HB3 GLU 76 HB3 GLU 76 4.846 14.223 -1.174 1328 HG2 GLU 76 HG2 GLU 76 5.703 15.330 -3.086 1329 HG3 GLU 76 HG3 GLU 76 5.268 16.564 -1.905 1330 H TYR 77 H TYR 77 3.556 14.721 0.928 1331 HA TYR 77 HA TYR 77 2.296 17.147 0.416 1332 HB2 TYR 77 HB2 TYR 77 1.030 15.110 0.604 1333 HB3 TYR 77 HB3 TYR 77 1.545 14.885 2.270 1334 HD1 TYR 77 HD2 TYR 77 -0.176 17.497 0.209 1335 HD2 TYR 77 HD1 TYR 77 -0.025 15.377 3.896 1336 HE1 TYR 77 HE2 TYR 77 -2.189 18.688 0.967 1337 HE2 TYR 77 HE1 TYR 77 -2.039 16.560 4.665 1338 HH TYR 77 HH TYR 77 -4.135 18.016 2.822 1339 H GLN 78 H GLN 78 3.213 15.811 3.597 1340 HA GLN 78 HA GLN 78 2.491 18.073 5.086 1341 HB2 GLN 78 HB2 GLN 78 4.619 16.021 5.725 1342 HB3 GLN 78 HB3 GLN 78 3.903 17.144 6.872 1343 HG2 GLN 78 HG2 GLN 78 1.680 16.082 6.358 1344 HG3 GLN 78 HG3 GLN 78 2.569 14.847 5.468 1345 HE21 GLN 78 HE21 GLN 78 0.907 14.455 7.747 1346 HE22 GLN 78 HE22 GLN 78 1.899 13.809 9.009 1347 H ARG 79 H ARG 79 5.503 17.205 3.504 1348 HA ARG 79 HA ARG 79 7.184 19.132 4.610 1349 HB2 ARG 79 HB2 ARG 79 7.898 17.190 3.226 1350 HB3 ARG 79 HB3 ARG 79 7.287 18.018 1.801 1351 HG2 ARG 79 HG2 ARG 79 9.666 18.298 1.918 1352 HG3 ARG 79 HG3 ARG 79 8.888 19.851 2.225 1353 HD2 ARG 79 HD2 ARG 79 9.330 18.318 4.656 1354 HD3 ARG 79 HD3 ARG 79 10.827 18.653 3.788 1355 HE ARG 79 HE ARG 79 9.101 20.568 5.115 1356 HH11 ARG 79 HH11 ARG 79 11.708 20.088 2.818 1357 HH12 ARG 79 HH12 ARG 79 12.298 21.711 2.965 1358 HH21 ARG 79 HH21 ARG 79 9.878 22.681 5.322 1359 HH22 ARG 79 HH22 ARG 79 11.257 23.193 4.396 1360 H LEU 80 H LEU 80 5.343 19.323 1.539 1361 HA LEU 80 HA LEU 80 6.170 22.015 1.061 1362 HB2 LEU 80 HB2 LEU 80 4.811 21.972 -0.858 1363 HB3 LEU 80 HB3 LEU 80 5.495 20.368 -0.701 1364 HG LEU 80 HG LEU 80 3.087 20.143 0.638 1365 HD11 LEU 80 HD11 LEU 80 2.599 21.750 -1.869 1366 HD12 LEU 80 HD12 LEU 80 2.428 22.365 -0.225 1367 HD13 LEU 80 HD13 LEU 80 1.384 21.064 -0.790 1368 HD21 LEU 80 HD21 LEU 80 4.012 18.463 -0.828 1369 HD22 LEU 80 HD22 LEU 80 3.741 19.496 -2.234 1370 HD23 LEU 80 HD23 LEU 80 2.368 18.855 -1.333 1371 H ARG 81 H ARG 81 3.545 20.607 2.832 1372 HA ARG 81 HA ARG 81 1.949 22.999 2.759 1373 HB2 ARG 81 HB2 ARG 81 1.703 20.443 4.331 1374 HB3 ARG 81 HB3 ARG 81 0.577 21.785 4.497 1375 HG2 ARG 81 HG2 ARG 81 1.111 20.789 1.762 1376 HG3 ARG 81 HG3 ARG 81 0.154 19.765 2.828 1377 HD2 ARG 81 HD2 ARG 81 -1.076 21.439 1.323 1378 HD3 ARG 81 HD3 ARG 81 -1.552 21.335 3.011 1379 HE ARG 81 HE ARG 81 0.232 23.449 1.982 1380 HH11 ARG 81 HH11 ARG 81 -2.465 22.427 3.975 1381 HH12 ARG 81 HH12 ARG 81 -2.823 24.028 4.533 1382 HH21 ARG 81 HH21 ARG 81 -0.224 25.564 2.758 1383 HH22 ARG 81 HH22 ARG 81 -1.557 25.809 3.840 1384 H GLU 82 H GLU 82 4.207 21.529 5.065 1385 HA GLU 82 HA GLU 82 3.605 23.434 7.104 1386 HB2 GLU 82 HB2 GLU 82 5.433 22.498 8.344 1387 HB3 GLU 82 HB3 GLU 82 4.551 21.185 7.581 1388 HG2 GLU 82 HG2 GLU 82 6.622 20.483 7.074 1389 HG3 GLU 82 HG3 GLU 82 6.424 21.586 5.716 1390 H GLN 83 H GLN 83 5.882 23.300 4.452 1391 HA GLN 83 HA GLN 83 7.409 25.554 5.366 1392 HB2 GLN 83 HB2 GLN 83 8.612 25.405 3.293 1393 HB3 GLN 83 HB3 GLN 83 8.357 23.774 3.900 1394 HG2 GLN 83 HG2 GLN 83 6.428 23.563 2.351 1395 HG3 GLN 83 HG3 GLN 83 6.859 25.133 1.677 1396 HE21 GLN 83 HE21 GLN 83 7.178 24.161 -0.356 1397 HE22 GLN 83 HE22 GLN 83 8.601 23.240 -0.699 1398 H LEU 84 H LEU 84 4.355 25.397 4.389 1399 HA LEU 84 HA LEU 84 4.395 27.837 2.777 1400 HB2 LEU 84 HB2 LEU 84 2.762 25.520 2.821 1401 HB3 LEU 84 HB3 LEU 84 1.749 26.853 3.328 1402 HG LEU 84 HG LEU 84 1.524 26.486 0.949 1403 HD11 LEU 84 HD11 LEU 84 3.044 29.019 1.547 1404 HD12 LEU 84 HD12 LEU 84 1.303 28.772 1.676 1405 HD13 LEU 84 HD13 LEU 84 2.086 28.720 0.098 1406 HD21 LEU 84 HD21 LEU 84 3.575 27.079 -0.495 1407 HD22 LEU 84 HD22 LEU 84 3.459 25.469 0.207 1408 HD23 LEU 84 HD23 LEU 84 4.508 26.677 0.945 1409 H LYS 85 H LYS 85 4.525 27.116 5.906 1410 HA LYS 85 HA LYS 85 2.521 29.009 6.848 1411 HB2 LYS 85 HB2 LYS 85 4.514 27.326 8.375 1412 HB3 LYS 85 HB3 LYS 85 3.279 28.343 9.104 1413 HG2 LYS 85 HG2 LYS 85 1.585 26.958 7.829 1414 HG3 LYS 85 HG3 LYS 85 2.903 25.844 7.478 1415 HD2 LYS 85 HD2 LYS 85 2.318 26.679 10.294 1416 HD3 LYS 85 HD3 LYS 85 1.380 25.401 9.527 1417 HE2 LYS 85 HE2 LYS 85 3.104 24.304 10.689 1418 HE3 LYS 85 HE3 LYS 85 3.591 24.284 8.997 1419 HZ1 LYS 85 HZ1 LYS 85 5.282 24.942 10.811 1420 HZ2 LYS 85 HZ2 LYS 85 4.524 26.450 10.757 1421 HZ3 LYS 85 HZ3 LYS 85 5.247 25.814 9.366 1422 H LYS 86 H LYS 86 5.967 28.754 6.385 1423 HA LYS 86 HA LYS 86 6.262 31.527 7.318 1424 HB2 LYS 86 HB2 LYS 86 7.990 29.129 7.757 1425 HB3 LYS 86 HB3 LYS 86 8.757 30.703 7.621 1426 HG2 LYS 86 HG2 LYS 86 6.493 30.242 9.526 1427 HG3 LYS 86 HG3 LYS 86 8.157 29.832 9.952 1428 HD2 LYS 86 HD2 LYS 86 8.847 32.129 9.572 1429 HD3 LYS 86 HD3 LYS 86 7.218 32.555 9.045 1430 HE2 LYS 86 HE2 LYS 86 7.528 33.278 11.321 1431 HE3 LYS 86 HE3 LYS 86 6.378 31.945 11.289 1432 HZ1 LYS 86 HZ1 LYS 86 7.983 31.721 13.088 1433 HZ2 LYS 86 HZ2 LYS 86 9.254 31.698 11.975 1434 HZ3 LYS 86 HZ3 LYS 86 8.121 30.447 11.987
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