NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
590501 | 2n1r | 25573 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H21 MYR 1 1H2 MYR 1 -6.356 12.599 -2.691 2 H22 MYR 1 2H2 MYR 1 -5.081 12.233 -3.837 3 H31 MYR 1 1H3 MYR 1 -6.785 10.032 -2.458 4 H32 MYR 1 2H3 MYR 1 -5.292 10.656 -1.755 5 H41 MYR 1 1H4 MYR 1 -4.549 10.050 -4.444 6 H42 MYR 1 2H4 MYR 1 -5.666 8.748 -4.029 7 H51 MYR 1 1H5 MYR 1 -4.046 8.971 -1.696 8 H52 MYR 1 2H5 MYR 1 -2.905 9.283 -3.005 9 H61 MYR 1 1H6 MYR 1 -3.696 7.139 -4.166 10 H62 MYR 1 2H6 MYR 1 -4.766 6.818 -2.799 11 H71 MYR 1 1H7 MYR 1 -2.969 5.620 -1.970 12 H72 MYR 1 2H7 MYR 1 -2.398 7.196 -1.417 13 H81 MYR 1 1H8 MYR 1 -0.484 6.637 -2.597 14 H82 MYR 1 2H8 MYR 1 -1.382 7.268 -3.980 15 H91 MYR 1 1H9 MYR 1 -1.391 5.215 -4.987 16 H92 MYR 1 2H9 MYR 1 -2.192 4.480 -3.598 17 H101 MYR 1 1H10 MYR 1 0.838 5.034 -3.632 18 H102 MYR 1 2H10 MYR 1 0.179 3.540 -4.280 19 H111 MYR 1 1H11 MYR 1 -1.030 3.496 -1.793 20 H112 MYR 1 2H11 MYR 1 0.340 4.526 -1.410 21 H121 MYR 1 1H12 MYR 1 1.954 2.773 -2.234 22 H122 MYR 1 2H12 MYR 1 0.610 1.717 -2.667 23 H131 MYR 1 1H13 MYR 1 0.000 2.318 0.018 24 H132 MYR 1 2H13 MYR 1 1.764 2.318 0.049 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 -7.929 13.535 -3.938 29 HA2 GLY 2 2HA GLY 2 -8.680 13.442 -6.434 30 HA3 GLY 2 3HA GLY 2 -9.157 11.814 -5.974 31 H ASN 3 H ASN 3 -11.088 11.505 -5.021 32 HA ASN 3 HA ASN 3 -12.690 13.908 -4.475 33 HB2 ASN 3 2HB ASN 3 -13.421 11.113 -5.323 34 HB3 ASN 3 3HB ASN 3 -14.620 12.196 -4.621 35 HD21 ASN 3 1HD2 ASN 3 -14.646 11.095 -7.245 36 HD22 ASN 3 2HD2 ASN 3 -14.572 12.414 -8.359 37 H GLY 4 H GLY 4 -11.853 14.205 -2.354 38 HA2 GLY 4 2HA GLY 4 -13.200 13.694 -0.197 39 HA3 GLY 4 3HA GLY 4 -12.506 12.094 -0.415 40 H ALA 5 H ALA 5 -11.019 11.845 1.122 41 HA ALA 5 HA ALA 5 -8.872 13.835 1.284 42 HB1 ALA 5 1HB ALA 5 -9.366 12.769 3.898 43 HB2 ALA 5 2HB ALA 5 -9.339 14.450 3.364 44 HB3 ALA 5 3HB ALA 5 -10.833 13.518 3.268 45 H SER 6 H SER 6 -9.788 10.797 2.919 46 HA SER 6 HA SER 6 -7.417 9.504 1.809 47 HB2 SER 6 2HB SER 6 -7.880 9.109 4.729 48 HB3 SER 6 3HB SER 6 -6.377 9.041 3.809 49 HG SER 6 HG SER 6 -6.099 10.963 4.628 50 H ARG 7 H ARG 7 -10.125 9.120 1.175 51 HA ARG 7 HA ARG 7 -11.334 7.002 2.586 52 HB2 ARG 7 2HB ARG 7 -11.674 8.206 -0.127 53 HB3 ARG 7 3HB ARG 7 -12.444 6.661 0.211 54 HG2 ARG 7 2HG ARG 7 -13.040 8.318 2.394 55 HG3 ARG 7 3HG ARG 7 -13.271 9.299 0.945 56 HD2 ARG 7 2HD ARG 7 -14.521 7.170 0.074 57 HD3 ARG 7 3HD ARG 7 -14.662 6.798 1.791 58 HE ARG 7 HE ARG 7 -16.196 8.488 2.001 59 HH11 ARG 7 1HH1 ARG 7 -14.554 8.793 -1.053 60 HH12 ARG 7 2HH1 ARG 7 -15.610 10.032 -1.645 61 HH21 ARG 7 1HH2 ARG 7 -17.593 10.120 1.233 62 HH22 ARG 7 2HH2 ARG 7 -17.337 10.787 -0.344 63 H ASP 8 H ASP 8 -9.379 7.006 -0.388 64 HA ASP 8 HA ASP 8 -9.406 4.262 -0.868 65 HB2 ASP 8 2HB ASP 8 -7.159 6.205 -1.446 66 HB3 ASP 8 3HB ASP 8 -7.392 4.635 -2.210 67 H TRP 9 H TRP 9 -7.454 6.173 1.325 68 HA TRP 9 HA TRP 9 -5.588 4.103 1.937 69 HB2 TRP 9 2HB TRP 9 -5.044 6.472 2.279 70 HB3 TRP 9 3HB TRP 9 -6.312 6.594 3.496 71 HD1 TRP 9 HD1 TRP 9 -5.821 5.539 5.896 72 HE1 TRP 9 HE1 TRP 9 -3.636 4.823 7.053 73 HE3 TRP 9 HE3 TRP 9 -2.738 5.438 1.819 74 HZ2 TRP 9 HZ2 TRP 9 -0.960 4.287 6.333 75 HZ3 TRP 9 HZ3 TRP 9 -0.379 4.815 2.139 76 HH2 TRP 9 HH2 TRP 9 0.490 4.252 4.350 77 H LYS 10 H LYS 10 -8.189 5.558 3.904 78 HA LYS 10 HA LYS 10 -8.148 3.767 6.003 79 HB2 LYS 10 2HB LYS 10 -9.612 5.937 5.469 80 HB3 LYS 10 3HB LYS 10 -10.811 4.713 5.073 81 HG2 LYS 10 2HG LYS 10 -11.198 4.254 7.214 82 HG3 LYS 10 3HG LYS 10 -9.477 4.190 7.600 83 HD2 LYS 10 2HD LYS 10 -10.545 6.879 7.062 84 HD3 LYS 10 3HD LYS 10 -11.180 6.093 8.510 85 HE2 LYS 10 2HE LYS 10 -9.252 6.345 9.612 86 HE3 LYS 10 3HE LYS 10 -8.299 5.791 8.236 87 HZ1 LYS 10 3HZ LYS 10 -9.165 8.254 7.475 88 HZ2 LYS 10 1HZ LYS 10 -7.628 7.892 8.083 89 HZ3 LYS 10 2HZ LYS 10 -8.835 8.461 9.121 90 H MET 11 H MET 11 -9.491 3.382 2.808 91 HA MET 11 HA MET 11 -11.063 1.075 3.408 92 HB2 MET 11 2HB MET 11 -11.151 2.753 1.372 93 HB3 MET 11 3HB MET 11 -10.024 1.607 0.657 94 HG2 MET 11 2HG MET 11 -11.967 0.724 -0.096 95 HG3 MET 11 3HG MET 11 -11.848 -0.131 1.440 96 HE1 MET 11 3HE MET 11 -14.138 -0.104 -0.181 97 HE2 MET 11 1HE MET 11 -15.536 0.349 0.794 98 HE3 MET 11 2HE MET 11 -14.950 1.436 -0.465 99 H ALA 12 H ALA 12 -7.960 1.515 1.706 100 HA ALA 12 HA ALA 12 -7.354 -1.140 1.234 101 HB1 ALA 12 1HB ALA 12 -4.932 -0.356 1.376 102 HB2 ALA 12 2HB ALA 12 -5.979 0.464 0.217 103 HB3 ALA 12 3HB ALA 12 -5.592 1.235 1.755 104 H ILE 13 H ILE 13 -7.157 0.677 4.205 105 HA ILE 13 HA ILE 13 -5.566 -1.278 5.591 106 HB ILE 13 HB ILE 13 -7.191 1.021 6.683 107 HG12 ILE 13 2HG1 ILE 13 -5.365 1.698 5.154 108 HG13 ILE 13 3HG1 ILE 13 -5.071 2.212 6.811 109 HG21 ILE 13 1HG2 ILE 13 -6.819 0.119 8.679 110 HG22 ILE 13 2HG2 ILE 13 -5.809 -1.146 7.980 111 HG23 ILE 13 3HG2 ILE 13 -5.098 0.406 8.421 112 HD11 ILE 13 3HD1 ILE 13 -3.492 0.433 7.132 113 HD12 ILE 13 1HD1 ILE 13 -3.861 -0.230 5.540 114 HD13 ILE 13 2HD1 ILE 13 -3.065 1.339 5.681 115 H LYS 14 H LYS 14 -8.983 -0.300 5.641 116 HA LYS 14 HA LYS 14 -9.927 -1.998 7.601 117 HB2 LYS 14 2HB LYS 14 -11.052 -0.451 5.441 118 HB3 LYS 14 3HB LYS 14 -11.907 -1.980 5.605 119 HG2 LYS 14 2HG LYS 14 -11.533 -0.916 8.204 120 HG3 LYS 14 3HG LYS 14 -12.155 0.372 7.169 121 HD2 LYS 14 2HD LYS 14 -13.874 -1.365 6.380 122 HD3 LYS 14 3HD LYS 14 -13.382 -2.296 7.797 123 HE2 LYS 14 2HE LYS 14 -13.778 0.104 8.937 124 HE3 LYS 14 3HE LYS 14 -14.932 0.213 7.609 125 HZ1 LYS 14 3HZ LYS 14 -14.895 -2.211 9.265 126 HZ2 LYS 14 1HZ LYS 14 -16.184 -1.496 8.434 127 HZ3 LYS 14 2HZ LYS 14 -15.628 -0.816 9.879 128 H ARG 15 H ARG 15 -9.158 -2.701 4.247 129 HA ARG 15 HA ARG 15 -10.252 -5.364 4.344 130 HB2 ARG 15 2HB ARG 15 -9.265 -3.581 2.329 131 HB3 ARG 15 3HB ARG 15 -8.431 -5.122 2.188 132 HG2 ARG 15 2HG ARG 15 -10.760 -6.179 2.282 133 HG3 ARG 15 3HG ARG 15 -11.362 -4.550 1.964 134 HD2 ARG 15 2HD ARG 15 -10.149 -4.440 -0.101 135 HD3 ARG 15 3HD ARG 15 -9.327 -5.961 0.247 136 HE ARG 15 HE ARG 15 -11.172 -7.090 -0.503 137 HH11 ARG 15 1HH1 ARG 15 -12.019 -3.761 0.062 138 HH12 ARG 15 2HH1 ARG 15 -13.591 -3.903 -0.652 139 HH21 ARG 15 1HH2 ARG 15 -13.240 -7.290 -1.446 140 HH22 ARG 15 2HH2 ARG 15 -14.285 -5.912 -1.508 141 H CYS 16 H CYS 16 -6.984 -3.963 4.245 142 HA CYS 16 HA CYS 16 -5.520 -6.320 4.307 143 HB2 CYS 16 2HB CYS 16 -4.809 -3.770 4.156 144 HB3 CYS 16 3HB CYS 16 -4.544 -3.979 5.883 145 HG CYS 16 HG CYS 16 -2.072 -4.503 5.247 146 H SER 17 H SER 17 -7.307 -4.746 6.823 147 HA SER 17 HA SER 17 -6.057 -5.859 9.077 148 HB2 SER 17 2HB SER 17 -7.805 -4.980 10.295 149 HB3 SER 17 3HB SER 17 -7.970 -4.037 8.814 150 HG SER 17 HG SER 17 -9.943 -4.798 8.923 151 H ASN 18 H ASN 18 -7.998 -7.286 6.660 152 HA ASN 18 HA ASN 18 -8.723 -9.563 8.343 153 HB2 ASN 18 2HB ASN 18 -9.926 -8.297 6.112 154 HB3 ASN 18 3HB ASN 18 -9.472 -9.918 5.595 155 HD21 ASN 18 1HD2 ASN 18 -12.083 -8.559 6.243 156 HD22 ASN 18 2HD2 ASN 18 -12.866 -9.644 7.336 157 H VAL 19 H VAL 19 -5.939 -8.945 7.502 158 HA VAL 19 HA VAL 19 -5.359 -11.321 5.866 159 HB VAL 19 HB VAL 19 -3.548 -8.986 6.501 160 HG11 VAL 19 1HG1 VAL 19 -2.597 -10.299 4.260 161 HG12 VAL 19 2HG1 VAL 19 -1.928 -10.392 5.890 162 HG13 VAL 19 3HG1 VAL 19 -3.084 -11.605 5.341 163 HG21 VAL 19 3HG2 VAL 19 -3.946 -8.197 4.291 164 HG22 VAL 19 1HG2 VAL 19 -4.871 -9.640 3.875 165 HG23 VAL 19 2HG2 VAL 19 -5.522 -8.477 5.030 166 H ALA 20 H ALA 20 -4.002 -12.911 6.592 167 HA ALA 20 HA ALA 20 -3.531 -12.962 9.467 168 HB1 ALA 20 1HB ALA 20 -2.840 -15.234 7.661 169 HB2 ALA 20 2HB ALA 20 -3.439 -15.256 9.321 170 HB3 ALA 20 3HB ALA 20 -4.534 -14.870 7.993 171 H VAL 21 H VAL 21 -1.492 -13.508 10.382 172 HA VAL 21 HA VAL 21 0.733 -12.350 8.918 173 HB VAL 21 HB VAL 21 0.727 -13.441 11.733 174 HG11 VAL 21 1HG1 VAL 21 2.926 -13.108 11.510 175 HG12 VAL 21 2HG1 VAL 21 2.724 -12.185 10.020 176 HG13 VAL 21 3HG1 VAL 21 2.544 -11.389 11.583 177 HG21 VAL 21 3HG2 VAL 21 -0.799 -11.777 12.017 178 HG22 VAL 21 1HG2 VAL 21 0.673 -10.811 12.127 179 HG23 VAL 21 2HG2 VAL 21 -0.234 -10.867 10.616 180 H GLY 22 H GLY 22 0.043 -15.406 10.622 181 HA2 GLY 22 2HA GLY 22 2.402 -16.628 9.420 182 HA3 GLY 22 3HA GLY 22 1.354 -17.355 10.628 183 H VAL 23 H VAL 23 2.037 -19.011 8.721 184 HA VAL 23 HA VAL 23 -0.253 -19.062 6.863 185 HB VAL 23 HB VAL 23 1.908 -18.809 5.700 186 HG11 VAL 23 1HG1 VAL 23 2.794 -21.548 6.206 187 HG12 VAL 23 2HG1 VAL 23 3.724 -20.050 6.125 188 HG13 VAL 23 3HG1 VAL 23 2.894 -20.494 7.617 189 HG21 VAL 23 3HG2 VAL 23 1.511 -20.444 4.039 190 HG22 VAL 23 1HG2 VAL 23 0.813 -21.567 5.206 191 HG23 VAL 23 2HG2 VAL 23 -0.060 -20.100 4.763 192 H GLY 24 H GLY 24 1.689 -20.829 9.165 193 HA2 GLY 24 2HA GLY 24 0.091 -23.254 8.736 194 HA3 GLY 24 3HA GLY 24 1.573 -23.151 9.675 195 H GLY 25 H GLY 25 -0.866 -20.730 10.112 196 HA2 GLY 25 2HA GLY 25 -1.874 -22.103 12.507 197 HA3 GLY 25 3HA GLY 25 -1.161 -20.505 12.679 198 H LYS 26 H LYS 26 -2.130 -19.076 10.642 199 HA LYS 26 HA LYS 26 -3.925 -17.797 10.070 200 HB2 LYS 26 2HB LYS 26 -4.399 -19.784 8.701 201 HB3 LYS 26 3HB LYS 26 -5.303 -20.489 10.035 202 HG2 LYS 26 2HG LYS 26 -7.094 -19.592 9.063 203 HG3 LYS 26 3HG LYS 26 -6.523 -18.061 9.730 204 HD2 LYS 26 2HD LYS 26 -5.417 -17.505 7.683 205 HD3 LYS 26 3HD LYS 26 -5.716 -19.114 7.023 206 HE2 LYS 26 2HE LYS 26 -8.180 -18.608 7.239 207 HE3 LYS 26 3HE LYS 26 -7.723 -16.943 7.592 208 HZ1 LYS 26 3HZ LYS 26 -7.155 -16.553 5.462 209 HZ2 LYS 26 1HZ LYS 26 -8.214 -17.834 5.142 210 HZ3 LYS 26 2HZ LYS 26 -6.546 -18.111 5.205 211 H SER 27 H SER 27 -4.093 -16.672 12.033 212 HA SER 27 HA SER 27 -6.600 -16.976 13.365 213 HB2 SER 27 2HB SER 27 -5.157 -17.041 15.659 214 HB3 SER 27 3HB SER 27 -5.843 -18.476 14.897 215 HG SER 27 HG SER 27 -3.432 -18.308 15.474 216 H LYS 28 H LYS 28 -3.341 -15.650 13.951 217 HA LYS 28 HA LYS 28 -4.470 -13.156 14.898 218 HB2 LYS 28 2HB LYS 28 -2.119 -12.499 15.262 219 HB3 LYS 28 3HB LYS 28 -2.504 -14.037 16.023 220 HG2 LYS 28 2HG LYS 28 -1.580 -14.712 13.487 221 HG3 LYS 28 3HG LYS 28 -0.515 -13.414 14.034 222 HD2 LYS 28 2HD LYS 28 0.509 -15.356 14.831 223 HD3 LYS 28 3HD LYS 28 -0.367 -14.735 16.232 224 HE2 LYS 28 2HE LYS 28 -2.246 -16.280 15.617 225 HE3 LYS 28 3HE LYS 28 -1.181 -16.989 14.404 226 HZ1 LYS 28 3HZ LYS 28 -0.712 -18.368 16.110 227 HZ2 LYS 28 1HZ LYS 28 -1.122 -17.242 17.304 228 HZ3 LYS 28 2HZ LYS 28 0.380 -17.146 16.531 229 H LYS 29 H LYS 29 -4.851 -11.426 13.685 230 HA LYS 29 HA LYS 29 -3.707 -11.345 10.974 231 HB2 LYS 29 2HB LYS 29 -6.208 -10.023 12.042 232 HB3 LYS 29 3HB LYS 29 -5.615 -9.894 10.391 233 HG2 LYS 29 2HG LYS 29 -6.440 -11.890 9.807 234 HG3 LYS 29 3HG LYS 29 -5.967 -12.643 11.332 235 HD2 LYS 29 2HD LYS 29 -7.894 -11.677 12.441 236 HD3 LYS 29 3HD LYS 29 -8.342 -10.816 10.967 237 HE2 LYS 29 2HE LYS 29 -9.720 -12.630 10.795 238 HE3 LYS 29 3HE LYS 29 -8.304 -13.247 9.947 239 HZ1 LYS 29 3HZ LYS 29 -9.508 -14.546 11.924 240 HZ2 LYS 29 1HZ LYS 29 -8.358 -13.685 12.818 241 HZ3 LYS 29 2HZ LYS 29 -7.862 -14.718 11.574 242 H PHE 30 H PHE 30 -3.343 -9.128 10.094 243 HA PHE 30 HA PHE 30 -1.762 -7.617 11.969 244 HB2 PHE 30 2HB PHE 30 -2.331 -7.264 9.024 245 HB3 PHE 30 3HB PHE 30 -1.294 -6.180 9.945 246 HD1 PHE 30 HD2 PHE 30 0.596 -7.420 11.330 247 HD2 PHE 30 HD1 PHE 30 -1.346 -8.990 7.883 248 HE1 PHE 30 HE2 PHE 30 2.509 -8.916 10.937 249 HE2 PHE 30 HE1 PHE 30 0.563 -10.489 7.486 250 HZ PHE 30 HZ PHE 30 2.495 -10.453 9.013 251 H GLY 31 H GLY 31 -1.964 -5.043 11.380 252 HA2 GLY 31 2HA GLY 31 -4.740 -4.190 11.376 253 HA3 GLY 31 3HA GLY 31 -3.885 -3.946 12.892 254 H GLU 32 H GLU 32 -4.899 -1.767 11.695 255 HA GLU 32 HA GLU 32 -3.357 -0.455 9.790 256 HB2 GLU 32 2HB GLU 32 -4.409 1.565 10.498 257 HB3 GLU 32 3HB GLU 32 -5.591 0.277 10.680 258 HG2 GLU 32 2HG GLU 32 -5.919 1.174 12.698 259 HG3 GLU 32 3HG GLU 32 -4.466 0.278 13.138 260 H GLY 33 H GLY 33 -2.770 -0.992 13.174 261 HA2 GLY 33 2HA GLY 33 -0.819 1.040 13.552 262 HA3 GLY 33 3HA GLY 33 -1.045 -0.378 14.565 263 H ASN 34 H ASN 34 -0.609 -2.354 12.583 264 HA ASN 34 HA ASN 34 2.236 -2.453 12.635 265 HB2 ASN 34 2HB ASN 34 0.053 -4.219 11.628 266 HB3 ASN 34 3HB ASN 34 1.684 -4.492 11.022 267 HD21 ASN 34 1HD2 ASN 34 -0.008 -6.158 12.726 268 HD22 ASN 34 2HD2 ASN 34 0.902 -6.438 14.167 269 H PHE 35 H PHE 35 -0.164 -1.908 10.093 270 HA PHE 35 HA PHE 35 1.668 -1.819 7.942 271 HB2 PHE 35 2HB PHE 35 -0.970 -0.358 8.058 272 HB3 PHE 35 3HB PHE 35 -0.136 -0.969 6.633 273 HD1 PHE 35 HD1 PHE 35 0.571 -3.687 7.457 274 HD2 PHE 35 HD2 PHE 35 -3.001 -1.463 8.102 275 HE1 PHE 35 HE1 PHE 35 -0.704 -5.786 7.610 276 HE2 PHE 35 HE2 PHE 35 -4.281 -3.559 8.257 277 HZ PHE 35 HZ PHE 35 -3.133 -5.724 8.012 278 H ARG 36 H ARG 36 0.043 0.813 9.717 279 HA ARG 36 HA ARG 36 1.377 2.924 8.452 280 HB2 ARG 36 2HB ARG 36 0.523 4.323 10.167 281 HB3 ARG 36 3HB ARG 36 -0.679 3.063 9.921 282 HG2 ARG 36 2HG ARG 36 -0.621 3.023 12.177 283 HG3 ARG 36 3HG ARG 36 0.717 1.913 11.875 284 HD2 ARG 36 2HD ARG 36 2.317 3.483 12.423 285 HD3 ARG 36 3HD ARG 36 1.254 4.843 12.066 286 HE ARG 36 HE ARG 36 0.122 3.555 14.218 287 HH11 ARG 36 1HH1 ARG 36 3.163 5.094 13.507 288 HH12 ARG 36 2HH1 ARG 36 3.444 5.587 15.144 289 HH21 ARG 36 1HH2 ARG 36 0.481 4.199 16.377 290 HH22 ARG 36 2HH2 ARG 36 1.919 5.077 16.775 291 H TRP 37 H TRP 37 2.296 0.879 11.137 292 HA TRP 37 HA TRP 37 4.404 2.435 12.157 293 HB2 TRP 37 2HB TRP 37 3.558 0.599 13.454 294 HB3 TRP 37 3HB TRP 37 3.941 -0.551 12.175 295 HD1 TRP 37 HD1 TRP 37 5.576 1.455 14.988 296 HE1 TRP 37 HE1 TRP 37 7.931 0.510 15.414 297 HE3 TRP 37 HE3 TRP 37 5.878 -1.781 11.041 298 HZ2 TRP 37 HZ2 TRP 37 9.686 -1.360 14.233 299 HZ3 TRP 37 HZ3 TRP 37 7.929 -3.110 10.761 300 HH2 TRP 37 HH2 TRP 37 9.793 -2.902 12.324 301 H ALA 38 H ALA 38 4.500 -0.317 9.889 302 HA ALA 38 HA ALA 38 7.255 -0.133 9.338 303 HB1 ALA 38 1HB ALA 38 6.899 -1.723 7.656 304 HB2 ALA 38 2HB ALA 38 5.665 -2.073 8.867 305 HB3 ALA 38 3HB ALA 38 5.233 -1.203 7.395 306 H ILE 39 H ILE 39 4.441 1.048 7.501 307 HA ILE 39 HA ILE 39 5.806 2.215 5.383 308 HB ILE 39 HB ILE 39 3.246 3.181 6.662 309 HG12 ILE 39 2HG1 ILE 39 3.503 1.453 4.209 310 HG13 ILE 39 3HG1 ILE 39 3.421 0.751 5.821 311 HG21 ILE 39 1HG2 ILE 39 3.347 4.865 5.217 312 HG22 ILE 39 2HG2 ILE 39 4.813 4.213 4.486 313 HG23 ILE 39 3HG2 ILE 39 3.231 3.686 3.911 314 HD11 ILE 39 3HD1 ILE 39 1.235 0.696 4.978 315 HD12 ILE 39 1HD1 ILE 39 1.267 2.040 6.119 316 HD13 ILE 39 2HD1 ILE 39 1.334 2.353 4.385 317 H ARG 40 H ARG 40 4.617 3.840 8.330 318 HA ARG 40 HA ARG 40 5.667 6.350 7.871 319 HB2 ARG 40 2HB ARG 40 4.136 5.737 9.736 320 HB3 ARG 40 3HB ARG 40 5.491 4.973 10.555 321 HG2 ARG 40 2HG ARG 40 5.401 7.031 11.578 322 HG3 ARG 40 3HG ARG 40 6.615 7.297 10.326 323 HD2 ARG 40 2HD ARG 40 4.267 7.894 9.035 324 HD3 ARG 40 3HD ARG 40 3.974 8.491 10.667 325 HE ARG 40 HE ARG 40 5.812 9.562 8.730 326 HH11 ARG 40 1HH1 ARG 40 5.022 9.316 12.112 327 HH12 ARG 40 2HH1 ARG 40 5.864 10.766 12.547 328 HH21 ARG 40 1HH2 ARG 40 6.924 11.473 9.291 329 HH22 ARG 40 2HH2 ARG 40 6.945 11.993 10.942 330 H MET 41 H MET 41 7.197 3.734 9.756 331 HA MET 41 HA MET 41 9.600 4.972 10.313 332 HB2 MET 41 2HB MET 41 8.795 2.734 11.160 333 HB3 MET 41 3HB MET 41 9.318 2.045 9.629 334 HG2 MET 41 2HG MET 41 11.458 3.573 10.707 335 HG3 MET 41 3HG MET 41 10.835 2.507 11.964 336 HE1 MET 41 3HE MET 41 10.370 -0.457 10.963 337 HE2 MET 41 1HE MET 41 12.075 -0.819 11.236 338 HE3 MET 41 2HE MET 41 11.243 0.339 12.273 339 H ALA 42 H ALA 42 8.735 3.057 7.451 340 HA ALA 42 HA ALA 42 11.243 3.196 6.184 341 HB1 ALA 42 1HB ALA 42 10.003 2.611 4.125 342 HB2 ALA 42 2HB ALA 42 9.600 1.574 5.495 343 HB3 ALA 42 3HB ALA 42 8.491 2.854 5.001 344 H ASN 43 H ASN 43 8.362 5.252 5.918 345 HA ASN 43 HA ASN 43 9.202 6.926 3.871 346 HB2 ASN 43 2HB ASN 43 6.990 6.793 5.454 347 HB3 ASN 43 3HB ASN 43 7.749 8.261 6.064 348 HD21 ASN 43 1HD2 ASN 43 7.344 10.077 5.025 349 HD22 ASN 43 2HD2 ASN 43 6.699 10.206 3.427 350 H VAL 44 H VAL 44 10.006 6.965 7.288 351 HA VAL 44 HA VAL 44 11.284 9.508 7.282 352 HB VAL 44 HB VAL 44 11.751 7.213 9.190 353 HG11 VAL 44 1HG1 VAL 44 12.249 10.178 9.406 354 HG12 VAL 44 2HG1 VAL 44 12.337 9.055 10.764 355 HG13 VAL 44 3HG1 VAL 44 13.452 8.889 9.406 356 HG21 VAL 44 3HG2 VAL 44 9.688 7.512 9.955 357 HG22 VAL 44 1HG2 VAL 44 10.067 9.199 10.301 358 HG23 VAL 44 2HG2 VAL 44 9.397 8.749 8.733 359 H SER 45 H SER 45 12.695 6.241 7.577 360 HA SER 45 HA SER 45 15.347 6.981 7.224 361 HB2 SER 45 2HB SER 45 15.307 4.478 6.131 362 HB3 SER 45 3HB SER 45 15.344 4.807 7.863 363 HG SER 45 HG SER 45 13.025 4.368 6.283 364 H THR 46 H THR 46 12.822 6.475 4.872 365 HA THR 46 HA THR 46 14.749 7.067 2.720 366 HB THR 46 HB THR 46 13.418 5.842 1.172 367 HG1 THR 46 HG1 THR 46 11.524 5.103 3.115 368 HG21 THR 46 3HG2 THR 46 13.169 3.980 3.471 369 HG22 THR 46 1HG2 THR 46 14.774 4.617 3.114 370 HG23 THR 46 2HG2 THR 46 13.884 3.724 1.880 371 H GLY 47 H GLY 47 13.679 9.154 4.198 372 HA2 GLY 47 2HA GLY 47 12.626 10.811 2.191 373 HA3 GLY 47 3HA GLY 47 11.294 10.246 3.188 374 H ARG 48 H ARG 48 11.908 10.395 5.662 375 HA ARG 48 HA ARG 48 12.254 11.753 7.454 376 HB2 ARG 48 2HB ARG 48 14.629 11.635 6.457 377 HB3 ARG 48 3HB ARG 48 14.307 13.254 5.849 378 HG2 ARG 48 2HG ARG 48 14.810 14.140 7.811 379 HG3 ARG 48 3HG ARG 48 13.620 13.120 8.622 380 HD2 ARG 48 2HD ARG 48 15.538 11.303 8.246 381 HD3 ARG 48 3HD ARG 48 16.542 12.752 8.295 382 HE ARG 48 HE ARG 48 14.796 12.846 10.467 383 HH11 ARG 48 1HH1 ARG 48 17.459 10.922 9.316 384 HH12 ARG 48 2HH1 ARG 48 17.989 10.471 10.903 385 HH21 ARG 48 1HH2 ARG 48 15.484 12.259 12.561 386 HH22 ARG 48 2HH2 ARG 48 16.864 11.232 12.748 387 H GLU 49 H GLU 49 10.111 12.425 5.954 388 HA GLU 49 HA GLU 49 9.669 15.121 6.645 389 HB2 GLU 49 2HB GLU 49 10.748 14.634 3.984 390 HB3 GLU 49 3HB GLU 49 9.194 15.455 3.929 391 HG2 GLU 49 2HG GLU 49 10.585 16.792 5.910 392 HG3 GLU 49 3HG GLU 49 11.800 16.463 4.677 393 HA PRO 50 HA PRO 50 5.484 13.859 6.293 394 HB2 PRO 50 2HB PRO 50 4.227 16.171 5.628 395 HB3 PRO 50 3HB PRO 50 4.896 15.870 7.236 396 HG2 PRO 50 2HG PRO 50 6.062 17.427 4.960 397 HG3 PRO 50 3HG PRO 50 6.025 17.827 6.687 398 HD2 PRO 50 2HD PRO 50 8.218 16.800 5.476 399 HD3 PRO 50 3HD PRO 50 7.816 16.459 7.171 400 H GLY 51 H GLY 51 6.357 16.051 3.609 401 HA2 GLY 51 2HA GLY 51 4.488 14.689 1.845 402 HA3 GLY 51 3HA GLY 51 5.450 16.106 1.453 403 H ASP 52 H ASP 52 6.069 12.723 2.404 404 HA ASP 52 HA ASP 52 7.665 12.377 -0.015 405 HB2 ASP 52 2HB ASP 52 9.090 13.118 2.037 406 HB3 ASP 52 3HB ASP 52 8.831 11.468 2.597 407 H ILE 53 H ILE 53 5.257 11.295 0.196 408 HA ILE 53 HA ILE 53 5.748 8.485 0.942 409 HB ILE 53 HB ILE 53 3.196 8.343 1.049 410 HG12 ILE 53 2HG1 ILE 53 3.075 11.178 1.823 411 HG13 ILE 53 3HG1 ILE 53 3.317 10.911 0.100 412 HG21 ILE 53 1HG2 ILE 53 3.168 9.262 3.377 413 HG22 ILE 53 2HG2 ILE 53 4.500 8.159 3.036 414 HG23 ILE 53 3HG2 ILE 53 4.785 9.898 3.080 415 HD11 ILE 53 3HD1 ILE 53 1.333 9.283 0.305 416 HD12 ILE 53 1HD1 ILE 53 1.012 10.118 1.825 417 HD13 ILE 53 2HD1 ILE 53 1.020 11.018 0.308 418 HA PRO 54 HA PRO 54 5.027 7.267 -3.213 419 HB2 PRO 54 2HB PRO 54 3.789 4.876 -2.867 420 HB3 PRO 54 3HB PRO 54 5.510 5.122 -2.548 421 HG2 PRO 54 2HG PRO 54 3.216 5.062 -0.625 422 HG3 PRO 54 3HG PRO 54 4.823 4.326 -0.474 423 HD2 PRO 54 2HD PRO 54 4.165 6.652 0.746 424 HD3 PRO 54 3HD PRO 54 5.808 6.308 0.169 425 H GLU 55 H GLU 55 3.554 7.702 -4.746 426 HA GLU 55 HA GLU 55 0.727 7.871 -3.930 427 HB2 GLU 55 2HB GLU 55 1.908 10.036 -4.523 428 HB3 GLU 55 3HB GLU 55 2.017 9.428 -6.169 429 HG2 GLU 55 2HG GLU 55 -0.540 9.133 -5.983 430 HG3 GLU 55 3HG GLU 55 -0.403 10.237 -4.615 431 H THR 56 H THR 56 3.002 6.636 -6.230 432 HA THR 56 HA THR 56 0.790 5.351 -7.697 433 HB THR 56 HB THR 56 2.056 5.388 -9.713 434 HG1 THR 56 HG1 THR 56 4.186 5.741 -9.774 435 HG21 THR 56 3HG2 THR 56 0.994 7.578 -8.803 436 HG22 THR 56 1HG2 THR 56 2.060 7.658 -10.205 437 HG23 THR 56 2HG2 THR 56 2.665 8.106 -8.610 438 H LEU 57 H LEU 57 1.133 3.200 -8.427 439 HA LEU 57 HA LEU 57 2.239 1.455 -6.596 440 HB2 LEU 57 2HB LEU 57 0.866 1.261 -9.021 441 HB3 LEU 57 3HB LEU 57 2.351 0.341 -9.255 442 HG LEU 57 HG LEU 57 0.232 -0.124 -7.160 443 HD11 LEU 57 1HD1 LEU 57 1.181 -1.793 -9.484 444 HD12 LEU 57 2HD1 LEU 57 -0.350 -0.924 -9.385 445 HD13 LEU 57 3HD1 LEU 57 -0.029 -2.272 -8.294 446 HD21 LEU 57 3HD2 LEU 57 1.633 -2.105 -6.563 447 HD22 LEU 57 1HD2 LEU 57 2.340 -0.550 -6.123 448 HD23 LEU 57 2HD2 LEU 57 2.927 -1.415 -7.543 449 H ASP 58 H ASP 58 3.730 2.998 -9.367 450 HA ASP 58 HA ASP 58 6.085 1.420 -9.420 451 HB2 ASP 58 2HB ASP 58 5.082 3.822 -10.743 452 HB3 ASP 58 3HB ASP 58 6.815 3.891 -10.436 453 H GLN 59 H GLN 59 5.341 4.575 -7.964 454 HA GLN 59 HA GLN 59 7.871 5.115 -6.916 455 HB2 GLN 59 2HB GLN 59 5.138 6.089 -6.498 456 HB3 GLN 59 3HB GLN 59 6.163 6.234 -5.077 457 HG2 GLN 59 2HG GLN 59 7.858 7.345 -6.618 458 HG3 GLN 59 3HG GLN 59 6.542 7.463 -7.784 459 HE21 GLN 59 1HE2 GLN 59 7.539 8.358 -4.531 460 HE22 GLN 59 2HE2 GLN 59 6.558 9.775 -4.421 461 H LEU 60 H LEU 60 5.089 3.511 -5.385 462 HA LEU 60 HA LEU 60 6.347 3.003 -2.919 463 HB2 LEU 60 2HB LEU 60 3.951 2.900 -3.147 464 HB3 LEU 60 3HB LEU 60 4.083 1.581 -4.308 465 HG LEU 60 HG LEU 60 5.307 0.470 -2.170 466 HD11 LEU 60 1HD1 LEU 60 3.646 2.681 -1.169 467 HD12 LEU 60 2HD1 LEU 60 5.003 1.845 -0.417 468 HD13 LEU 60 3HD1 LEU 60 3.395 1.122 -0.384 469 HD21 LEU 60 3HD2 LEU 60 3.569 -0.585 -3.462 470 HD22 LEU 60 1HD2 LEU 60 2.359 0.516 -2.802 471 HD23 LEU 60 2HD2 LEU 60 3.146 -0.662 -1.751 472 H ARG 61 H ARG 61 6.190 1.167 -5.921 473 HA ARG 61 HA ARG 61 7.217 -1.263 -5.041 474 HB2 ARG 61 2HB ARG 61 6.282 -0.892 -7.292 475 HB3 ARG 61 3HB ARG 61 7.686 0.082 -7.708 476 HG2 ARG 61 2HG ARG 61 8.680 -2.370 -6.767 477 HG3 ARG 61 3HG ARG 61 7.342 -2.751 -7.853 478 HD2 ARG 61 2HD ARG 61 9.419 -0.746 -8.642 479 HD3 ARG 61 3HD ARG 61 9.730 -2.472 -8.822 480 HE ARG 61 HE ARG 61 7.236 -1.675 -9.974 481 HH11 ARG 61 1HH1 ARG 61 10.673 -1.836 -10.507 482 HH12 ARG 61 2HH1 ARG 61 10.535 -1.878 -12.234 483 HH21 ARG 61 1HH2 ARG 61 7.041 -1.730 -12.246 484 HH22 ARG 61 2HH2 ARG 61 8.469 -1.817 -13.222 485 H LEU 62 H LEU 62 8.940 1.612 -6.216 486 HA LEU 62 HA LEU 62 11.534 0.508 -5.970 487 HB2 LEU 62 2HB LEU 62 10.375 2.949 -6.811 488 HB3 LEU 62 3HB LEU 62 11.591 3.336 -5.596 489 HG LEU 62 HG LEU 62 12.562 3.475 -7.798 490 HD11 LEU 62 1HD1 LEU 62 13.570 0.922 -6.575 491 HD12 LEU 62 2HD1 LEU 62 13.850 2.502 -5.845 492 HD13 LEU 62 3HD1 LEU 62 14.479 2.152 -7.455 493 HD21 LEU 62 3HD2 LEU 62 12.784 1.134 -8.985 494 HD22 LEU 62 1HD2 LEU 62 11.382 2.169 -9.257 495 HD23 LEU 62 2HD2 LEU 62 11.273 0.814 -8.133 496 H VAL 63 H VAL 63 9.504 2.402 -3.789 497 HA VAL 63 HA VAL 63 11.367 2.943 -1.790 498 HB VAL 63 HB VAL 63 8.420 2.371 -1.440 499 HG11 VAL 63 1HG1 VAL 63 9.469 2.276 0.692 500 HG12 VAL 63 2HG1 VAL 63 10.443 3.707 0.347 501 HG13 VAL 63 3HG1 VAL 63 8.699 3.857 0.567 502 HG21 VAL 63 3HG2 VAL 63 8.022 4.309 -2.448 503 HG22 VAL 63 1HG2 VAL 63 9.080 5.138 -1.306 504 HG23 VAL 63 2HG2 VAL 63 9.743 4.474 -2.799 505 H ILE 64 H ILE 64 9.231 0.134 -2.187 506 HA ILE 64 HA ILE 64 9.956 -1.195 0.177 507 HB ILE 64 HB ILE 64 9.034 -2.401 -2.435 508 HG12 ILE 64 2HG1 ILE 64 7.350 -1.846 -0.001 509 HG13 ILE 64 3HG1 ILE 64 7.574 -0.635 -1.259 510 HG21 ILE 64 1HG2 ILE 64 9.639 -3.540 0.215 511 HG22 ILE 64 2HG2 ILE 64 8.133 -4.074 -0.529 512 HG23 ILE 64 3HG2 ILE 64 9.662 -4.294 -1.379 513 HD11 ILE 64 3HD1 ILE 64 5.679 -1.578 -2.036 514 HD12 ILE 64 1HD1 ILE 64 6.829 -2.684 -2.787 515 HD13 ILE 64 2HD1 ILE 64 6.016 -3.139 -1.289 516 H CYS 65 H CYS 65 11.132 -1.683 -3.154 517 HA CYS 65 HA CYS 65 13.008 -3.651 -2.647 518 HB2 CYS 65 2HB CYS 65 12.238 -2.563 -4.888 519 HB3 CYS 65 3HB CYS 65 13.585 -1.463 -4.620 520 HG CYS 65 HG CYS 65 14.617 -4.559 -4.220 521 H ASP 66 H ASP 66 13.341 -0.141 -2.385 522 HA ASP 66 HA ASP 66 16.117 -0.204 -1.732 523 HB2 ASP 66 2HB ASP 66 13.980 1.908 -1.519 524 HB3 ASP 66 3HB ASP 66 15.617 2.185 -0.930 525 H LEU 67 H LEU 67 13.131 -0.173 0.128 526 HA LEU 67 HA LEU 67 14.236 0.323 2.660 527 HB2 LEU 67 2HB LEU 67 11.761 0.206 1.831 528 HB3 LEU 67 3HB LEU 67 11.885 -1.485 2.309 529 HG LEU 67 HG LEU 67 10.842 -0.113 4.047 530 HD11 LEU 67 1HD1 LEU 67 12.716 -2.035 4.384 531 HD12 LEU 67 2HD1 LEU 67 11.798 -1.299 5.697 532 HD13 LEU 67 3HD1 LEU 67 13.419 -0.717 5.320 533 HD21 LEU 67 3HD2 LEU 67 12.031 1.612 5.198 534 HD22 LEU 67 1HD2 LEU 67 12.077 1.979 3.473 535 HD23 LEU 67 2HD2 LEU 67 13.497 1.297 4.268 536 H GLN 68 H GLN 68 13.418 -2.765 1.083 537 HA GLN 68 HA GLN 68 14.514 -4.353 3.180 538 HB2 GLN 68 2HB GLN 68 12.742 -5.014 1.435 539 HB3 GLN 68 3HB GLN 68 14.098 -5.290 0.351 540 HG2 GLN 68 2HG GLN 68 14.350 -6.570 2.975 541 HG3 GLN 68 3HG GLN 68 13.013 -7.156 1.987 542 HE21 GLN 68 1HE2 GLN 68 13.732 -7.430 -0.415 543 HE22 GLN 68 2HE2 GLN 68 15.192 -8.328 -0.629 544 H GLU 69 H GLU 69 15.801 -2.847 0.339 545 HA GLU 69 HA GLU 69 18.128 -4.459 0.073 546 HB2 GLU 69 2HB GLU 69 17.412 -3.162 -1.810 547 HB3 GLU 69 3HB GLU 69 17.472 -1.672 -0.879 548 HG2 GLU 69 2HG GLU 69 19.351 -1.899 -2.441 549 HG3 GLU 69 3HG GLU 69 19.871 -1.782 -0.761 550 H ARG 70 H ARG 70 17.798 -1.102 1.245 551 HA ARG 70 HA ARG 70 20.376 -0.907 2.310 552 HB2 ARG 70 2HB ARG 70 18.102 0.739 2.126 553 HB3 ARG 70 3HB ARG 70 18.499 0.661 3.837 554 HG2 ARG 70 2HG ARG 70 19.726 2.476 3.144 555 HG3 ARG 70 3HG ARG 70 20.914 1.175 3.034 556 HD2 ARG 70 2HD ARG 70 20.918 1.185 0.750 557 HD3 ARG 70 3HD ARG 70 19.249 1.744 0.642 558 HE ARG 70 HE ARG 70 21.589 3.359 0.643 559 HH11 ARG 70 1HH1 ARG 70 18.270 3.276 1.692 560 HH12 ARG 70 2HH1 ARG 70 18.084 4.998 1.668 561 HH21 ARG 70 1HH2 ARG 70 21.356 5.627 0.608 562 HH22 ARG 70 2HH2 ARG 70 19.839 6.335 1.051 563 H ARG 71 H ARG 71 17.303 -1.666 3.940 564 HA ARG 71 HA ARG 71 18.261 -1.972 6.522 565 HB2 ARG 71 2HB ARG 71 15.993 -3.315 5.064 566 HB3 ARG 71 3HB ARG 71 16.320 -3.625 6.764 567 HG2 ARG 71 2HG ARG 71 15.704 -0.933 5.562 568 HG3 ARG 71 3HG ARG 71 14.573 -1.947 6.460 569 HD2 ARG 71 2HD ARG 71 15.250 -0.757 8.237 570 HD3 ARG 71 3HD ARG 71 16.664 -1.808 8.192 571 HE ARG 71 HE ARG 71 17.911 0.013 7.639 572 HH11 ARG 71 1HH1 ARG 71 14.598 0.646 6.778 573 HH12 ARG 71 2HH1 ARG 71 14.902 2.279 6.283 574 HH21 ARG 71 1HH2 ARG 71 18.324 2.161 6.991 575 HH22 ARG 71 2HH2 ARG 71 17.021 3.139 6.404 576 H GLU 72 H GLU 72 18.123 -4.344 3.895 577 HA GLU 72 HA GLU 72 18.963 -6.589 5.322 578 HB2 GLU 72 2HB GLU 72 18.091 -6.846 3.104 579 HB3 GLU 72 3HB GLU 72 19.357 -5.831 2.428 580 HG2 GLU 72 2HG GLU 72 20.884 -7.493 2.422 581 HG3 GLU 72 3HG GLU 72 20.245 -8.236 3.888 582 H LYS 73 H LYS 73 20.895 -4.222 3.502 583 HA LYS 73 HA LYS 73 23.406 -5.340 3.929 584 HB2 LYS 73 2HB LYS 73 22.412 -2.587 3.349 585 HB3 LYS 73 3HB LYS 73 24.092 -2.779 3.830 586 HG2 LYS 73 2HG LYS 73 24.131 -4.601 1.972 587 HG3 LYS 73 3HG LYS 73 22.700 -3.753 1.380 588 HD2 LYS 73 2HD LYS 73 25.100 -2.140 2.076 589 HD3 LYS 73 3HD LYS 73 25.140 -3.092 0.590 590 HE2 LYS 73 2HE LYS 73 23.932 -1.542 -0.441 591 HE3 LYS 73 3HE LYS 73 22.630 -1.772 0.725 592 HZ1 LYS 73 3HZ LYS 73 23.844 0.535 0.420 593 HZ2 LYS 73 1HZ LYS 73 24.902 -0.138 1.557 594 HZ3 LYS 73 2HZ LYS 73 23.259 0.028 1.924 595 H PHE 74 H PHE 74 21.490 -3.207 5.977 596 HA PHE 74 HA PHE 74 23.560 -2.824 7.918 597 HB2 PHE 74 2HB PHE 74 21.688 -1.213 7.547 598 HB3 PHE 74 3HB PHE 74 20.583 -2.398 8.236 599 HD1 PHE 74 HD2 PHE 74 23.865 -0.857 9.136 600 HD2 PHE 74 HD1 PHE 74 19.974 -2.025 10.406 601 HE1 PHE 74 HE2 PHE 74 24.342 0.014 11.387 602 HE2 PHE 74 HE1 PHE 74 20.444 -1.155 12.659 603 HZ PHE 74 HZ PHE 74 22.631 -0.135 13.152 604 H GLY 75 H GLY 75 21.091 -5.191 7.361 605 HA2 GLY 75 2HA GLY 75 21.843 -7.325 8.612 606 HA3 GLY 75 3HA GLY 75 21.520 -6.344 10.034 607 H SER 76 H SER 76 20.207 -8.691 9.783 608 HA SER 76 HA SER 76 17.531 -8.001 8.783 609 HB2 SER 76 2HB SER 76 18.552 -10.094 7.916 610 HB3 SER 76 3HB SER 76 18.620 -10.717 9.565 611 HG SER 76 HG SER 76 16.737 -11.488 8.856 612 H SER 77 H SER 77 15.676 -8.527 10.079 613 HA SER 77 HA SER 77 15.865 -9.315 12.790 614 HB2 SER 77 2HB SER 77 15.942 -7.371 13.966 615 HB3 SER 77 3HB SER 77 16.727 -6.757 12.512 616 HG SER 77 HG SER 77 15.099 -5.356 12.895 617 H LYS 78 H LYS 78 13.823 -9.445 13.819 618 HA LYS 78 HA LYS 78 11.682 -10.119 12.213 619 HB2 LYS 78 2HB LYS 78 12.072 -10.577 14.717 620 HB3 LYS 78 3HB LYS 78 11.303 -9.019 14.989 621 HG2 LYS 78 2HG LYS 78 9.284 -9.897 14.746 622 HG3 LYS 78 3HG LYS 78 9.724 -10.630 13.202 623 HD2 LYS 78 2HD LYS 78 10.286 -12.633 14.157 624 HD3 LYS 78 3HD LYS 78 10.736 -11.896 15.697 625 HE2 LYS 78 2HE LYS 78 8.047 -11.351 15.510 626 HE3 LYS 78 3HE LYS 78 8.172 -12.961 14.803 627 HZ1 LYS 78 3HZ LYS 78 9.444 -13.609 16.829 628 HZ2 LYS 78 1HZ LYS 78 7.823 -13.218 17.118 629 HZ3 LYS 78 2HZ LYS 78 9.042 -12.112 17.507 630 H GLU 79 H GLU 79 12.496 -7.000 13.623 631 HA GLU 79 HA GLU 79 10.064 -5.696 12.997 632 HB2 GLU 79 2HB GLU 79 12.752 -4.348 13.197 633 HB3 GLU 79 3HB GLU 79 11.171 -3.669 13.555 634 HG2 GLU 79 2HG GLU 79 12.766 -5.637 15.151 635 HG3 GLU 79 3HG GLU 79 12.154 -4.057 15.637 636 H ILE 80 H ILE 80 13.141 -6.002 11.276 637 HA ILE 80 HA ILE 80 12.460 -4.296 9.123 638 HB ILE 80 HB ILE 80 14.449 -6.568 9.182 639 HG12 ILE 80 2HG1 ILE 80 14.944 -4.899 10.883 640 HG13 ILE 80 3HG1 ILE 80 16.108 -4.769 9.569 641 HG21 ILE 80 1HG2 ILE 80 14.128 -4.270 7.258 642 HG22 ILE 80 2HG2 ILE 80 15.503 -5.372 7.293 643 HG23 ILE 80 3HG2 ILE 80 13.895 -5.983 6.909 644 HD11 ILE 80 3HD1 ILE 80 15.563 -2.570 10.093 645 HD12 ILE 80 1HD1 ILE 80 14.598 -2.924 8.660 646 HD13 ILE 80 2HD1 ILE 80 13.846 -2.936 10.256 647 H ASP 81 H ASP 81 12.618 -7.858 9.276 648 HA ASP 81 HA ASP 81 11.573 -8.400 6.769 649 HB2 ASP 81 2HB ASP 81 11.351 -9.963 9.345 650 HB3 ASP 81 3HB ASP 81 10.841 -10.593 7.781 651 H MET 82 H MET 82 9.871 -7.850 9.824 652 HA MET 82 HA MET 82 7.279 -8.412 8.877 653 HB2 MET 82 2HB MET 82 8.365 -6.852 11.195 654 HB3 MET 82 3HB MET 82 6.643 -6.816 10.841 655 HG2 MET 82 2HG MET 82 6.511 -9.219 11.082 656 HG3 MET 82 3HG MET 82 8.251 -9.308 11.346 657 HE1 MET 82 3HE MET 82 4.923 -8.395 14.192 658 HE2 MET 82 1HE MET 82 4.891 -8.842 12.486 659 HE3 MET 82 2HE MET 82 5.375 -10.027 13.699 660 H ALA 83 H ALA 83 9.226 -5.483 8.868 661 HA ALA 83 HA ALA 83 7.232 -3.645 8.158 662 HB1 ALA 83 1HB ALA 83 10.002 -3.589 8.559 663 HB2 ALA 83 2HB ALA 83 9.740 -2.974 6.927 664 HB3 ALA 83 3HB ALA 83 8.926 -2.217 8.296 665 H ILE 84 H ILE 84 9.518 -5.427 6.082 666 HA ILE 84 HA ILE 84 8.577 -4.470 3.630 667 HB ILE 84 HB ILE 84 9.757 -7.200 4.152 668 HG12 ILE 84 2HG1 ILE 84 11.205 -5.467 5.070 669 HG13 ILE 84 3HG1 ILE 84 11.924 -6.136 3.608 670 HG21 ILE 84 1HG2 ILE 84 9.439 -7.504 1.974 671 HG22 ILE 84 2HG2 ILE 84 8.872 -5.847 1.769 672 HG23 ILE 84 3HG2 ILE 84 10.596 -6.205 1.684 673 HD11 ILE 84 3HD1 ILE 84 10.979 -4.178 2.367 674 HD12 ILE 84 1HD1 ILE 84 10.537 -3.492 3.930 675 HD13 ILE 84 2HD1 ILE 84 12.233 -3.792 3.546 676 H VAL 85 H VAL 85 7.571 -7.262 5.555 677 HA VAL 85 HA VAL 85 5.835 -8.451 3.727 678 HB VAL 85 HB VAL 85 5.568 -8.346 6.735 679 HG11 VAL 85 1HG1 VAL 85 4.296 -10.152 4.684 680 HG12 VAL 85 2HG1 VAL 85 4.291 -10.464 6.421 681 HG13 VAL 85 3HG1 VAL 85 3.481 -9.034 5.779 682 HG21 VAL 85 3HG2 VAL 85 7.620 -9.418 5.268 683 HG22 VAL 85 1HG2 VAL 85 7.151 -9.921 6.892 684 HG23 VAL 85 2HG2 VAL 85 6.546 -10.800 5.488 685 H THR 86 H THR 86 5.160 -5.990 6.202 686 HA THR 86 HA THR 86 2.414 -5.739 5.738 687 HB THR 86 HB THR 86 2.498 -3.667 6.921 688 HG1 THR 86 HG1 THR 86 4.068 -2.390 6.264 689 HG21 THR 86 3HG2 THR 86 4.739 -4.660 8.423 690 HG22 THR 86 1HG2 THR 86 3.731 -6.001 7.881 691 HG23 THR 86 2HG2 THR 86 3.023 -4.693 8.829 692 H LEU 87 H LEU 87 5.160 -4.047 4.269 693 HA LEU 87 HA LEU 87 3.736 -2.192 2.749 694 HB2 LEU 87 2HB LEU 87 6.418 -3.099 2.972 695 HB3 LEU 87 3HB LEU 87 5.995 -3.064 1.261 696 HG LEU 87 HG LEU 87 7.096 -0.991 2.108 697 HD11 LEU 87 1HD1 LEU 87 6.008 0.215 0.562 698 HD12 LEU 87 2HD1 LEU 87 4.436 -0.040 1.319 699 HD13 LEU 87 3HD1 LEU 87 5.122 -1.281 0.271 700 HD21 LEU 87 3HD2 LEU 87 6.268 0.265 3.783 701 HD22 LEU 87 1HD2 LEU 87 5.502 -1.246 4.272 702 HD23 LEU 87 2HD2 LEU 87 4.591 -0.057 3.340 703 H LYS 88 H LYS 88 4.623 -5.536 2.047 704 HA LYS 88 HA LYS 88 3.687 -5.524 -0.637 705 HB2 LYS 88 2HB LYS 88 3.950 -7.921 1.180 706 HB3 LYS 88 3HB LYS 88 3.981 -7.908 -0.579 707 HG2 LYS 88 2HG LYS 88 6.024 -6.170 0.322 708 HG3 LYS 88 3HG LYS 88 6.145 -7.671 1.243 709 HD2 LYS 88 2HD LYS 88 6.052 -8.916 -0.921 710 HD3 LYS 88 3HD LYS 88 6.136 -7.364 -1.758 711 HE2 LYS 88 2HE LYS 88 8.192 -8.024 0.301 712 HE3 LYS 88 3HE LYS 88 8.307 -8.765 -1.295 713 HZ1 LYS 88 3HZ LYS 88 7.804 -5.971 -1.484 714 HZ2 LYS 88 1HZ LYS 88 9.067 -6.880 -2.148 715 HZ3 LYS 88 2HZ LYS 88 9.199 -6.272 -0.576 716 H VAL 89 H VAL 89 2.324 -7.118 2.254 717 HA VAL 89 HA VAL 89 -0.104 -7.874 1.182 718 HB VAL 89 HB VAL 89 0.295 -6.913 4.017 719 HG11 VAL 89 1HG1 VAL 89 -1.577 -8.194 4.595 720 HG12 VAL 89 2HG1 VAL 89 -2.049 -7.386 3.099 721 HG13 VAL 89 3HG1 VAL 89 -1.554 -9.079 3.070 722 HG21 VAL 89 3HG2 VAL 89 0.442 -9.735 3.822 723 HG22 VAL 89 1HG2 VAL 89 1.565 -9.057 2.643 724 HG23 VAL 89 2HG2 VAL 89 1.693 -8.608 4.344 725 H PHE 90 H PHE 90 0.803 -4.776 2.626 726 HA PHE 90 HA PHE 90 -1.792 -3.634 2.517 727 HB2 PHE 90 2HB PHE 90 -0.210 -2.667 4.023 728 HB3 PHE 90 3HB PHE 90 0.961 -2.416 2.732 729 HD1 PHE 90 HD2 PHE 90 -2.671 -1.622 2.872 730 HD2 PHE 90 HD1 PHE 90 1.309 -0.136 2.619 731 HE1 PHE 90 HE2 PHE 90 -3.546 0.652 2.528 732 HE2 PHE 90 HE1 PHE 90 0.441 2.141 2.275 733 HZ PHE 90 HZ PHE 90 -1.989 2.537 2.228 734 H ALA 91 H ALA 91 0.929 -3.715 0.292 735 HA ALA 91 HA ALA 91 -0.032 -1.793 -1.540 736 HB1 ALA 91 1HB ALA 91 2.302 -2.551 -1.476 737 HB2 ALA 91 2HB ALA 91 1.795 -4.132 -2.072 738 HB3 ALA 91 3HB ALA 91 1.600 -2.703 -3.087 739 H VAL 92 H VAL 92 -0.301 -5.337 -1.467 740 HA VAL 92 HA VAL 92 -1.882 -5.453 -3.853 741 HB VAL 92 HB VAL 92 -1.601 -7.593 -1.743 742 HG11 VAL 92 1HG1 VAL 92 -3.359 -8.131 -3.237 743 HG12 VAL 92 2HG1 VAL 92 -2.417 -7.622 -4.640 744 HG13 VAL 92 3HG1 VAL 92 -1.962 -9.076 -3.751 745 HG21 VAL 92 3HG2 VAL 92 0.608 -7.297 -2.261 746 HG22 VAL 92 1HG2 VAL 92 0.142 -8.403 -3.553 747 HG23 VAL 92 2HG2 VAL 92 0.262 -6.673 -3.873 748 H ALA 93 H ALA 93 -2.635 -6.166 -0.437 749 HA ALA 93 HA ALA 93 -5.406 -6.413 -0.790 750 HB1 ALA 93 1HB ALA 93 -4.055 -7.168 1.196 751 HB2 ALA 93 2HB ALA 93 -4.065 -5.490 1.740 752 HB3 ALA 93 3HB ALA 93 -5.583 -6.372 1.573 753 H GLY 94 H GLY 94 -3.403 -3.648 -0.783 754 HA2 GLY 94 2HA GLY 94 -5.660 -1.866 -0.176 755 HA3 GLY 94 3HA GLY 94 -3.968 -1.396 -0.221 756 H LEU 95 H LEU 95 -2.917 -1.549 -2.413 757 HA LEU 95 HA LEU 95 -4.260 0.079 -4.236 758 HB2 LEU 95 2HB LEU 95 -2.050 -1.811 -4.988 759 HB3 LEU 95 3HB LEU 95 -2.432 -0.242 -5.696 760 HG LEU 95 HG LEU 95 -1.223 -0.753 -2.979 761 HD11 LEU 95 1HD1 LEU 95 0.073 -0.840 -5.299 762 HD12 LEU 95 2HD1 LEU 95 0.785 -0.147 -3.842 763 HD13 LEU 95 3HD1 LEU 95 0.071 0.907 -5.062 764 HD21 LEU 95 3HD2 LEU 95 -1.971 1.240 -2.359 765 HD22 LEU 95 1HD2 LEU 95 -2.765 1.459 -3.919 766 HD23 LEU 95 2HD2 LEU 95 -1.091 1.970 -3.702 767 H LEU 96 H LEU 96 -3.815 -3.436 -4.209 768 HA LEU 96 HA LEU 96 -5.429 -3.725 -6.611 769 HB2 LEU 96 2HB LEU 96 -3.353 -5.180 -5.479 770 HB3 LEU 96 3HB LEU 96 -4.777 -6.185 -5.224 771 HG LEU 96 HG LEU 96 -3.628 -6.820 -7.264 772 HD11 LEU 96 1HD1 LEU 96 -6.179 -5.384 -7.965 773 HD12 LEU 96 2HD1 LEU 96 -6.118 -6.923 -7.107 774 HD13 LEU 96 3HD1 LEU 96 -5.492 -6.805 -8.751 775 HD21 LEU 96 3HD2 LEU 96 -2.536 -5.200 -8.345 776 HD22 LEU 96 1HD2 LEU 96 -3.557 -3.934 -7.661 777 HD23 LEU 96 2HD2 LEU 96 -4.089 -4.820 -9.090 778 H ASN 97 H ASN 97 -6.004 -3.387 -3.362 779 HA ASN 97 HA ASN 97 -7.754 -3.838 -1.973 780 HB2 ASN 97 2HB ASN 97 -9.497 -4.159 -4.395 781 HB3 ASN 97 3HB ASN 97 -9.868 -3.389 -2.856 782 HD21 ASN 97 1HD2 ASN 97 -9.038 -1.311 -2.434 783 HD22 ASN 97 2HD2 ASN 97 -8.553 -0.265 -3.721 784 H MET 98 H MET 98 -6.206 -6.116 -2.953 785 HA MET 98 HA MET 98 -8.261 -8.222 -2.820 786 HB2 MET 98 2HB MET 98 -5.646 -8.038 -4.239 787 HB3 MET 98 3HB MET 98 -6.161 -9.616 -3.658 788 HG2 MET 98 2HG MET 98 -8.390 -9.020 -4.867 789 HG3 MET 98 3HG MET 98 -7.378 -7.877 -5.747 790 HE1 MET 98 3HE MET 98 -8.691 -11.592 -6.500 791 HE2 MET 98 1HE MET 98 -7.344 -12.377 -5.675 792 HE3 MET 98 2HE MET 98 -8.354 -11.219 -4.809 793 H THR 99 H THR 99 -8.354 -8.118 -0.529 794 HA THR 99 HA THR 99 -6.160 -8.305 1.196 795 HB THR 99 HB THR 99 -8.923 -9.421 1.706 796 HG1 THR 99 HG1 THR 99 -9.111 -7.230 2.729 797 HG21 THR 99 3HG2 THR 99 -8.436 -9.244 4.001 798 HG22 THR 99 1HG2 THR 99 -7.007 -8.253 3.710 799 HG23 THR 99 2HG2 THR 99 -6.993 -9.967 3.294 800 H VAL 100 H VAL 100 -4.652 -9.836 0.723 801 HA VAL 100 HA VAL 100 -5.114 -12.436 -0.170 802 HB VAL 100 HB VAL 100 -2.830 -12.939 0.820 803 HG11 VAL 100 1HG1 VAL 100 -3.600 -11.450 -1.416 804 HG12 VAL 100 2HG1 VAL 100 -2.229 -10.583 -0.722 805 HG13 VAL 100 3HG1 VAL 100 -2.067 -12.283 -1.162 806 HG21 VAL 100 3HG2 VAL 100 -1.683 -11.428 2.056 807 HG22 VAL 100 1HG2 VAL 100 -2.402 -10.045 1.230 808 HG23 VAL 100 2HG2 VAL 100 -3.307 -10.890 2.487 809 H SER 101 H SER 101 -4.116 -14.339 1.295 810 HA SER 101 HA SER 101 -5.956 -14.533 3.552 811 HB2 SER 101 2HB SER 101 -4.578 -16.966 3.265 812 HB3 SER 101 3HB SER 101 -6.220 -16.603 2.734 813 HG SER 101 HG SER 101 -5.295 -17.137 0.878 814 H THR 102 H THR 102 -2.508 -14.843 2.823 815 HA THR 102 HA THR 102 -1.937 -14.392 5.667 816 HB THR 102 HB THR 102 -0.282 -16.085 5.787 817 HG1 THR 102 HG1 THR 102 0.233 -17.356 3.905 818 HG21 THR 102 3HG2 THR 102 -2.540 -16.942 6.064 819 HG22 THR 102 1HG2 THR 102 -1.530 -18.149 5.268 820 HG23 THR 102 2HG2 THR 102 -2.679 -17.200 4.325 821 H ALA 103 H ALA 103 0.351 -13.731 6.032 822 HA ALA 103 HA ALA 103 1.039 -11.529 4.468 823 HB1 ALA 103 1HB ALA 103 2.268 -11.165 6.277 824 HB2 ALA 103 2HB ALA 103 2.052 -12.836 6.800 825 HB3 ALA 103 3HB ALA 103 3.393 -12.411 5.736 826 H ALA 104 H ALA 104 2.245 -14.852 4.388 827 HA ALA 104 HA ALA 104 4.316 -14.423 2.521 828 HB1 ALA 104 1HB ALA 104 2.847 -16.806 3.533 829 HB2 ALA 104 2HB ALA 104 3.850 -16.976 2.091 830 HB3 ALA 104 3HB ALA 104 4.568 -16.424 3.604 831 H ALA 105 H ALA 105 0.934 -15.418 2.129 832 HA ALA 105 HA ALA 105 0.954 -15.926 -0.609 833 HB1 ALA 105 1HB ALA 105 -1.040 -16.587 0.196 834 HB2 ALA 105 2HB ALA 105 -1.093 -15.309 1.410 835 HB3 ALA 105 3HB ALA 105 -1.544 -14.959 -0.259 836 H ALA 106 H ALA 106 0.471 -12.882 1.134 837 HA ALA 106 HA ALA 106 -0.175 -11.286 -1.088 838 HB1 ALA 106 1HB ALA 106 0.322 -10.898 1.694 839 HB2 ALA 106 2HB ALA 106 1.216 -9.686 0.775 840 HB3 ALA 106 3HB ALA 106 -0.527 -9.846 0.561 841 H GLU 107 H GLU 107 2.950 -11.676 0.594 842 HA GLU 107 HA GLU 107 4.436 -10.128 -1.228 843 HB2 GLU 107 2HB GLU 107 6.417 -11.221 -0.220 844 HB3 GLU 107 3HB GLU 107 5.296 -10.598 0.982 845 HG2 GLU 107 2HG GLU 107 4.383 -12.876 1.256 846 HG3 GLU 107 3HG GLU 107 5.605 -13.468 0.132 847 H ASN 108 H ASN 108 3.334 -13.408 -1.315 848 HA ASN 108 HA ASN 108 5.187 -14.431 -3.193 849 HB2 ASN 108 2HB ASN 108 3.647 -15.791 -1.729 850 HB3 ASN 108 3HB ASN 108 2.331 -15.340 -2.809 851 HD21 ASN 108 1HD2 ASN 108 5.361 -17.068 -2.559 852 HD22 ASN 108 2HD2 ASN 108 5.112 -18.088 -3.931 853 H MET 109 H MET 109 1.816 -13.347 -3.640 854 HA MET 109 HA MET 109 1.862 -13.480 -6.450 855 HB2 MET 109 2HB MET 109 -0.050 -12.975 -4.526 856 HB3 MET 109 3HB MET 109 0.087 -11.430 -5.355 857 HG2 MET 109 2HG MET 109 -0.508 -14.089 -6.632 858 HG3 MET 109 3HG MET 109 -1.658 -12.787 -6.336 859 HE1 MET 109 3HE MET 109 -1.007 -10.144 -8.816 860 HE2 MET 109 1HE MET 109 -1.458 -10.532 -7.156 861 HE3 MET 109 2HE MET 109 0.194 -10.039 -7.528 862 H TYR 110 H TYR 110 2.779 -10.968 -4.190 863 HA TYR 110 HA TYR 110 2.890 -8.798 -5.962 864 HB2 TYR 110 2HB TYR 110 3.016 -8.518 -3.535 865 HB3 TYR 110 3HB TYR 110 4.570 -9.345 -3.505 866 HD1 TYR 110 HD2 TYR 110 6.580 -8.246 -4.388 867 HD2 TYR 110 HD1 TYR 110 2.839 -6.224 -4.243 868 HE1 TYR 110 HE2 TYR 110 7.734 -6.098 -4.715 869 HE2 TYR 110 HE1 TYR 110 3.982 -4.072 -4.571 870 HH TYR 110 HH TYR 110 5.952 -3.111 -5.204 871 H SER 111 H SER 111 5.424 -11.089 -4.971 872 HA SER 111 HA SER 111 7.368 -9.975 -6.757 873 HB2 SER 111 2HB SER 111 8.680 -12.049 -6.130 874 HB3 SER 111 3HB SER 111 8.197 -11.028 -4.776 875 HG SER 111 HG SER 111 7.792 -13.521 -4.880 876 H GLN 112 H GLN 112 5.296 -12.846 -6.766 877 HA GLN 112 HA GLN 112 6.282 -14.007 -9.122 878 HB2 GLN 112 2HB GLN 112 4.847 -15.212 -7.544 879 HB3 GLN 112 3HB GLN 112 3.501 -14.154 -7.946 880 HG2 GLN 112 2HG GLN 112 3.066 -15.213 -9.887 881 HG3 GLN 112 3HG GLN 112 4.764 -15.560 -10.206 882 HE21 GLN 112 1HE2 GLN 112 4.767 -17.686 -10.562 883 HE22 GLN 112 2HE2 GLN 112 4.179 -18.879 -9.460 884 H MET 113 H MET 113 4.127 -11.342 -8.589 885 HA MET 113 HA MET 113 3.005 -11.325 -11.225 886 HB2 MET 113 2HB MET 113 1.763 -10.332 -9.402 887 HB3 MET 113 3HB MET 113 3.080 -9.219 -9.059 888 HG2 MET 113 2HG MET 113 2.739 -8.136 -11.214 889 HG3 MET 113 3HG MET 113 1.434 -9.262 -11.578 890 HE1 MET 113 3HE MET 113 -0.215 -7.398 -12.115 891 HE2 MET 113 1HE MET 113 -0.672 -6.082 -11.033 892 HE3 MET 113 2HE MET 113 0.929 -6.100 -11.772 893 H GLY 114 H GLY 114 5.866 -10.056 -9.733 894 HA2 GLY 114 2HA GLY 114 7.731 -9.535 -11.213 895 HA3 GLY 114 3HA GLY 114 6.574 -8.791 -12.306 896 H LEU 115 H LEU 115 6.222 -8.257 -8.910 897 HA LEU 115 HA LEU 115 6.922 -5.447 -9.316 898 HB2 LEU 115 2HB LEU 115 5.560 -6.741 -6.961 899 HB3 LEU 115 3HB LEU 115 5.712 -5.013 -7.273 900 HG LEU 115 HG LEU 115 4.046 -6.995 -8.821 901 HD11 LEU 115 1HD1 LEU 115 3.376 -4.721 -6.969 902 HD12 LEU 115 2HD1 LEU 115 2.981 -6.428 -6.775 903 HD13 LEU 115 3HD1 LEU 115 2.204 -5.482 -8.044 904 HD21 LEU 115 3HD2 LEU 115 4.244 -5.618 -10.555 905 HD22 LEU 115 1HD2 LEU 115 5.156 -4.447 -9.602 906 HD23 LEU 115 2HD2 LEU 115 3.393 -4.404 -9.599 907 H ASP 116 H ASP 116 7.928 -8.291 -7.598 908 HA ASP 116 HA ASP 116 9.833 -6.765 -5.987 909 HB2 ASP 116 2HB ASP 116 8.322 -8.898 -5.307 910 HB3 ASP 116 3HB ASP 116 9.791 -9.722 -5.821 911 H THR 117 H THR 117 12.019 -8.076 -5.729 912 HA THR 117 HA THR 117 12.978 -8.815 -8.412 913 HB THR 117 HB THR 117 15.089 -7.638 -7.986 914 HG1 THR 117 HG1 THR 117 15.225 -7.552 -5.779 915 HG21 THR 117 3HG2 THR 117 13.144 -6.506 -9.112 916 HG22 THR 117 1HG2 THR 117 14.314 -5.414 -8.371 917 HG23 THR 117 2HG2 THR 117 12.781 -5.744 -7.564 918 H ARG 118 H ARG 118 12.187 -10.437 -6.085 919 HA ARG 118 HA ARG 118 14.520 -12.132 -6.015 920 HB2 ARG 118 2HB ARG 118 14.755 -10.416 -4.120 921 HB3 ARG 118 3HB ARG 118 13.406 -11.251 -3.361 922 HG2 ARG 118 2HG ARG 118 15.412 -13.135 -4.190 923 HG3 ARG 118 3HG ARG 118 16.116 -11.877 -3.171 924 HD2 ARG 118 2HD ARG 118 13.545 -13.133 -2.342 925 HD3 ARG 118 3HD ARG 118 15.043 -14.038 -2.122 926 HE ARG 118 HE ARG 118 15.127 -11.350 -1.092 927 HH11 ARG 118 1HH1 ARG 118 14.321 -14.669 -0.416 928 HH12 ARG 118 2HH1 ARG 118 14.482 -14.495 1.301 929 HH21 ARG 118 1HH2 ARG 118 15.342 -11.108 1.166 930 HH22 ARG 118 2HH2 ARG 118 15.062 -12.469 2.199 931 HA PRO 119 HA PRO 119 10.372 -14.242 -5.974 932 HB2 PRO 119 2HB PRO 119 10.901 -15.850 -8.098 933 HB3 PRO 119 3HB PRO 119 10.238 -14.220 -8.268 934 HG2 PRO 119 2HG PRO 119 13.065 -15.157 -8.573 935 HG3 PRO 119 3HG PRO 119 12.148 -14.020 -9.579 936 HD2 PRO 119 2HD PRO 119 13.934 -13.203 -7.715 937 HD3 PRO 119 3HD PRO 119 12.482 -12.266 -8.122 938 H SER 120 H SER 120 10.105 -15.956 -4.692 939 HA SER 120 HA SER 120 12.200 -18.018 -4.619 940 HB2 SER 120 2HB SER 120 10.921 -16.596 -2.288 941 HB3 SER 120 3HB SER 120 11.675 -18.180 -2.109 942 HG SER 120 HG SER 120 13.486 -17.145 -1.972 943 H MET 121 H MET 121 11.455 -20.089 -3.725 944 HA MET 121 HA MET 121 8.625 -20.543 -4.387 945 HB2 MET 121 2HB MET 121 9.309 -22.915 -4.742 946 HB3 MET 121 3HB MET 121 10.087 -21.782 -5.839 947 HG2 MET 121 2HG MET 121 12.099 -21.827 -4.434 948 HG3 MET 121 3HG MET 121 11.317 -23.004 -3.381 949 HE1 MET 121 3HE MET 121 14.167 -23.406 -6.163 950 HE2 MET 121 1HE MET 121 13.018 -23.352 -7.499 951 HE3 MET 121 2HE MET 121 13.059 -22.042 -6.319 952 H LYS 122 H LYS 122 11.121 -21.093 -1.989 953 HA LYS 122 HA LYS 122 9.037 -22.014 -0.124 954 HB2 LYS 122 2HB LYS 122 10.946 -23.671 -1.011 955 HB3 LYS 122 3HB LYS 122 11.835 -22.918 0.306 956 HG2 LYS 122 2HG LYS 122 10.371 -23.734 1.924 957 HG3 LYS 122 3HG LYS 122 9.106 -24.072 0.741 958 HD2 LYS 122 2HD LYS 122 9.952 -26.184 1.209 959 HD3 LYS 122 3HD LYS 122 10.819 -25.733 -0.261 960 HE2 LYS 122 2HE LYS 122 12.810 -25.477 0.828 961 HE3 LYS 122 3HE LYS 122 12.044 -25.013 2.347 962 HZ1 LYS 122 3HZ LYS 122 11.525 -27.254 2.821 963 HZ2 LYS 122 1HZ LYS 122 13.145 -27.244 2.332 964 HZ3 LYS 122 2HZ LYS 122 11.943 -27.771 1.265 965 H GLU 123 H GLU 123 8.706 -20.201 1.045 966 HA GLU 123 HA GLU 123 10.974 -18.610 1.941 967 HB2 GLU 123 2HB GLU 123 8.692 -17.711 1.074 968 HB3 GLU 123 3HB GLU 123 8.116 -18.084 2.693 969 HG2 GLU 123 2HG GLU 123 8.713 -15.924 3.010 970 HG3 GLU 123 3HG GLU 123 10.253 -16.696 3.386 971 H ALA 124 H ALA 124 8.088 -19.973 3.540 972 HA ALA 124 HA ALA 124 9.772 -20.888 5.744 973 HB1 ALA 124 1HB ALA 124 9.240 -19.061 6.934 974 HB2 ALA 124 2HB ALA 124 7.870 -18.659 5.898 975 HB3 ALA 124 3HB ALA 124 7.692 -19.874 7.165 976 H GLY 125 H GLY 125 8.955 -22.646 6.857 977 HA2 GLY 125 2HA GLY 125 6.261 -23.536 6.633 978 HA3 GLY 125 3HA GLY 125 7.300 -24.420 5.525 979 H GLY 126 H GLY 126 7.125 -26.395 6.540 980 HA2 GLY 126 2HA GLY 126 8.846 -27.478 8.146 981 HA3 GLY 126 3HA GLY 126 7.977 -26.539 9.350 982 H LYS 127 H LYS 127 8.326 -29.486 8.932 983 HA LYS 127 HA LYS 127 5.464 -30.181 8.965 984 HB2 LYS 127 2HB LYS 127 7.638 -32.028 7.986 985 HB3 LYS 127 3HB LYS 127 5.898 -32.243 7.849 986 HG2 LYS 127 2HG LYS 127 6.425 -29.828 6.567 987 HG3 LYS 127 3HG LYS 127 7.731 -30.908 6.075 988 HD2 LYS 127 2HD LYS 127 4.787 -31.553 5.914 989 HD3 LYS 127 3HD LYS 127 5.784 -31.015 4.561 990 HE2 LYS 127 2HE LYS 127 6.332 -33.133 4.178 991 HE3 LYS 127 3HE LYS 127 7.147 -33.171 5.741 992 HZ1 LYS 127 3HZ LYS 127 4.287 -33.815 5.265 993 HZ2 LYS 127 1HZ LYS 127 5.064 -33.845 6.768 994 HZ3 LYS 127 2HZ LYS 127 5.517 -34.938 5.559 995 H GLU 128 H GLU 128 4.925 -32.062 10.267 996 HA GLU 128 HA GLU 128 4.906 -33.116 12.287 997 HB2 GLU 128 2HB GLU 128 7.866 -33.416 11.756 998 HB3 GLU 128 3HB GLU 128 6.898 -34.399 12.845 999 HG2 GLU 128 2HG GLU 128 6.869 -34.337 9.852 1000 HG3 GLU 128 3HG GLU 128 7.157 -35.702 10.929 1001 H GLU 129 H GLU 129 4.394 -31.183 13.438 1002 HA GLU 129 HA GLU 129 6.628 -30.201 15.089 1003 HB2 GLU 129 2HB GLU 129 5.704 -28.007 15.106 1004 HB3 GLU 129 3HB GLU 129 5.752 -28.524 13.427 1005 HG2 GLU 129 2HG GLU 129 3.248 -29.313 14.370 1006 HG3 GLU 129 3HG GLU 129 3.514 -27.699 15.026 1007 H GLY 130 H GLY 130 5.684 -29.050 17.130 1008 HA2 GLY 130 2HA GLY 130 3.898 -29.050 18.767 1009 HA3 GLY 130 3HA GLY 130 3.422 -30.633 18.170 1010 HA PRO 131 HA PRO 131 6.225 -30.934 21.966 1011 HB2 PRO 131 2HB PRO 131 4.372 -31.946 23.673 1012 HB3 PRO 131 3HB PRO 131 4.658 -30.212 23.484 1013 HG2 PRO 131 2HG PRO 131 2.514 -31.920 22.281 1014 HG3 PRO 131 3HG PRO 131 2.386 -30.303 22.997 1015 HD2 PRO 131 2HD PRO 131 2.478 -30.708 20.322 1016 HD3 PRO 131 3HD PRO 131 3.158 -29.261 21.092 1017 HA PRO 132 HA PRO 132 6.896 -35.246 21.431 1018 HB2 PRO 132 2HB PRO 132 7.654 -36.049 23.911 1019 HB3 PRO 132 3HB PRO 132 8.680 -35.059 22.866 1020 HG2 PRO 132 2HG PRO 132 6.928 -34.221 25.144 1021 HG3 PRO 132 3HG PRO 132 8.572 -33.690 24.743 1022 HD2 PRO 132 2HD PRO 132 6.379 -32.218 24.145 1023 HD3 PRO 132 3HD PRO 132 7.838 -32.214 23.132 1024 H GLN 133 H GLN 133 6.303 -37.448 22.248 1025 HA GLN 133 HA GLN 133 3.576 -37.409 23.358 1026 HB2 GLN 133 2HB GLN 133 4.415 -38.414 20.935 1027 HB3 GLN 133 3HB GLN 133 4.385 -39.848 21.954 1028 HG2 GLN 133 2HG GLN 133 2.082 -39.551 22.449 1029 HG3 GLN 133 3HG GLN 133 2.068 -37.950 21.711 1030 HE21 GLN 133 1HE2 GLN 133 0.353 -40.146 21.086 1031 HE22 GLN 133 2HE2 GLN 133 0.624 -40.553 19.429 1032 H ALA 134 H ALA 134 2.976 -38.991 24.866 1033 HA ALA 134 HA ALA 134 5.186 -39.959 26.486 1034 HB1 ALA 134 1HB ALA 134 2.387 -40.533 27.263 1035 HB2 ALA 134 2HB ALA 134 3.748 -39.981 28.240 1036 HB3 ALA 134 3HB ALA 134 2.878 -38.839 27.216 1037 H TYR 135 H TYR 135 6.069 -41.778 25.668 1038 HA TYR 135 HA TYR 135 4.251 -44.003 25.014 1039 HB2 TYR 135 2HB TYR 135 5.980 -44.873 23.550 1040 HB3 TYR 135 3HB TYR 135 5.635 -43.202 23.118 1041 HD1 TYR 135 HD2 TYR 135 7.250 -41.415 23.710 1042 HD2 TYR 135 HD1 TYR 135 8.136 -45.529 24.339 1043 HE1 TYR 135 HE2 TYR 135 9.637 -40.862 23.925 1044 HE2 TYR 135 HE1 TYR 135 10.525 -44.987 24.557 1045 HH TYR 135 HH TYR 135 12.007 -42.765 23.545 Start of MODEL 2 1 H21 MYR 1 1H2 MYR 1 -3.415 5.221 8.614 2 H22 MYR 1 2H2 MYR 1 -2.018 4.256 8.180 3 H31 MYR 1 1H3 MYR 1 -1.790 7.335 8.368 4 H32 MYR 1 2H3 MYR 1 -2.486 6.587 6.930 5 H41 MYR 1 1H4 MYR 1 -0.372 5.204 6.626 6 H42 MYR 1 2H4 MYR 1 0.327 5.953 8.063 7 H51 MYR 1 1H5 MYR 1 0.724 8.008 6.994 8 H52 MYR 1 2H5 MYR 1 -0.712 7.890 5.974 9 H61 MYR 1 1H6 MYR 1 1.666 5.986 5.525 10 H62 MYR 1 2H6 MYR 1 1.709 7.629 4.879 11 H71 MYR 1 1H7 MYR 1 -0.855 6.769 4.076 12 H72 MYR 1 2H7 MYR 1 0.065 5.265 3.996 13 H81 MYR 1 1H8 MYR 1 1.869 6.576 2.630 14 H82 MYR 1 2H8 MYR 1 0.722 7.916 2.550 15 H91 MYR 1 1H9 MYR 1 -0.147 6.921 0.679 16 H92 MYR 1 2H9 MYR 1 -0.880 5.727 1.750 17 H101 MYR 1 1H10 MYR 1 2.029 5.304 0.939 18 H102 MYR 1 2H10 MYR 1 0.812 5.023 -0.296 19 H111 MYR 1 1H11 MYR 1 -0.352 3.383 1.336 20 H112 MYR 1 2H11 MYR 1 0.957 3.669 2.471 21 H121 MYR 1 1H12 MYR 1 1.754 1.716 1.466 22 H122 MYR 1 2H12 MYR 1 2.568 2.918 0.465 23 H131 MYR 1 1H13 MYR 1 1.405 2.308 -1.434 24 H132 MYR 1 2H13 MYR 1 -0.150 2.313 -0.599 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 -0.251 4.148 9.774 29 HA2 GLY 2 2HA GLY 2 -1.167 4.389 12.471 30 HA3 GLY 2 3HA GLY 2 0.431 3.868 11.958 31 H ASN 3 H ASN 3 2.110 5.293 11.983 32 HA ASN 3 HA ASN 3 1.512 7.947 13.101 33 HB2 ASN 3 2HB ASN 3 3.271 5.975 13.978 34 HB3 ASN 3 3HB ASN 3 4.311 7.158 13.191 35 HD21 ASN 3 1HD2 ASN 3 4.392 9.269 13.995 36 HD22 ASN 3 2HD2 ASN 3 3.866 9.649 15.596 37 H GLY 4 H GLY 4 3.000 9.714 12.456 38 HA2 GLY 4 2HA GLY 4 3.329 9.673 9.560 39 HA3 GLY 4 3HA GLY 4 3.420 11.087 10.600 40 H ALA 5 H ALA 5 5.339 11.844 9.735 41 HA ALA 5 HA ALA 5 7.592 12.084 9.526 42 HB1 ALA 5 1HB ALA 5 9.006 11.014 11.243 43 HB2 ALA 5 2HB ALA 5 7.605 11.838 11.929 44 HB3 ALA 5 3HB ALA 5 7.608 10.081 11.780 45 H SER 6 H SER 6 6.147 9.993 7.992 46 HA SER 6 HA SER 6 6.573 8.291 6.540 47 HB2 SER 6 2HB SER 6 8.515 10.136 6.172 48 HB3 SER 6 3HB SER 6 9.502 8.734 6.583 49 HG SER 6 HG SER 6 7.547 8.876 4.528 50 H ARG 7 H ARG 7 6.577 7.632 9.331 51 HA ARG 7 HA ARG 7 8.732 5.844 9.897 52 HB2 ARG 7 2HB ARG 7 7.177 7.048 11.562 53 HB3 ARG 7 3HB ARG 7 6.031 5.759 11.219 54 HG2 ARG 7 2HG ARG 7 7.542 4.103 12.052 55 HG3 ARG 7 3HG ARG 7 8.831 5.297 12.216 56 HD2 ARG 7 2HD ARG 7 8.032 6.066 14.169 57 HD3 ARG 7 3HD ARG 7 6.358 5.992 13.622 58 HE ARG 7 HE ARG 7 7.193 3.378 14.021 59 HH11 ARG 7 1HH1 ARG 7 6.740 6.264 15.914 60 HH12 ARG 7 2HH1 ARG 7 6.372 5.406 17.373 61 HH21 ARG 7 1HH2 ARG 7 6.709 2.237 15.935 62 HH22 ARG 7 2HH2 ARG 7 6.355 3.115 17.385 63 H ASP 8 H ASP 8 5.260 5.212 9.353 64 HA ASP 8 HA ASP 8 5.474 2.449 9.072 65 HB2 ASP 8 2HB ASP 8 3.462 4.502 8.363 66 HB3 ASP 8 3HB ASP 8 3.339 2.971 7.500 67 H TRP 9 H TRP 9 6.176 5.001 6.833 68 HA TRP 9 HA TRP 9 6.097 3.425 4.461 69 HB2 TRP 9 2HB TRP 9 5.894 5.846 4.341 70 HB3 TRP 9 3HB TRP 9 7.494 6.042 5.052 71 HD1 TRP 9 HD1 TRP 9 9.605 5.599 3.473 72 HE1 TRP 9 HE1 TRP 9 9.848 5.496 0.913 73 HE3 TRP 9 HE3 TRP 9 4.674 5.123 2.207 74 HZ2 TRP 9 HZ2 TRP 9 8.173 5.247 -1.345 75 HZ3 TRP 9 HZ3 TRP 9 4.079 4.959 -0.175 76 HH2 TRP 9 HH2 TRP 9 5.794 5.020 -1.912 77 H LYS 10 H LYS 10 8.839 4.741 6.330 78 HA LYS 10 HA LYS 10 10.880 3.457 4.961 79 HB2 LYS 10 2HB LYS 10 10.573 4.844 7.492 80 HB3 LYS 10 3HB LYS 10 11.723 3.519 7.623 81 HG2 LYS 10 2HG LYS 10 12.623 4.599 5.366 82 HG3 LYS 10 3HG LYS 10 11.892 6.038 6.080 83 HD2 LYS 10 2HD LYS 10 13.744 4.275 7.653 84 HD3 LYS 10 3HD LYS 10 14.359 5.551 6.600 85 HE2 LYS 10 2HE LYS 10 12.194 6.344 8.433 86 HE3 LYS 10 3HE LYS 10 13.716 5.903 9.204 87 HZ1 LYS 10 3HZ LYS 10 13.077 8.310 7.991 88 HZ2 LYS 10 1HZ LYS 10 14.213 7.569 6.980 89 HZ3 LYS 10 2HZ LYS 10 14.579 7.837 8.609 90 H MET 11 H MET 11 8.817 2.273 7.554 91 HA MET 11 HA MET 11 10.280 -0.157 7.942 92 HB2 MET 11 2HB MET 11 7.910 1.123 9.066 93 HB3 MET 11 3HB MET 11 7.725 -0.618 8.901 94 HG2 MET 11 2HG MET 11 8.686 -0.651 10.922 95 HG3 MET 11 3HG MET 11 10.177 -0.509 9.995 96 HE1 MET 11 3HE MET 11 11.588 1.848 9.789 97 HE2 MET 11 1HE MET 11 11.799 2.432 11.440 98 HE3 MET 11 2HE MET 11 11.855 0.702 11.104 99 H ALA 12 H ALA 12 7.241 0.684 6.301 100 HA ALA 12 HA ALA 12 6.447 -1.820 5.460 101 HB1 ALA 12 1HB ALA 12 6.177 0.832 4.056 102 HB2 ALA 12 2HB ALA 12 5.339 -0.640 3.563 103 HB3 ALA 12 3HB ALA 12 5.017 0.071 5.145 104 H ILE 13 H ILE 13 8.903 0.295 4.092 105 HA ILE 13 HA ILE 13 9.324 -1.336 1.764 106 HB ILE 13 HB ILE 13 11.048 0.858 2.921 107 HG12 ILE 13 2HG1 ILE 13 8.780 1.596 2.262 108 HG13 ILE 13 3HG1 ILE 13 10.029 2.290 1.234 109 HG21 ILE 13 1HG2 ILE 13 11.367 -0.939 0.631 110 HG22 ILE 13 2HG2 ILE 13 11.573 0.770 0.250 111 HG23 ILE 13 3HG2 ILE 13 12.566 0.019 1.500 112 HD11 ILE 13 3HD1 ILE 13 9.043 -0.191 0.148 113 HD12 ILE 13 1HD1 ILE 13 7.737 0.963 0.420 114 HD13 ILE 13 2HD1 ILE 13 9.118 1.412 -0.582 115 H LYS 14 H LYS 14 11.058 -0.779 4.812 116 HA LYS 14 HA LYS 14 13.291 -2.345 4.382 117 HB2 LYS 14 2HB LYS 14 11.913 -1.222 6.665 118 HB3 LYS 14 3HB LYS 14 12.582 -2.801 7.055 119 HG2 LYS 14 2HG LYS 14 14.511 -1.252 5.606 120 HG3 LYS 14 3HG LYS 14 13.914 -0.342 6.996 121 HD2 LYS 14 2HD LYS 14 14.589 -3.193 7.439 122 HD3 LYS 14 3HD LYS 14 15.934 -2.084 7.165 123 HE2 LYS 14 2HE LYS 14 14.264 -0.758 8.956 124 HE3 LYS 14 3HE LYS 14 14.272 -2.433 9.506 125 HZ1 LYS 14 3HZ LYS 14 16.604 -0.642 9.130 126 HZ2 LYS 14 1HZ LYS 14 16.754 -2.311 9.366 127 HZ3 LYS 14 2HZ LYS 14 16.060 -1.346 10.569 128 H ARG 15 H ARG 15 10.014 -3.320 5.066 129 HA ARG 15 HA ARG 15 10.751 -6.076 5.576 130 HB2 ARG 15 2HB ARG 15 8.408 -4.423 5.950 131 HB3 ARG 15 3HB ARG 15 7.984 -5.932 5.152 132 HG2 ARG 15 2HG ARG 15 7.979 -6.913 7.134 133 HG3 ARG 15 3HG ARG 15 9.719 -6.633 7.233 134 HD2 ARG 15 2HD ARG 15 7.883 -4.401 7.938 135 HD3 ARG 15 3HD ARG 15 8.057 -5.733 9.081 136 HE ARG 15 HE ARG 15 10.570 -4.696 8.174 137 HH11 ARG 15 1HH1 ARG 15 7.974 -4.264 10.454 138 HH12 ARG 15 2HH1 ARG 15 8.955 -3.425 11.610 139 HH21 ARG 15 1HH2 ARG 15 11.871 -3.592 9.688 140 HH22 ARG 15 2HH2 ARG 15 11.171 -3.042 11.172 141 H CYS 16 H CYS 16 8.978 -4.275 3.073 142 HA CYS 16 HA CYS 16 8.443 -6.442 1.387 143 HB2 CYS 16 2HB CYS 16 7.694 -3.887 1.346 144 HB3 CYS 16 3HB CYS 16 9.007 -3.776 0.180 145 HG CYS 16 HG CYS 16 7.010 -4.069 -1.532 146 H SER 17 H SER 17 11.344 -4.630 1.923 147 HA SER 17 HA SER 17 12.706 -5.125 -0.472 148 HB2 SER 17 2HB SER 17 14.631 -4.383 0.623 149 HB3 SER 17 3HB SER 17 13.346 -3.619 1.558 150 HG SER 17 HG SER 17 15.102 -5.641 2.266 151 H ASN 18 H ASN 18 11.949 -7.198 2.182 152 HA ASN 18 HA ASN 18 13.874 -9.221 1.316 153 HB2 ASN 18 2HB ASN 18 13.237 -8.524 3.802 154 HB3 ASN 18 3HB ASN 18 11.964 -9.716 3.553 155 HD21 ASN 18 1HD2 ASN 18 14.164 -9.841 5.392 156 HD22 ASN 18 2HD2 ASN 18 15.086 -11.242 4.977 157 H VAL 19 H VAL 19 11.571 -8.480 -0.332 158 HA VAL 19 HA VAL 19 9.965 -10.939 -0.224 159 HB VAL 19 HB VAL 19 9.451 -8.363 -1.718 160 HG11 VAL 19 1HG1 VAL 19 7.761 -10.851 -1.486 161 HG12 VAL 19 2HG1 VAL 19 7.257 -9.336 -2.236 162 HG13 VAL 19 3HG1 VAL 19 8.575 -10.274 -2.940 163 HG21 VAL 19 3HG2 VAL 19 9.186 -8.624 0.898 164 HG22 VAL 19 1HG2 VAL 19 7.999 -7.743 -0.065 165 HG23 VAL 19 2HG2 VAL 19 7.676 -9.405 0.429 166 H ALA 20 H ALA 20 9.795 -12.301 -1.976 167 HA ALA 20 HA ALA 20 11.822 -11.908 -4.073 168 HB1 ALA 20 1HB ALA 20 12.262 -14.121 -4.044 169 HB2 ALA 20 2HB ALA 20 11.589 -14.013 -2.417 170 HB3 ALA 20 3HB ALA 20 10.580 -14.564 -3.754 171 H VAL 21 H VAL 21 11.308 -12.236 -6.239 172 HA VAL 21 HA VAL 21 8.815 -11.361 -7.115 173 HB VAL 21 HB VAL 21 10.742 -13.054 -8.709 174 HG11 VAL 21 1HG1 VAL 21 9.796 -11.652 -10.595 175 HG12 VAL 21 2HG1 VAL 21 8.711 -12.858 -9.899 176 HG13 VAL 21 3HG1 VAL 21 8.535 -11.157 -9.466 177 HG21 VAL 21 3HG2 VAL 21 11.049 -10.320 -9.314 178 HG22 VAL 21 1HG2 VAL 21 11.096 -10.460 -7.557 179 HG23 VAL 21 2HG2 VAL 21 12.215 -11.398 -8.547 180 H GLY 22 H GLY 22 9.898 -14.538 -6.253 181 HA2 GLY 22 2HA GLY 22 7.214 -15.565 -6.886 182 HA3 GLY 22 3HA GLY 22 8.629 -16.458 -7.426 183 H VAL 23 H VAL 23 7.464 -18.138 -6.106 184 HA VAL 23 HA VAL 23 7.572 -17.873 -3.242 185 HB VAL 23 HB VAL 23 7.138 -20.397 -4.838 186 HG11 VAL 23 1HG1 VAL 23 6.352 -19.640 -2.026 187 HG12 VAL 23 2HG1 VAL 23 5.974 -21.164 -2.831 188 HG13 VAL 23 3HG1 VAL 23 7.650 -20.745 -2.476 189 HG21 VAL 23 3HG2 VAL 23 5.488 -18.060 -4.637 190 HG22 VAL 23 1HG2 VAL 23 5.209 -19.549 -5.540 191 HG23 VAL 23 2HG2 VAL 23 4.690 -19.427 -3.859 192 H GLY 24 H GLY 24 9.645 -19.081 -5.747 193 HA2 GLY 24 2HA GLY 24 11.883 -19.264 -4.034 194 HA3 GLY 24 3HA GLY 24 11.234 -20.874 -4.308 195 H GLY 25 H GLY 25 12.599 -21.844 -5.673 196 HA2 GLY 25 2HA GLY 25 13.621 -22.329 -7.679 197 HA3 GLY 25 3HA GLY 25 12.773 -20.956 -8.377 198 H LYS 26 H LYS 26 14.115 -19.534 -9.235 199 HA LYS 26 HA LYS 26 16.554 -18.827 -7.761 200 HB2 LYS 26 2HB LYS 26 16.404 -19.388 -10.729 201 HB3 LYS 26 3HB LYS 26 17.806 -18.731 -9.896 202 HG2 LYS 26 2HG LYS 26 17.538 -20.905 -8.436 203 HG3 LYS 26 3HG LYS 26 16.706 -21.490 -9.878 204 HD2 LYS 26 2HD LYS 26 18.824 -20.510 -11.096 205 HD3 LYS 26 3HD LYS 26 19.563 -20.722 -9.507 206 HE2 LYS 26 2HE LYS 26 19.981 -22.703 -10.764 207 HE3 LYS 26 3HE LYS 26 18.767 -23.093 -9.547 208 HZ1 LYS 26 3HZ LYS 26 18.524 -23.720 -12.118 209 HZ2 LYS 26 1HZ LYS 26 17.745 -22.218 -12.120 210 HZ3 LYS 26 2HZ LYS 26 17.199 -23.452 -11.100 211 H SER 27 H SER 27 14.321 -17.331 -7.558 212 HA SER 27 HA SER 27 14.612 -15.128 -9.475 213 HB2 SER 27 2HB SER 27 12.425 -14.514 -9.018 214 HB3 SER 27 3HB SER 27 12.336 -16.259 -8.783 215 HG SER 27 HG SER 27 12.896 -15.635 -6.480 216 H LYS 28 H LYS 28 14.899 -12.989 -8.777 217 HA LYS 28 HA LYS 28 16.420 -12.761 -6.318 218 HB2 LYS 28 2HB LYS 28 15.821 -10.714 -8.462 219 HB3 LYS 28 3HB LYS 28 16.926 -10.480 -7.115 220 HG2 LYS 28 2HG LYS 28 18.550 -11.266 -8.394 221 HG3 LYS 28 3HG LYS 28 17.756 -12.842 -8.355 222 HD2 LYS 28 2HD LYS 28 16.320 -11.937 -10.286 223 HD3 LYS 28 3HD LYS 28 17.552 -10.680 -10.428 224 HE2 LYS 28 2HE LYS 28 19.142 -12.825 -10.359 225 HE3 LYS 28 3HE LYS 28 17.700 -13.576 -11.040 226 HZ1 LYS 28 3HZ LYS 28 17.990 -11.251 -12.445 227 HZ2 LYS 28 1HZ LYS 28 18.402 -12.801 -12.984 228 HZ3 LYS 28 2HZ LYS 28 19.576 -11.814 -12.273 229 H LYS 29 H LYS 29 16.041 -10.384 -5.293 230 HA LYS 29 HA LYS 29 13.220 -10.390 -4.464 231 HB2 LYS 29 2HB LYS 29 14.009 -9.237 -2.428 232 HB3 LYS 29 3HB LYS 29 14.775 -10.805 -2.646 233 HG2 LYS 29 2HG LYS 29 16.289 -8.640 -3.857 234 HG3 LYS 29 3HG LYS 29 16.054 -8.431 -2.120 235 HD2 LYS 29 2HD LYS 29 17.263 -10.302 -1.594 236 HD3 LYS 29 3HD LYS 29 16.873 -11.113 -3.112 237 HE2 LYS 29 2HE LYS 29 19.024 -10.602 -3.590 238 HE3 LYS 29 3HE LYS 29 18.311 -9.062 -4.064 239 HZ1 LYS 29 3HZ LYS 29 18.896 -8.123 -1.965 240 HZ2 LYS 29 1HZ LYS 29 20.281 -8.853 -2.607 241 HZ3 LYS 29 2HZ LYS 29 19.420 -9.616 -1.368 242 H PHE 30 H PHE 30 12.499 -8.139 -3.648 243 HA PHE 30 HA PHE 30 13.088 -6.230 -5.796 244 HB2 PHE 30 2HB PHE 30 10.746 -6.437 -3.895 245 HB3 PHE 30 3HB PHE 30 10.960 -5.130 -5.055 246 HD1 PHE 30 HD1 PHE 30 11.701 -6.270 -7.501 247 HD2 PHE 30 HD2 PHE 30 9.112 -7.898 -4.541 248 HE1 PHE 30 HE1 PHE 30 10.580 -7.617 -9.228 249 HE2 PHE 30 HE2 PHE 30 7.987 -9.249 -6.263 250 HZ PHE 30 HZ PHE 30 8.721 -9.110 -8.610 251 H GLY 31 H GLY 31 12.731 -3.851 -5.036 252 HA2 GLY 31 2HA GLY 31 13.792 -3.372 -2.356 253 HA3 GLY 31 3HA GLY 31 14.784 -2.844 -3.707 254 H GLU 32 H GLU 32 14.123 -0.917 -2.040 255 HA GLU 32 HA GLU 32 11.685 0.362 -2.237 256 HB2 GLU 32 2HB GLU 32 13.551 1.033 -0.735 257 HB3 GLU 32 3HB GLU 32 14.389 1.709 -2.124 258 HG2 GLU 32 2HG GLU 32 12.600 3.311 -2.457 259 HG3 GLU 32 3HG GLU 32 11.701 2.610 -1.113 260 H GLY 33 H GLY 33 14.416 0.440 -4.470 261 HA2 GLY 33 2HA GLY 33 13.433 2.502 -6.141 262 HA3 GLY 33 3HA GLY 33 14.632 1.298 -6.590 263 H ASN 34 H ASN 34 13.096 -1.024 -6.282 264 HA ASN 34 HA ASN 34 11.795 -1.138 -8.772 265 HB2 ASN 34 2HB ASN 34 11.576 -3.025 -6.415 266 HB3 ASN 34 3HB ASN 34 11.056 -3.384 -8.059 267 HD21 ASN 34 1HD2 ASN 34 12.582 -3.782 -9.641 268 HD22 ASN 34 2HD2 ASN 34 14.240 -4.099 -9.270 269 H PHE 35 H PHE 35 10.484 -1.060 -5.467 270 HA PHE 35 HA PHE 35 7.777 -1.186 -6.135 271 HB2 PHE 35 2HB PHE 35 8.917 0.356 -3.802 272 HB3 PHE 35 3HB PHE 35 7.328 -0.391 -3.919 273 HD1 PHE 35 HD2 PHE 35 7.942 -3.043 -4.956 274 HD2 PHE 35 HD1 PHE 35 10.000 -0.700 -2.060 275 HE1 PHE 35 HE2 PHE 35 8.833 -5.096 -3.934 276 HE2 PHE 35 HE1 PHE 35 10.895 -2.749 -1.033 277 HZ PHE 35 HZ PHE 35 10.311 -4.950 -1.969 278 H ARG 36 H ARG 36 9.905 1.621 -5.735 279 HA ARG 36 HA ARG 36 7.991 3.626 -6.062 280 HB2 ARG 36 2HB ARG 36 10.924 3.593 -6.788 281 HB3 ARG 36 3HB ARG 36 9.925 5.040 -6.810 282 HG2 ARG 36 2HG ARG 36 10.027 3.423 -4.317 283 HG3 ARG 36 3HG ARG 36 11.410 4.437 -4.734 284 HD2 ARG 36 2HD ARG 36 8.959 5.890 -5.107 285 HD3 ARG 36 3HD ARG 36 9.025 5.216 -3.479 286 HE ARG 36 HE ARG 36 11.493 6.400 -4.019 287 HH11 ARG 36 1HH1 ARG 36 8.165 7.329 -3.593 288 HH12 ARG 36 2HH1 ARG 36 8.547 8.904 -2.981 289 HH21 ARG 36 1HH2 ARG 36 12.009 8.471 -3.214 290 HH22 ARG 36 2HH2 ARG 36 10.734 9.553 -2.766 291 H TRP 37 H TRP 37 9.884 1.847 -8.460 292 HA TRP 37 HA TRP 37 9.114 3.326 -10.719 293 HB2 TRP 37 2HB TRP 37 10.974 1.813 -10.871 294 HB3 TRP 37 3HB TRP 37 9.963 0.441 -10.427 295 HD1 TRP 37 HD1 TRP 37 10.957 2.588 -13.392 296 HE1 TRP 37 HE1 TRP 37 9.995 1.551 -15.543 297 HE3 TRP 37 HE3 TRP 37 7.936 -0.966 -11.299 298 HZ2 TRP 37 HZ2 TRP 37 8.195 -0.502 -16.257 299 HZ3 TRP 37 HZ3 TRP 37 6.627 -2.426 -12.786 300 HH2 TRP 37 HH2 TRP 37 6.755 -2.196 -15.214 301 H ALA 38 H ALA 38 7.679 0.458 -9.208 302 HA ALA 38 HA ALA 38 5.621 0.138 -11.142 303 HB1 ALA 38 1HB ALA 38 4.629 -1.416 -9.550 304 HB2 ALA 38 2HB ALA 38 6.364 -1.696 -9.703 305 HB3 ALA 38 3HB ALA 38 5.728 -0.848 -8.293 306 H ILE 39 H ILE 39 5.604 1.480 -7.839 307 HA ILE 39 HA ILE 39 2.926 2.258 -7.781 308 HB ILE 39 HB ILE 39 5.262 3.586 -6.401 309 HG12 ILE 39 2HG1 ILE 39 3.353 1.583 -5.210 310 HG13 ILE 39 3HG1 ILE 39 4.824 1.075 -6.033 311 HG21 ILE 39 1HG2 ILE 39 3.579 5.124 -6.124 312 HG22 ILE 39 2HG2 ILE 39 2.308 3.903 -6.173 313 HG23 ILE 39 3HG2 ILE 39 3.306 4.079 -4.730 314 HD11 ILE 39 3HD1 ILE 39 5.984 2.731 -4.405 315 HD12 ILE 39 1HD1 ILE 39 4.504 2.550 -3.465 316 HD13 ILE 39 2HD1 ILE 39 5.490 1.136 -3.838 317 H ARG 40 H ARG 40 5.800 4.148 -8.694 318 HA ARG 40 HA ARG 40 4.485 6.543 -9.280 319 HB2 ARG 40 2HB ARG 40 7.052 5.343 -10.303 320 HB3 ARG 40 3HB ARG 40 6.498 6.931 -10.814 321 HG2 ARG 40 2HG ARG 40 6.396 6.766 -7.963 322 HG3 ARG 40 3HG ARG 40 7.990 6.268 -8.531 323 HD2 ARG 40 2HD ARG 40 8.504 8.329 -9.316 324 HD3 ARG 40 3HD ARG 40 6.844 8.672 -9.802 325 HE ARG 40 HE ARG 40 7.179 8.617 -6.960 326 HH11 ARG 40 1HH1 ARG 40 7.526 10.580 -9.814 327 HH12 ARG 40 2HH1 ARG 40 7.375 12.080 -8.959 328 HH21 ARG 40 1HH2 ARG 40 6.978 10.585 -5.824 329 HH22 ARG 40 2HH2 ARG 40 7.065 12.081 -6.689 330 H MET 41 H MET 41 5.340 3.830 -11.413 331 HA MET 41 HA MET 41 4.464 4.843 -13.825 332 HB2 MET 41 2HB MET 41 4.942 2.183 -12.702 333 HB3 MET 41 3HB MET 41 3.731 2.191 -13.977 334 HG2 MET 41 2HG MET 41 6.252 3.660 -14.477 335 HG3 MET 41 3HG MET 41 6.317 1.899 -14.465 336 HE1 MET 41 3HE MET 41 6.517 3.604 -17.934 337 HE2 MET 41 1HE MET 41 5.388 4.826 -17.349 338 HE3 MET 41 2HE MET 41 6.767 4.353 -16.356 339 H ALA 42 H ALA 42 2.573 3.046 -11.407 340 HA ALA 42 HA ALA 42 0.128 3.208 -12.846 341 HB1 ALA 42 1HB ALA 42 0.102 2.906 -9.893 342 HB2 ALA 42 2HB ALA 42 -0.795 2.026 -11.130 343 HB3 ALA 42 3HB ALA 42 0.906 1.659 -10.846 344 H ASN 43 H ASN 43 1.536 5.102 -10.204 345 HA ASN 43 HA ASN 43 -0.649 6.741 -9.650 346 HB2 ASN 43 2HB ASN 43 1.721 6.514 -8.512 347 HB3 ASN 43 3HB ASN 43 2.119 7.873 -9.559 348 HD21 ASN 43 1HD2 ASN 43 1.860 9.777 -8.669 349 HD22 ASN 43 2HD2 ASN 43 0.735 10.180 -7.421 350 H VAL 44 H VAL 44 1.490 6.709 -12.351 351 HA VAL 44 HA VAL 44 0.839 9.407 -13.191 352 HB VAL 44 HB VAL 44 2.385 7.242 -14.624 353 HG11 VAL 44 1HG1 VAL 44 3.194 9.628 -15.672 354 HG12 VAL 44 2HG1 VAL 44 2.017 8.542 -16.413 355 HG13 VAL 44 3HG1 VAL 44 1.469 9.901 -15.432 356 HG21 VAL 44 3HG2 VAL 44 3.935 9.511 -13.806 357 HG22 VAL 44 1HG2 VAL 44 3.095 8.824 -12.415 358 HG23 VAL 44 2HG2 VAL 44 4.150 7.808 -13.398 359 H SER 45 H SER 45 0.565 6.235 -14.805 360 HA SER 45 HA SER 45 -1.168 6.984 -16.816 361 HB2 SER 45 2HB SER 45 -0.166 4.532 -15.747 362 HB3 SER 45 3HB SER 45 -1.900 4.351 -16.014 363 HG SER 45 HG SER 45 0.132 4.948 -17.869 364 H THR 46 H THR 46 -1.847 6.310 -13.465 365 HA THR 46 HA THR 46 -4.687 6.924 -13.964 366 HB THR 46 HB THR 46 -5.376 5.436 -12.232 367 HG1 THR 46 HG1 THR 46 -4.026 5.147 -10.635 368 HG21 THR 46 3HG2 THR 46 -5.064 3.459 -13.321 369 HG22 THR 46 1HG2 THR 46 -3.322 3.686 -13.465 370 HG23 THR 46 2HG2 THR 46 -4.416 4.538 -14.556 371 H GLY 47 H GLY 47 -3.022 9.001 -13.527 372 HA2 GLY 47 2HA GLY 47 -4.136 10.302 -11.321 373 HA3 GLY 47 3HA GLY 47 -2.571 9.678 -10.822 374 H ARG 48 H ARG 48 -0.975 10.053 -12.948 375 HA ARG 48 HA ARG 48 0.292 11.596 -14.037 376 HB2 ARG 48 2HB ARG 48 -2.309 12.115 -14.816 377 HB3 ARG 48 3HB ARG 48 -1.732 13.687 -14.280 378 HG2 ARG 48 2HG ARG 48 0.040 13.673 -15.852 379 HG3 ARG 48 3HG ARG 48 -0.233 11.973 -16.240 380 HD2 ARG 48 2HD ARG 48 -2.637 12.876 -16.867 381 HD3 ARG 48 3HD ARG 48 -1.756 14.389 -17.073 382 HE ARG 48 HE ARG 48 -0.271 12.631 -18.481 383 HH11 ARG 48 1HH1 ARG 48 -3.667 13.394 -18.466 384 HH12 ARG 48 2HH1 ARG 48 -3.895 13.008 -20.140 385 HH21 ARG 48 1HH2 ARG 48 -0.557 12.119 -20.686 386 HH22 ARG 48 2HH2 ARG 48 -2.125 12.282 -21.401 387 H GLU 49 H GLU 49 1.253 13.773 -13.829 388 HA GLU 49 HA GLU 49 2.168 15.447 -12.589 389 HB2 GLU 49 2HB GLU 49 -0.651 15.422 -11.843 390 HB3 GLU 49 3HB GLU 49 0.377 16.034 -10.556 391 HG2 GLU 49 2HG GLU 49 1.415 17.489 -12.443 392 HG3 GLU 49 3HG GLU 49 -0.090 17.131 -13.288 393 HA PRO 50 HA PRO 50 4.135 13.657 -9.101 394 HB2 PRO 50 2HB PRO 50 4.762 15.831 -7.600 395 HB3 PRO 50 3HB PRO 50 5.581 15.443 -9.118 396 HG2 PRO 50 2HG PRO 50 3.375 17.401 -8.602 397 HG3 PRO 50 3HG PRO 50 4.829 17.591 -9.600 398 HD2 PRO 50 2HD PRO 50 2.399 17.029 -10.656 399 HD3 PRO 50 3HD PRO 50 3.912 16.441 -11.375 400 H GLY 51 H GLY 51 1.894 16.246 -8.078 401 HA2 GLY 51 2HA GLY 51 1.385 14.891 -5.565 402 HA3 GLY 51 3HA GLY 51 0.700 16.423 -6.084 403 H ASP 52 H ASP 52 0.556 12.942 -6.792 404 HA ASP 52 HA ASP 52 -2.344 13.090 -6.828 405 HB2 ASP 52 2HB ASP 52 -1.358 13.505 -9.203 406 HB3 ASP 52 3HB ASP 52 -1.023 11.776 -9.181 407 H ILE 53 H ILE 53 -1.121 11.914 -4.853 408 HA ILE 53 HA ILE 53 -1.079 9.037 -5.492 409 HB ILE 53 HB ILE 53 0.179 8.850 -3.272 410 HG12 ILE 53 2HG1 ILE 53 1.083 11.652 -3.745 411 HG13 ILE 53 3HG1 ILE 53 -0.434 11.411 -2.886 412 HG21 ILE 53 1HG2 ILE 53 2.307 9.206 -4.336 413 HG22 ILE 53 2HG2 ILE 53 1.174 8.566 -5.525 414 HG23 ILE 53 3HG2 ILE 53 1.577 10.283 -5.525 415 HD11 ILE 53 3HD1 ILE 53 2.325 10.568 -2.090 416 HD12 ILE 53 1HD1 ILE 53 1.176 11.581 -1.214 417 HD13 ILE 53 2HD1 ILE 53 0.888 9.847 -1.365 418 HA PRO 54 HA PRO 54 -4.540 8.344 -2.883 419 HB2 PRO 54 2HB PRO 54 -3.945 5.912 -1.832 420 HB3 PRO 54 3HB PRO 54 -4.431 6.138 -3.516 421 HG2 PRO 54 2HG PRO 54 -1.688 5.807 -2.364 422 HG3 PRO 54 3HG PRO 54 -2.384 5.078 -3.823 423 HD2 PRO 54 2HD PRO 54 -0.734 7.223 -3.912 424 HD3 PRO 54 3HD PRO 54 -2.042 6.975 -5.087 425 H GLU 55 H GLU 55 -4.903 7.213 -0.528 426 HA GLU 55 HA GLU 55 -2.909 7.994 1.404 427 HB2 GLU 55 2HB GLU 55 -4.124 10.124 0.848 428 HB3 GLU 55 3HB GLU 55 -5.591 9.381 1.470 429 HG2 GLU 55 2HG GLU 55 -5.055 10.109 3.484 430 HG3 GLU 55 3HG GLU 55 -3.652 9.042 3.463 431 H THR 56 H THR 56 -6.239 6.971 0.802 432 HA THR 56 HA THR 56 -6.286 5.530 3.346 433 HB THR 56 HB THR 56 -8.631 5.252 3.045 434 HG1 THR 56 HG1 THR 56 -9.483 5.125 1.113 435 HG21 THR 56 3HG2 THR 56 -7.712 7.585 3.569 436 HG22 THR 56 1HG2 THR 56 -9.390 7.475 3.040 437 HG23 THR 56 2HG2 THR 56 -8.140 7.991 1.907 438 H LEU 57 H LEU 57 -7.177 3.299 3.341 439 HA LEU 57 HA LEU 57 -5.629 1.587 1.768 440 HB2 LEU 57 2HB LEU 57 -7.557 1.359 3.859 441 HB3 LEU 57 3HB LEU 57 -7.934 0.178 2.606 442 HG LEU 57 HG LEU 57 -6.540 -0.780 4.369 443 HD11 LEU 57 1HD1 LEU 57 -5.098 -0.466 1.740 444 HD12 LEU 57 2HD1 LEU 57 -6.346 -1.656 2.107 445 HD13 LEU 57 3HD1 LEU 57 -4.794 -1.722 2.941 446 HD21 LEU 57 3HD2 LEU 57 -4.321 -0.031 4.807 447 HD22 LEU 57 1HD2 LEU 57 -5.385 1.370 4.932 448 HD23 LEU 57 2HD2 LEU 57 -4.393 1.142 3.492 449 H ASP 58 H ASP 58 -9.037 2.521 1.460 450 HA ASP 58 HA ASP 58 -9.637 0.880 -0.746 451 HB2 ASP 58 2HB ASP 58 -10.878 3.235 0.564 452 HB3 ASP 58 3HB ASP 58 -11.366 2.912 -1.097 453 H GLN 59 H GLN 59 -8.335 4.147 -0.515 454 HA GLN 59 HA GLN 59 -8.531 4.886 -3.200 455 HB2 GLN 59 2HB GLN 59 -6.832 5.710 -0.902 456 HB3 GLN 59 3HB GLN 59 -6.309 6.197 -2.509 457 HG2 GLN 59 2HG GLN 59 -9.095 6.711 -1.531 458 HG3 GLN 59 3HG GLN 59 -7.764 7.816 -1.191 459 HE21 GLN 59 1HE2 GLN 59 -9.798 8.845 -2.525 460 HE22 GLN 59 2HE2 GLN 59 -9.422 9.067 -4.196 461 H LEU 60 H LEU 60 -5.863 3.280 -1.484 462 HA LEU 60 HA LEU 60 -4.144 3.057 -3.697 463 HB2 LEU 60 2HB LEU 60 -3.330 2.772 -1.450 464 HB3 LEU 60 3HB LEU 60 -4.380 1.377 -1.207 465 HG LEU 60 HG LEU 60 -2.977 0.406 -3.222 466 HD11 LEU 60 1HD1 LEU 60 -1.378 2.701 -2.219 467 HD12 LEU 60 2HD1 LEU 60 -1.515 2.042 -3.848 468 HD13 LEU 60 3HD1 LEU 60 -0.535 1.210 -2.641 469 HD21 LEU 60 3HD2 LEU 60 -2.165 0.562 -0.330 470 HD22 LEU 60 1HD2 LEU 60 -1.347 -0.475 -1.500 471 HD23 LEU 60 2HD2 LEU 60 -3.058 -0.721 -1.148 472 H ARG 61 H ARG 61 -6.481 0.755 -2.327 473 HA ARG 61 HA ARG 61 -6.037 -1.400 -3.993 474 HB2 ARG 61 2HB ARG 61 -7.701 -1.044 -1.990 475 HB3 ARG 61 3HB ARG 61 -8.844 -0.660 -3.270 476 HG2 ARG 61 2HG ARG 61 -8.379 -2.855 -4.298 477 HG3 ARG 61 3HG ARG 61 -7.322 -3.235 -2.937 478 HD2 ARG 61 2HD ARG 61 -9.117 -4.043 -1.898 479 HD3 ARG 61 3HD ARG 61 -9.690 -2.382 -1.763 480 HE ARG 61 HE ARG 61 -10.477 -3.214 -4.254 481 HH11 ARG 61 1HH1 ARG 61 -10.979 -4.294 -0.983 482 HH12 ARG 61 2HH1 ARG 61 -12.545 -4.961 -1.306 483 HH21 ARG 61 1HH2 ARG 61 -12.538 -4.089 -4.691 484 HH22 ARG 61 2HH2 ARG 61 -13.431 -4.845 -3.415 485 H LEU 62 H LEU 62 -7.957 1.499 -4.587 486 HA LEU 62 HA LEU 62 -9.086 0.636 -7.038 487 HB2 LEU 62 2HB LEU 62 -10.079 2.441 -5.794 488 HB3 LEU 62 3HB LEU 62 -8.603 3.395 -5.927 489 HG LEU 62 HG LEU 62 -8.992 3.447 -8.416 490 HD11 LEU 62 1HD1 LEU 62 -10.542 1.485 -8.414 491 HD12 LEU 62 2HD1 LEU 62 -11.141 2.897 -9.285 492 HD13 LEU 62 3HD1 LEU 62 -11.762 2.525 -7.677 493 HD21 LEU 62 3HD2 LEU 62 -10.828 4.730 -6.427 494 HD22 LEU 62 1HD2 LEU 62 -10.984 5.066 -8.151 495 HD23 LEU 62 2HD2 LEU 62 -9.476 5.435 -7.315 496 H VAL 63 H VAL 63 -6.235 2.600 -6.259 497 HA VAL 63 HA VAL 63 -5.447 3.309 -8.817 498 HB VAL 63 HB VAL 63 -3.621 2.580 -6.522 499 HG11 VAL 63 1HG1 VAL 63 -2.148 2.783 -8.255 500 HG12 VAL 63 2HG1 VAL 63 -3.195 3.876 -9.163 501 HG13 VAL 63 3HG1 VAL 63 -2.278 4.476 -7.781 502 HG21 VAL 63 3HG2 VAL 63 -5.542 4.632 -6.712 503 HG22 VAL 63 1HG2 VAL 63 -4.298 4.420 -5.480 504 HG23 VAL 63 2HG2 VAL 63 -3.964 5.394 -6.911 505 H ILE 64 H ILE 64 -4.809 0.321 -7.035 506 HA ILE 64 HA ILE 64 -3.053 -0.829 -8.921 507 HB ILE 64 HB ILE 64 -4.883 -2.266 -6.995 508 HG12 ILE 64 2HG1 ILE 64 -2.000 -1.454 -6.590 509 HG13 ILE 64 3HG1 ILE 64 -3.367 -0.539 -5.964 510 HG21 ILE 64 1HG2 ILE 64 -2.337 -3.156 -8.345 511 HG22 ILE 64 2HG2 ILE 64 -3.249 -4.080 -7.153 512 HG23 ILE 64 3HG2 ILE 64 -3.965 -3.719 -8.723 513 HD11 ILE 64 3HD1 ILE 64 -2.457 -3.288 -5.193 514 HD12 ILE 64 1HD1 ILE 64 -2.605 -1.851 -4.181 515 HD13 ILE 64 2HD1 ILE 64 -4.053 -2.666 -4.774 516 H CYS 65 H CYS 65 -6.508 -1.494 -8.322 517 HA CYS 65 HA CYS 65 -6.908 -3.212 -10.477 518 HB2 CYS 65 2HB CYS 65 -8.686 -1.493 -8.807 519 HB3 CYS 65 3HB CYS 65 -9.352 -2.189 -10.280 520 HG CYS 65 HG CYS 65 -8.798 -4.839 -9.518 521 H ASP 66 H ASP 66 -6.981 0.298 -10.313 522 HA ASP 66 HA ASP 66 -8.127 0.814 -12.820 523 HB2 ASP 66 2HB ASP 66 -7.576 2.432 -10.864 524 HB3 ASP 66 3HB ASP 66 -5.999 2.574 -11.636 525 H LEU 67 H LEU 67 -4.692 0.662 -11.883 526 HA LEU 67 HA LEU 67 -3.693 1.002 -14.504 527 HB2 LEU 67 2HB LEU 67 -2.315 1.447 -12.578 528 HB3 LEU 67 3HB LEU 67 -2.447 -0.230 -12.053 529 HG LEU 67 HG LEU 67 -1.295 -0.715 -14.363 530 HD11 LEU 67 1HD1 LEU 67 -1.078 2.186 -14.074 531 HD12 LEU 67 2HD1 LEU 67 -0.882 1.167 -15.499 532 HD13 LEU 67 3HD1 LEU 67 0.459 1.373 -14.372 533 HD21 LEU 67 3HD2 LEU 67 0.944 -0.036 -13.038 534 HD22 LEU 67 1HD2 LEU 67 -0.022 -1.462 -12.657 535 HD23 LEU 67 2HD2 LEU 67 -0.222 0.015 -11.714 536 H GLN 68 H GLN 68 -4.176 -1.904 -12.513 537 HA GLN 68 HA GLN 68 -3.218 -3.769 -14.366 538 HB2 GLN 68 2HB GLN 68 -3.708 -4.208 -11.949 539 HB3 GLN 68 3HB GLN 68 -5.421 -4.218 -12.348 540 HG2 GLN 68 2HG GLN 68 -4.833 -6.059 -14.020 541 HG3 GLN 68 3HG GLN 68 -3.299 -6.169 -13.158 542 HE21 GLN 68 1HE2 GLN 68 -5.151 -8.259 -13.348 543 HE22 GLN 68 2HE2 GLN 68 -5.759 -8.595 -11.766 544 H GLU 69 H GLU 69 -6.311 -2.168 -14.087 545 HA GLU 69 HA GLU 69 -7.739 -3.885 -15.848 546 HB2 GLU 69 2HB GLU 69 -8.201 -1.208 -14.628 547 HB3 GLU 69 3HB GLU 69 -9.161 -1.638 -16.036 548 HG2 GLU 69 2HG GLU 69 -8.959 -3.502 -13.709 549 HG3 GLU 69 3HG GLU 69 -10.078 -2.140 -13.682 550 H ARG 70 H ARG 70 -6.595 -0.540 -16.347 551 HA ARG 70 HA ARG 70 -7.035 -0.479 -19.104 552 HB2 ARG 70 2HB ARG 70 -5.821 1.211 -17.126 553 HB3 ARG 70 3HB ARG 70 -4.802 1.167 -18.558 554 HG2 ARG 70 2HG ARG 70 -6.714 1.825 -19.936 555 HG3 ARG 70 3HG ARG 70 -7.727 1.880 -18.492 556 HD2 ARG 70 2HD ARG 70 -6.917 4.108 -19.182 557 HD3 ARG 70 3HD ARG 70 -6.385 3.655 -17.564 558 HE ARG 70 HE ARG 70 -4.223 3.727 -18.301 559 HH11 ARG 70 1HH1 ARG 70 -6.350 3.551 -21.052 560 HH12 ARG 70 2HH1 ARG 70 -5.084 3.792 -22.211 561 HH21 ARG 70 1HH2 ARG 70 -2.548 4.045 -19.817 562 HH22 ARG 70 2HH2 ARG 70 -2.922 4.072 -21.507 563 H ARG 71 H ARG 71 -4.048 -1.183 -17.303 564 HA ARG 71 HA ARG 71 -2.345 -1.580 -19.455 565 HB2 ARG 71 2HB ARG 71 -2.402 -2.853 -16.721 566 HB3 ARG 71 3HB ARG 71 -1.105 -3.138 -17.874 567 HG2 ARG 71 2HG ARG 71 -1.898 -0.418 -16.860 568 HG3 ARG 71 3HG ARG 71 -0.599 -1.400 -16.179 569 HD2 ARG 71 2HD ARG 71 0.807 -0.678 -17.739 570 HD3 ARG 71 3HD ARG 71 -0.271 -1.252 -19.011 571 HE ARG 71 HE ARG 71 -1.068 1.264 -17.876 572 HH11 ARG 71 1HH1 ARG 71 0.940 -0.292 -20.257 573 HH12 ARG 71 2HH1 ARG 71 1.027 1.100 -21.284 574 HH21 ARG 71 1HH2 ARG 71 -0.962 3.103 -19.221 575 HH22 ARG 71 2HH2 ARG 71 -0.055 3.031 -20.694 576 H GLU 72 H GLU 72 -4.507 -3.889 -17.857 577 HA GLU 72 HA GLU 72 -3.742 -6.190 -19.235 578 HB2 GLU 72 2HB GLU 72 -6.158 -5.317 -17.752 579 HB3 GLU 72 3HB GLU 72 -6.353 -6.688 -18.835 580 HG2 GLU 72 2HG GLU 72 -4.108 -6.639 -16.869 581 HG3 GLU 72 3HG GLU 72 -5.734 -7.083 -16.354 582 H LYS 73 H LYS 73 -6.293 -3.840 -20.012 583 HA LYS 73 HA LYS 73 -7.281 -5.044 -22.312 584 HB2 LYS 73 2HB LYS 73 -7.333 -2.362 -21.128 585 HB3 LYS 73 3HB LYS 73 -7.479 -2.361 -22.881 586 HG2 LYS 73 2HG LYS 73 -9.502 -3.417 -22.854 587 HG3 LYS 73 3HG LYS 73 -9.176 -4.242 -21.328 588 HD2 LYS 73 2HD LYS 73 -10.459 -2.698 -20.355 589 HD3 LYS 73 3HD LYS 73 -9.154 -1.549 -20.662 590 HE2 LYS 73 2HE LYS 73 -10.616 -0.397 -21.887 591 HE3 LYS 73 3HE LYS 73 -10.507 -1.695 -23.075 592 HZ1 LYS 73 3HZ LYS 73 -12.770 -1.479 -22.649 593 HZ2 LYS 73 1HZ LYS 73 -12.552 -1.288 -20.982 594 HZ3 LYS 73 2HZ LYS 73 -12.320 -2.803 -21.697 595 H PHE 74 H PHE 74 -4.532 -2.859 -21.911 596 HA PHE 74 HA PHE 74 -3.967 -2.660 -24.701 597 HB2 PHE 74 2HB PHE 74 -3.259 -1.067 -22.787 598 HB3 PHE 74 3HB PHE 74 -1.938 -2.202 -22.529 599 HD1 PHE 74 HD1 PHE 74 -0.243 -2.548 -24.282 600 HD2 PHE 74 HD2 PHE 74 -3.269 0.425 -24.635 601 HE1 PHE 74 HE1 PHE 74 1.055 -1.442 -26.055 602 HE2 PHE 74 HE2 PHE 74 -1.975 1.536 -26.409 603 HZ PHE 74 HZ PHE 74 0.189 0.602 -27.122 604 H GLY 75 H GLY 75 -3.153 -4.912 -22.194 605 HA2 GLY 75 2HA GLY 75 -2.526 -7.118 -23.400 606 HA3 GLY 75 3HA GLY 75 -1.130 -6.180 -23.910 607 H SER 76 H SER 76 -0.691 -8.476 -22.559 608 HA SER 76 HA SER 76 -0.148 -7.685 -19.783 609 HB2 SER 76 2HB SER 76 -0.590 -10.304 -21.143 610 HB3 SER 76 3HB SER 76 0.461 -10.273 -19.726 611 HG SER 76 HG SER 76 -1.391 -9.043 -18.750 612 H SER 77 H SER 77 1.913 -7.964 -18.875 613 HA SER 77 HA SER 77 4.143 -8.864 -20.419 614 HB2 SER 77 2HB SER 77 5.181 -6.890 -21.002 615 HB3 SER 77 3HB SER 77 3.495 -6.403 -21.175 616 HG SER 77 HG SER 77 5.131 -5.105 -19.814 617 H LYS 78 H LYS 78 6.070 -8.990 -19.203 618 HA LYS 78 HA LYS 78 5.808 -9.598 -16.524 619 HB2 LYS 78 2HB LYS 78 8.288 -8.663 -17.981 620 HB3 LYS 78 3HB LYS 78 8.280 -9.455 -16.411 621 HG2 LYS 78 2HG LYS 78 7.137 -10.726 -18.881 622 HG3 LYS 78 3HG LYS 78 8.823 -10.911 -18.392 623 HD2 LYS 78 2HD LYS 78 6.841 -11.431 -16.280 624 HD3 LYS 78 3HD LYS 78 6.813 -12.567 -17.631 625 HE2 LYS 78 2HE LYS 78 9.414 -12.565 -17.266 626 HE3 LYS 78 3HE LYS 78 8.975 -12.012 -15.651 627 HZ1 LYS 78 3HZ LYS 78 7.961 -14.488 -16.941 628 HZ2 LYS 78 1HZ LYS 78 7.610 -13.967 -15.370 629 HZ3 LYS 78 2HZ LYS 78 9.186 -14.428 -15.776 630 H GLU 79 H GLU 79 6.625 -6.521 -18.027 631 HA GLU 79 HA GLU 79 7.387 -5.156 -15.680 632 HB2 GLU 79 2HB GLU 79 6.151 -4.014 -18.192 633 HB3 GLU 79 3HB GLU 79 7.039 -3.111 -16.973 634 HG2 GLU 79 2HG GLU 79 8.256 -5.366 -18.539 635 HG3 GLU 79 3HG GLU 79 8.297 -3.687 -19.076 636 H ILE 80 H ILE 80 4.267 -5.471 -17.331 637 HA ILE 80 HA ILE 80 2.840 -3.763 -15.576 638 HB ILE 80 HB ILE 80 1.791 -6.000 -17.314 639 HG12 ILE 80 2HG1 ILE 80 1.792 -3.040 -17.902 640 HG13 ILE 80 3HG1 ILE 80 3.087 -4.109 -18.430 641 HG21 ILE 80 1HG2 ILE 80 0.213 -5.369 -15.567 642 HG22 ILE 80 2HG2 ILE 80 0.351 -3.677 -16.041 643 HG23 ILE 80 3HG2 ILE 80 -0.360 -4.848 -17.151 644 HD11 ILE 80 3HD1 ILE 80 1.485 -5.419 -19.715 645 HD12 ILE 80 1HD1 ILE 80 0.185 -4.355 -19.181 646 HD13 ILE 80 2HD1 ILE 80 1.477 -3.725 -20.203 647 H ASP 81 H ASP 81 2.865 -7.322 -15.838 648 HA ASP 81 HA ASP 81 1.303 -7.887 -13.622 649 HB2 ASP 81 2HB ASP 81 2.580 -9.394 -15.481 650 HB3 ASP 81 3HB ASP 81 3.580 -9.716 -14.068 651 H MET 82 H MET 82 4.794 -7.338 -13.809 652 HA MET 82 HA MET 82 5.408 -7.953 -11.140 653 HB2 MET 82 2HB MET 82 7.163 -7.764 -12.781 654 HB3 MET 82 3HB MET 82 6.753 -6.083 -13.094 655 HG2 MET 82 2HG MET 82 7.332 -6.518 -10.301 656 HG3 MET 82 3HG MET 82 8.663 -7.046 -11.328 657 HE1 MET 82 3HE MET 82 9.481 -5.524 -13.377 658 HE2 MET 82 1HE MET 82 10.070 -3.934 -12.890 659 HE3 MET 82 2HE MET 82 10.541 -5.367 -11.976 660 H ALA 83 H ALA 83 4.458 -4.910 -12.680 661 HA ALA 83 HA ALA 83 4.822 -3.197 -10.514 662 HB1 ALA 83 1HB ALA 83 3.072 -3.147 -12.927 663 HB2 ALA 83 2HB ALA 83 2.835 -1.939 -11.664 664 HB3 ALA 83 3HB ALA 83 4.397 -2.075 -12.472 665 H ILE 84 H ILE 84 1.946 -5.066 -11.452 666 HA ILE 84 HA ILE 84 0.286 -4.170 -9.363 667 HB ILE 84 HB ILE 84 0.138 -6.860 -10.722 668 HG12 ILE 84 2HG1 ILE 84 0.252 -5.117 -12.418 669 HG13 ILE 84 3HG1 ILE 84 -1.387 -5.751 -12.328 670 HG21 ILE 84 1HG2 ILE 84 -1.397 -6.970 -9.017 671 HG22 ILE 84 2HG2 ILE 84 -1.723 -5.237 -9.054 672 HG23 ILE 84 3HG2 ILE 84 -2.382 -6.285 -10.310 673 HD11 ILE 84 3HD1 ILE 84 -0.365 -3.138 -11.259 674 HD12 ILE 84 1HD1 ILE 84 -1.543 -3.401 -12.545 675 HD13 ILE 84 2HD1 ILE 84 -1.957 -3.793 -10.875 676 H VAL 85 H VAL 85 2.511 -6.904 -9.607 677 HA VAL 85 HA VAL 85 1.838 -8.214 -7.232 678 HB VAL 85 HB VAL 85 4.550 -8.033 -8.551 679 HG11 VAL 85 1HG1 VAL 85 4.820 -10.299 -7.397 680 HG12 VAL 85 2HG1 VAL 85 4.947 -8.854 -6.392 681 HG13 VAL 85 3HG1 VAL 85 3.462 -9.807 -6.387 682 HG21 VAL 85 3HG2 VAL 85 3.760 -9.372 -10.138 683 HG22 VAL 85 1HG2 VAL 85 3.205 -10.527 -8.926 684 HG23 VAL 85 2HG2 VAL 85 2.148 -9.212 -9.441 685 H THR 86 H THR 86 4.335 -5.748 -7.824 686 HA THR 86 HA THR 86 5.321 -5.590 -5.215 687 HB THR 86 HB THR 86 6.166 -3.358 -5.820 688 HG1 THR 86 HG1 THR 86 4.867 -2.304 -7.133 689 HG21 THR 86 3HG2 THR 86 6.628 -4.781 -8.350 690 HG22 THR 86 1HG2 THR 86 6.913 -5.741 -6.900 691 HG23 THR 86 2HG2 THR 86 7.779 -4.223 -7.137 692 H LEU 87 H LEU 87 2.691 -3.802 -6.783 693 HA LEU 87 HA LEU 87 2.120 -2.030 -4.700 694 HB2 LEU 87 2HB LEU 87 0.975 -2.776 -7.187 695 HB3 LEU 87 3HB LEU 87 -0.306 -2.792 -5.976 696 HG LEU 87 HG LEU 87 -0.083 -0.646 -7.225 697 HD11 LEU 87 1HD1 LEU 87 -1.019 0.298 -5.450 698 HD12 LEU 87 2HD1 LEU 87 0.520 0.331 -4.590 699 HD13 LEU 87 3HD1 LEU 87 -0.510 -1.098 -4.500 700 HD21 LEU 87 3HD2 LEU 87 1.758 0.773 -6.947 701 HD22 LEU 87 1HD2 LEU 87 2.467 -0.813 -7.251 702 HD23 LEU 87 2HD2 LEU 87 2.402 -0.177 -5.607 703 H LYS 88 H LYS 88 1.103 -5.351 -5.251 704 HA LYS 88 HA LYS 88 -0.803 -5.407 -3.124 705 HB2 LYS 88 2HB LYS 88 -0.246 -7.039 -5.250 706 HB3 LYS 88 3HB LYS 88 0.408 -7.969 -3.909 707 HG2 LYS 88 2HG LYS 88 -1.617 -8.585 -3.250 708 HG3 LYS 88 3HG LYS 88 -2.201 -6.919 -3.266 709 HD2 LYS 88 2HD LYS 88 -1.922 -8.612 -5.744 710 HD3 LYS 88 3HD LYS 88 -3.413 -8.494 -4.806 711 HE2 LYS 88 2HE LYS 88 -3.221 -5.976 -5.121 712 HE3 LYS 88 3HE LYS 88 -1.987 -6.329 -6.329 713 HZ1 LYS 88 3HZ LYS 88 -4.379 -7.867 -6.693 714 HZ2 LYS 88 1HZ LYS 88 -3.522 -6.925 -7.806 715 HZ3 LYS 88 2HZ LYS 88 -4.659 -6.202 -6.785 716 H VAL 89 H VAL 89 2.374 -7.000 -3.472 717 HA VAL 89 HA VAL 89 2.632 -7.909 -0.870 718 HB VAL 89 HB VAL 89 4.906 -6.911 -2.589 719 HG11 VAL 89 1HG1 VAL 89 4.981 -7.780 -0.007 720 HG12 VAL 89 2HG1 VAL 89 5.270 -9.275 -0.900 721 HG13 VAL 89 3HG1 VAL 89 6.323 -7.881 -1.147 722 HG21 VAL 89 3HG2 VAL 89 4.450 -8.532 -4.037 723 HG22 VAL 89 1HG2 VAL 89 4.621 -9.721 -2.746 724 HG23 VAL 89 2HG2 VAL 89 3.044 -9.010 -3.086 725 H PHE 90 H PHE 90 3.522 -4.765 -2.229 726 HA PHE 90 HA PHE 90 4.727 -3.761 0.134 727 HB2 PHE 90 2HB PHE 90 5.284 -2.716 -1.943 728 HB3 PHE 90 3HB PHE 90 3.591 -2.394 -2.306 729 HD1 PHE 90 HD2 PHE 90 5.533 -1.809 0.813 730 HD2 PHE 90 HD1 PHE 90 3.394 -0.096 -2.445 731 HE1 PHE 90 HE2 PHE 90 5.738 0.412 1.851 732 HE2 PHE 90 HE1 PHE 90 3.597 2.128 -1.412 733 HZ PHE 90 HZ PHE 90 4.769 2.384 0.739 734 H ALA 91 H ALA 91 1.451 -3.707 -1.138 735 HA ALA 91 HA ALA 91 0.381 -1.837 0.691 736 HB1 ALA 91 1HB ALA 91 -1.807 -2.736 0.015 737 HB2 ALA 91 2HB ALA 91 -0.770 -2.386 -1.369 738 HB3 ALA 91 3HB ALA 91 -0.990 -4.051 -0.831 739 H VAL 92 H VAL 92 0.454 -5.392 0.702 740 HA VAL 92 HA VAL 92 -0.850 -5.602 3.242 741 HB VAL 92 HB VAL 92 0.792 -7.721 1.854 742 HG11 VAL 92 1HG1 VAL 92 -0.339 -7.719 4.357 743 HG12 VAL 92 2HG1 VAL 92 -1.568 -8.513 3.370 744 HG13 VAL 92 3HG1 VAL 92 0.076 -9.151 3.415 745 HG21 VAL 92 3HG2 VAL 92 -1.805 -6.559 1.173 746 HG22 VAL 92 1HG2 VAL 92 -0.709 -7.540 0.200 747 HG23 VAL 92 2HG2 VAL 92 -1.823 -8.316 1.325 748 H ALA 93 H ALA 93 2.471 -6.400 2.200 749 HA ALA 93 HA ALA 93 3.504 -6.786 4.777 750 HB1 ALA 93 1HB ALA 93 5.652 -6.791 3.780 751 HB2 ALA 93 2HB ALA 93 4.549 -7.490 2.594 752 HB3 ALA 93 3HB ALA 93 5.098 -5.824 2.413 753 H GLY 94 H GLY 94 2.683 -3.911 3.104 754 HA2 GLY 94 2HA GLY 94 4.380 -2.260 4.836 755 HA3 GLY 94 3HA GLY 94 3.496 -1.701 3.425 756 H LEU 95 H LEU 95 1.065 -1.800 3.636 757 HA LEU 95 HA LEU 95 0.241 -0.232 5.799 758 HB2 LEU 95 2HB LEU 95 -1.593 -1.967 4.169 759 HB3 LEU 95 3HB LEU 95 -1.958 -0.429 4.949 760 HG LEU 95 HG LEU 95 -0.265 -0.867 2.493 761 HD11 LEU 95 1HD1 LEU 95 -2.360 1.029 2.188 762 HD12 LEU 95 2HD1 LEU 95 -3.036 -0.446 2.876 763 HD13 LEU 95 3HD1 LEU 95 -2.135 -0.513 1.362 764 HD21 LEU 95 3HD2 LEU 95 0.848 0.944 3.218 765 HD22 LEU 95 1HD2 LEU 95 -0.399 1.368 4.392 766 HD23 LEU 95 2HD2 LEU 95 -0.594 1.818 2.698 767 H LEU 96 H LEU 96 -0.153 -3.706 5.201 768 HA LEU 96 HA LEU 96 -1.395 -4.080 7.801 769 HB2 LEU 96 2HB LEU 96 -1.658 -5.358 5.397 770 HB3 LEU 96 3HB LEU 96 -0.620 -6.466 6.293 771 HG LEU 96 HG LEU 96 -2.357 -6.457 8.112 772 HD11 LEU 96 1HD1 LEU 96 -4.474 -5.552 7.779 773 HD12 LEU 96 2HD1 LEU 96 -4.223 -5.352 6.046 774 HD13 LEU 96 3HD1 LEU 96 -3.390 -4.294 7.185 775 HD21 LEU 96 3HD2 LEU 96 -4.039 -7.748 6.521 776 HD22 LEU 96 1HD2 LEU 96 -2.455 -8.405 6.936 777 HD23 LEU 96 2HD2 LEU 96 -2.695 -7.591 5.389 778 H ASN 97 H ASN 97 1.684 -3.701 6.767 779 HA ASN 97 HA ASN 97 3.750 -4.262 7.547 780 HB2 ASN 97 2HB ASN 97 2.193 -3.508 9.687 781 HB3 ASN 97 3HB ASN 97 2.845 -5.055 10.221 782 HD21 ASN 97 1HD2 ASN 97 3.611 -1.807 9.233 783 HD22 ASN 97 2HD2 ASN 97 5.228 -1.791 9.841 784 H MET 98 H MET 98 2.130 -6.401 6.384 785 HA MET 98 HA MET 98 2.391 -8.801 7.827 786 HB2 MET 98 2HB MET 98 1.437 -8.005 5.284 787 HB3 MET 98 3HB MET 98 2.610 -9.285 5.009 788 HG2 MET 98 2HG MET 98 0.498 -9.635 7.084 789 HG3 MET 98 3HG MET 98 0.105 -9.858 5.381 790 HE1 MET 98 3HE MET 98 0.955 -11.339 8.466 791 HE2 MET 98 1HE MET 98 -0.133 -12.420 7.594 792 HE3 MET 98 2HE MET 98 1.467 -12.982 8.078 793 H THR 99 H THR 99 3.841 -10.590 7.396 794 HA THR 99 HA THR 99 6.557 -9.650 6.764 795 HB THR 99 HB THR 99 6.333 -10.477 9.047 796 HG1 THR 99 HG1 THR 99 8.223 -11.019 7.593 797 HG21 THR 99 3HG2 THR 99 4.892 -12.126 9.472 798 HG22 THR 99 1HG2 THR 99 6.043 -13.245 8.744 799 HG23 THR 99 2HG2 THR 99 4.767 -12.529 7.760 800 H VAL 100 H VAL 100 5.070 -10.199 4.572 801 HA VAL 100 HA VAL 100 5.536 -12.949 3.753 802 HB VAL 100 HB VAL 100 4.486 -12.230 1.606 803 HG11 VAL 100 1HG1 VAL 100 2.496 -11.310 3.536 804 HG12 VAL 100 2HG1 VAL 100 2.476 -12.713 2.465 805 HG13 VAL 100 3HG1 VAL 100 3.314 -12.797 4.016 806 HG21 VAL 100 3HG2 VAL 100 3.260 -9.826 2.433 807 HG22 VAL 100 1HG2 VAL 100 4.993 -9.640 2.697 808 HG23 VAL 100 2HG2 VAL 100 4.386 -10.069 1.098 809 H SER 101 H SER 101 7.164 -13.636 2.502 810 HA SER 101 HA SER 101 8.989 -11.603 1.396 811 HB2 SER 101 2HB SER 101 9.512 -14.244 2.721 812 HB3 SER 101 3HB SER 101 10.670 -13.605 1.554 813 HG SER 101 HG SER 101 9.740 -12.252 3.871 814 H THR 102 H THR 102 6.598 -13.211 0.295 815 HA THR 102 HA THR 102 7.877 -13.822 -2.255 816 HB THR 102 HB THR 102 6.905 -15.978 -2.513 817 HG1 THR 102 HG1 THR 102 5.364 -16.774 -1.180 818 HG21 THR 102 3HG2 THR 102 8.977 -15.825 -1.110 819 HG22 THR 102 1HG2 THR 102 8.000 -17.263 -0.814 820 HG23 THR 102 2HG2 THR 102 7.947 -15.911 0.318 821 H ALA 103 H ALA 103 6.692 -13.161 -3.947 822 HA ALA 103 HA ALA 103 4.496 -11.511 -3.696 823 HB1 ALA 103 1HB ALA 103 4.107 -12.119 -6.171 824 HB2 ALA 103 2HB ALA 103 5.631 -11.355 -5.718 825 HB3 ALA 103 3HB ALA 103 5.566 -13.095 -6.002 826 H ALA 104 H ALA 104 4.616 -14.994 -3.936 827 HA ALA 104 HA ALA 104 1.876 -15.412 -4.547 828 HB1 ALA 104 1HB ALA 104 2.293 -17.734 -3.849 829 HB2 ALA 104 2HB ALA 104 3.524 -17.137 -4.963 830 HB3 ALA 104 3HB ALA 104 3.876 -17.251 -3.239 831 H ALA 105 H ALA 105 3.689 -15.173 -1.529 832 HA ALA 105 HA ALA 105 1.574 -15.949 0.186 833 HB1 ALA 105 1HB ALA 105 2.935 -15.087 1.982 834 HB2 ALA 105 2HB ALA 105 3.957 -15.959 0.839 835 HB3 ALA 105 3HB ALA 105 3.938 -14.195 0.838 836 H ALA 106 H ALA 106 2.668 -12.820 -1.038 837 HA ALA 106 HA ALA 106 1.006 -11.196 0.547 838 HB1 ALA 106 1HB ALA 106 2.668 -9.993 -0.482 839 HB2 ALA 106 2HB ALA 106 2.467 -10.825 -2.024 840 HB3 ALA 106 3HB ALA 106 1.294 -9.609 -1.519 841 H GLU 107 H GLU 107 0.561 -12.318 -2.812 842 HA GLU 107 HA GLU 107 -1.970 -11.241 -3.225 843 HB2 GLU 107 2HB GLU 107 -0.314 -12.482 -4.841 844 HB3 GLU 107 3HB GLU 107 -1.255 -13.900 -4.398 845 HG2 GLU 107 2HG GLU 107 -3.003 -13.282 -5.642 846 HG3 GLU 107 3HG GLU 107 -2.875 -11.591 -5.161 847 H ASN 108 H ASN 108 -1.045 -14.393 -1.898 848 HA ASN 108 HA ASN 108 -3.613 -15.480 -1.661 849 HB2 ASN 108 2HB ASN 108 -1.228 -16.530 -1.289 850 HB3 ASN 108 3HB ASN 108 -1.515 -16.079 0.389 851 HD21 ASN 108 1HD2 ASN 108 -2.095 -18.346 -2.039 852 HD22 ASN 108 2HD2 ASN 108 -3.237 -19.329 -1.192 853 H MET 109 H MET 109 -1.797 -13.331 0.449 854 HA MET 109 HA MET 109 -3.664 -13.477 2.615 855 HB2 MET 109 2HB MET 109 -1.369 -12.905 3.089 856 HB3 MET 109 3HB MET 109 -1.439 -11.530 1.994 857 HG2 MET 109 2HG MET 109 -1.551 -10.833 4.322 858 HG3 MET 109 3HG MET 109 -3.024 -10.418 3.449 859 HE1 MET 109 3HE MET 109 -3.977 -10.235 6.435 860 HE2 MET 109 1HE MET 109 -4.720 -10.134 4.838 861 HE3 MET 109 2HE MET 109 -5.392 -11.219 6.056 862 H TYR 110 H TYR 110 -2.900 -10.969 0.199 863 HA TYR 110 HA TYR 110 -4.842 -9.123 0.923 864 HB2 TYR 110 2HB TYR 110 -2.916 -9.077 -0.897 865 HB3 TYR 110 3HB TYR 110 -4.238 -9.512 -1.975 866 HD1 TYR 110 HD2 TYR 110 -3.854 -7.139 0.895 867 HD2 TYR 110 HD1 TYR 110 -5.028 -7.703 -3.155 868 HE1 TYR 110 HE2 TYR 110 -4.518 -4.774 0.764 869 HE2 TYR 110 HE1 TYR 110 -5.695 -5.340 -3.298 870 HH TYR 110 HH TYR 110 -6.007 -3.350 -0.561 871 H SER 111 H SER 111 -5.132 -12.094 -0.868 872 HA SER 111 HA SER 111 -7.819 -11.500 -1.777 873 HB2 SER 111 2HB SER 111 -6.195 -12.856 -3.134 874 HB3 SER 111 3HB SER 111 -6.332 -14.131 -1.923 875 HG SER 111 HG SER 111 -7.827 -14.649 -3.418 876 H GLN 112 H GLN 112 -6.252 -13.656 0.558 877 HA GLN 112 HA GLN 112 -8.519 -15.017 1.444 878 HB2 GLN 112 2HB GLN 112 -5.817 -14.469 2.528 879 HB3 GLN 112 3HB GLN 112 -7.039 -14.953 3.696 880 HG2 GLN 112 2HG GLN 112 -7.479 -16.837 1.884 881 HG3 GLN 112 3HG GLN 112 -5.794 -16.495 1.496 882 HE21 GLN 112 1HE2 GLN 112 -6.722 -18.943 2.496 883 HE22 GLN 112 2HE2 GLN 112 -6.030 -19.188 4.060 884 H MET 113 H MET 113 -7.341 -11.821 2.192 885 HA MET 113 HA MET 113 -9.064 -11.447 4.463 886 HB2 MET 113 2HB MET 113 -6.821 -10.271 3.971 887 HB3 MET 113 3HB MET 113 -7.756 -9.235 2.901 888 HG2 MET 113 2HG MET 113 -7.699 -8.033 4.869 889 HG3 MET 113 3HG MET 113 -9.262 -8.843 4.947 890 HE1 MET 113 3HE MET 113 -9.063 -11.464 7.468 891 HE2 MET 113 1HE MET 113 -9.791 -9.878 7.729 892 HE3 MET 113 2HE MET 113 -9.887 -10.642 6.142 893 H GLY 114 H GLY 114 -9.263 -10.957 1.030 894 HA2 GLY 114 2HA GLY 114 -11.407 -10.825 -0.037 895 HA3 GLY 114 3HA GLY 114 -12.024 -10.004 1.389 896 H LEU 115 H LEU 115 -8.941 -9.027 0.211 897 HA LEU 115 HA LEU 115 -10.105 -6.477 -0.632 898 HB2 LEU 115 2HB LEU 115 -7.187 -7.093 -0.266 899 HB3 LEU 115 3HB LEU 115 -7.969 -5.514 -0.304 900 HG LEU 115 HG LEU 115 -8.383 -7.540 1.890 901 HD11 LEU 115 1HD1 LEU 115 -6.063 -6.894 1.894 902 HD12 LEU 115 2HD1 LEU 115 -6.894 -6.092 3.226 903 HD13 LEU 115 3HD1 LEU 115 -6.500 -5.190 1.762 904 HD21 LEU 115 3HD2 LEU 115 -8.818 -4.869 2.700 905 HD22 LEU 115 1HD2 LEU 115 -9.997 -6.172 2.551 906 HD23 LEU 115 2HD2 LEU 115 -9.685 -5.105 1.181 907 H ASP 116 H ASP 116 -8.377 -9.235 -1.841 908 HA ASP 116 HA ASP 116 -7.620 -8.000 -4.328 909 HB2 ASP 116 2HB ASP 116 -6.640 -10.124 -3.008 910 HB3 ASP 116 3HB ASP 116 -7.737 -10.959 -4.104 911 H THR 117 H THR 117 -8.236 -9.655 -6.310 912 HA THR 117 HA THR 117 -11.160 -9.960 -6.286 913 HB THR 117 HB THR 117 -10.970 -9.196 -8.786 914 HG1 THR 117 HG1 THR 117 -9.223 -8.066 -9.283 915 HG21 THR 117 3HG2 THR 117 -11.339 -7.708 -6.288 916 HG22 THR 117 1HG2 THR 117 -12.344 -7.756 -7.735 917 HG23 THR 117 2HG2 THR 117 -10.934 -6.698 -7.675 918 H ARG 118 H ARG 118 -11.966 -11.328 -8.072 919 HA ARG 118 HA ARG 118 -12.007 -13.341 -9.131 920 HB2 ARG 118 2HB ARG 118 -9.303 -12.281 -9.916 921 HB3 ARG 118 3HB ARG 118 -9.872 -13.844 -10.489 922 HG2 ARG 118 2HG ARG 118 -10.847 -12.776 -12.165 923 HG3 ARG 118 3HG ARG 118 -11.976 -12.096 -10.992 924 HD2 ARG 118 2HD ARG 118 -10.035 -10.367 -10.613 925 HD3 ARG 118 3HD ARG 118 -9.554 -10.879 -12.230 926 HE ARG 118 HE ARG 118 -12.265 -10.290 -12.330 927 HH11 ARG 118 1HH1 ARG 118 -9.268 -8.630 -11.714 928 HH12 ARG 118 2HH1 ARG 118 -9.839 -7.106 -12.307 929 HH21 ARG 118 1HH2 ARG 118 -13.029 -8.288 -13.113 930 HH22 ARG 118 2HH2 ARG 118 -11.979 -6.912 -13.102 931 HA PRO 119 HA PRO 119 -9.709 -15.328 -5.595 932 HB2 PRO 119 2HB PRO 119 -11.888 -16.562 -4.549 933 HB3 PRO 119 3HB PRO 119 -11.419 -14.914 -4.117 934 HG2 PRO 119 2HG PRO 119 -13.498 -15.844 -6.060 935 HG3 PRO 119 3HG PRO 119 -13.587 -14.535 -4.868 936 HD2 PRO 119 2HD PRO 119 -13.120 -14.083 -7.496 937 HD3 PRO 119 3HD PRO 119 -12.437 -13.060 -6.215 938 H SER 120 H SER 120 -8.776 -16.550 -7.392 939 HA SER 120 HA SER 120 -10.260 -18.895 -8.277 940 HB2 SER 120 2HB SER 120 -7.443 -18.639 -9.097 941 HB3 SER 120 3HB SER 120 -8.883 -18.924 -10.075 942 HG SER 120 HG SER 120 -8.425 -16.922 -10.650 943 H MET 121 H MET 121 -8.959 -20.995 -8.369 944 HA MET 121 HA MET 121 -8.329 -21.763 -5.712 945 HB2 MET 121 2HB MET 121 -7.702 -23.309 -8.228 946 HB3 MET 121 3HB MET 121 -7.931 -23.953 -6.607 947 HG2 MET 121 2HG MET 121 -10.297 -22.696 -7.006 948 HG3 MET 121 3HG MET 121 -9.902 -23.214 -8.643 949 HE1 MET 121 3HE MET 121 -12.356 -23.917 -7.410 950 HE2 MET 121 1HE MET 121 -12.593 -25.640 -7.118 951 HE3 MET 121 2HE MET 121 -12.136 -24.575 -5.788 952 H LYS 122 H LYS 122 -6.280 -21.791 -8.636 953 HA LYS 122 HA LYS 122 -4.043 -21.498 -8.928 954 HB2 LYS 122 2HB LYS 122 -4.808 -19.633 -6.900 955 HB3 LYS 122 3HB LYS 122 -3.220 -20.274 -6.499 956 HG2 LYS 122 2HG LYS 122 -3.075 -19.727 -9.215 957 HG3 LYS 122 3HG LYS 122 -3.988 -18.377 -8.537 958 HD2 LYS 122 2HD LYS 122 -2.197 -18.113 -6.825 959 HD3 LYS 122 3HD LYS 122 -1.270 -19.356 -7.667 960 HE2 LYS 122 2HE LYS 122 -2.275 -16.947 -9.133 961 HE3 LYS 122 3HE LYS 122 -0.799 -16.858 -8.174 962 HZ1 LYS 122 3HZ LYS 122 -0.217 -18.996 -9.535 963 HZ2 LYS 122 1HZ LYS 122 0.038 -17.458 -10.192 964 HZ3 LYS 122 2HZ LYS 122 -1.326 -18.352 -10.639 965 H GLU 123 H GLU 123 -1.839 -21.954 -7.853 966 HA GLU 123 HA GLU 123 -2.101 -24.172 -5.936 967 HB2 GLU 123 2HB GLU 123 -1.342 -24.397 -8.634 968 HB3 GLU 123 3HB GLU 123 0.144 -24.553 -7.707 969 HG2 GLU 123 2HG GLU 123 -0.491 -26.724 -7.730 970 HG3 GLU 123 3HG GLU 123 -1.349 -26.204 -6.281 971 H ALA 124 H ALA 124 -1.196 -23.428 -4.128 972 HA ALA 124 HA ALA 124 1.531 -22.356 -4.293 973 HB1 ALA 124 1HB ALA 124 0.294 -20.371 -4.055 974 HB2 ALA 124 2HB ALA 124 -0.789 -21.091 -2.863 975 HB3 ALA 124 3HB ALA 124 0.887 -20.745 -2.437 976 H GLY 125 H GLY 125 2.849 -22.800 -2.514 977 HA2 GLY 125 2HA GLY 125 1.807 -24.931 -0.772 978 HA3 GLY 125 3HA GLY 125 3.500 -24.674 -1.165 979 H GLY 126 H GLY 126 3.216 -25.025 1.366 980 HA2 GLY 126 2HA GLY 126 2.830 -22.397 2.637 981 HA3 GLY 126 3HA GLY 126 2.780 -23.943 3.469 982 H LYS 127 H LYS 127 5.151 -22.475 1.255 983 HA LYS 127 HA LYS 127 7.395 -22.150 1.437 984 HB2 LYS 127 2HB LYS 127 6.939 -21.982 4.415 985 HB3 LYS 127 3HB LYS 127 8.233 -21.239 3.483 986 HG2 LYS 127 2HG LYS 127 6.990 -19.397 3.510 987 HG3 LYS 127 3HG LYS 127 5.967 -20.206 2.321 988 HD2 LYS 127 2HD LYS 127 4.428 -20.898 3.958 989 HD3 LYS 127 3HD LYS 127 5.554 -20.564 5.276 990 HE2 LYS 127 2HE LYS 127 5.424 -18.134 4.600 991 HE3 LYS 127 3HE LYS 127 4.089 -18.586 3.541 992 HZ1 LYS 127 3HZ LYS 127 3.992 -19.357 6.374 993 HZ2 LYS 127 1HZ LYS 127 2.721 -19.033 5.304 994 HZ3 LYS 127 2HZ LYS 127 3.631 -17.761 5.947 995 H GLU 128 H GLU 128 9.367 -22.910 3.053 996 HA GLU 128 HA GLU 128 9.036 -25.830 3.278 997 HB2 GLU 128 2HB GLU 128 11.338 -24.161 2.314 998 HB3 GLU 128 3HB GLU 128 11.614 -25.777 2.950 999 HG2 GLU 128 2HG GLU 128 11.026 -26.688 1.026 1000 HG3 GLU 128 3HG GLU 128 9.475 -25.851 1.055 1001 H GLU 129 H GLU 129 8.894 -26.386 5.348 1002 HA GLU 129 HA GLU 129 10.768 -25.146 7.252 1003 HB2 GLU 129 2HB GLU 129 8.961 -25.541 8.993 1004 HB3 GLU 129 3HB GLU 129 8.665 -24.244 7.844 1005 HG2 GLU 129 2HG GLU 129 6.790 -25.188 7.148 1006 HG3 GLU 129 3HG GLU 129 7.600 -26.727 6.861 1007 H GLY 130 H GLY 130 12.202 -26.616 7.871 1008 HA2 GLY 130 2HA GLY 130 11.233 -29.304 8.571 1009 HA3 GLY 130 3HA GLY 130 12.605 -29.141 7.486 1010 HA PRO 131 HA PRO 131 13.999 -27.522 11.844 1011 HB2 PRO 131 2HB PRO 131 12.384 -28.204 13.917 1012 HB3 PRO 131 3HB PRO 131 12.209 -26.691 13.020 1013 HG2 PRO 131 2HG PRO 131 10.674 -29.246 12.743 1014 HG3 PRO 131 3HG PRO 131 10.076 -27.577 12.742 1015 HD2 PRO 131 2HD PRO 131 10.433 -28.998 10.465 1016 HD3 PRO 131 3HD PRO 131 10.655 -27.238 10.537 1017 HA PRO 132 HA PRO 132 15.826 -31.326 13.080 1018 HB2 PRO 132 2HB PRO 132 16.620 -30.813 15.625 1019 HB3 PRO 132 3HB PRO 132 17.406 -30.101 14.212 1020 HG2 PRO 132 2HG PRO 132 15.361 -28.908 16.043 1021 HG3 PRO 132 3HG PRO 132 16.825 -28.169 15.368 1022 HD2 PRO 132 2HD PRO 132 14.359 -27.714 14.345 1023 HD3 PRO 132 3HD PRO 132 15.822 -27.734 13.339 1024 H GLN 133 H GLN 133 14.996 -33.232 13.654 1025 HA GLN 133 HA GLN 133 12.942 -33.285 15.765 1026 HB2 GLN 133 2HB GLN 133 12.394 -33.890 13.273 1027 HB3 GLN 133 3HB GLN 133 13.159 -35.420 13.679 1028 HG2 GLN 133 2HG GLN 133 11.495 -35.242 15.747 1029 HG3 GLN 133 3HG GLN 133 10.585 -34.283 14.581 1030 HE21 GLN 133 1HE2 GLN 133 11.343 -37.379 15.654 1031 HE22 GLN 133 2HE2 GLN 133 10.617 -38.277 14.369 1032 H ALA 134 H ALA 134 13.234 -34.588 17.473 1033 HA ALA 134 HA ALA 134 15.664 -36.237 17.511 1034 HB1 ALA 134 1HB ALA 134 14.836 -34.349 19.282 1035 HB2 ALA 134 2HB ALA 134 14.241 -35.826 20.042 1036 HB3 ALA 134 3HB ALA 134 15.955 -35.659 19.659 1037 H TYR 135 H TYR 135 15.229 -38.014 19.446 1038 HA TYR 135 HA TYR 135 13.566 -39.950 18.192 1039 HB2 TYR 135 2HB TYR 135 15.079 -39.918 20.800 1040 HB3 TYR 135 3HB TYR 135 14.111 -41.298 20.292 1041 HD1 TYR 135 HD2 TYR 135 17.135 -39.333 19.617 1042 HD2 TYR 135 HD1 TYR 135 14.835 -42.727 18.480 1043 HE1 TYR 135 HE2 TYR 135 19.037 -40.175 18.306 1044 HE2 TYR 135 HE1 TYR 135 16.731 -43.580 17.167 1045 HH TYR 135 HH TYR 135 18.841 -43.264 16.560 Start of MODEL 3 1 H21 MYR 1 1H2 MYR 1 -0.067 12.444 1.401 2 H22 MYR 1 2H2 MYR 1 -0.207 12.031 3.098 3 H31 MYR 1 1H3 MYR 1 2.023 10.750 2.940 4 H32 MYR 1 2H3 MYR 1 2.122 11.174 1.230 5 H41 MYR 1 1H4 MYR 1 0.120 9.860 0.678 6 H42 MYR 1 2H4 MYR 1 -0.320 9.671 2.377 7 H51 MYR 1 1H5 MYR 1 0.695 7.565 1.568 8 H52 MYR 1 2H5 MYR 1 1.754 8.284 2.783 9 H61 MYR 1 1H6 MYR 1 3.289 9.162 1.051 10 H62 MYR 1 2H6 MYR 1 2.165 8.748 -0.245 11 H71 MYR 1 1H7 MYR 1 2.791 6.363 1.426 12 H72 MYR 1 2H7 MYR 1 4.267 7.108 0.809 13 H81 MYR 1 1H8 MYR 1 3.865 5.936 -1.129 14 H82 MYR 1 2H8 MYR 1 2.651 7.167 -1.483 15 H91 MYR 1 1H9 MYR 1 1.060 5.598 0.052 16 H92 MYR 1 2H9 MYR 1 2.247 4.353 -0.337 17 H101 MYR 1 1H10 MYR 1 1.938 5.051 -2.849 18 H102 MYR 1 2H10 MYR 1 0.535 5.976 -2.338 19 H111 MYR 1 1H11 MYR 1 -0.221 3.779 -3.144 20 H112 MYR 1 2H11 MYR 1 -0.510 3.874 -1.415 21 H121 MYR 1 1H12 MYR 1 2.169 2.687 -2.124 22 H122 MYR 1 2H12 MYR 1 0.786 1.747 -2.686 23 H131 MYR 1 1H13 MYR 1 -0.060 2.317 -0.095 24 H132 MYR 1 2H13 MYR 1 1.687 2.318 0.152 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 0.594 14.500 1.066 29 HA2 GLY 2 2HA GLY 2 1.320 16.433 2.684 30 HA3 GLY 2 3HA GLY 2 2.824 15.523 2.668 31 H ASN 3 H ASN 3 0.449 16.646 0.251 32 HA ASN 3 HA ASN 3 0.710 17.671 -1.763 33 HB2 ASN 3 2HB ASN 3 2.895 18.841 -0.096 34 HB3 ASN 3 3HB ASN 3 2.887 19.186 -1.823 35 HD21 ASN 3 1HD2 ASN 3 0.958 19.365 1.113 36 HD22 ASN 3 2HD2 ASN 3 -0.006 20.710 0.615 37 H GLY 4 H GLY 4 1.201 15.255 -2.274 38 HA2 GLY 4 2HA GLY 4 2.277 14.288 -4.192 39 HA3 GLY 4 3HA GLY 4 3.707 15.240 -3.819 40 H ALA 5 H ALA 5 4.636 13.006 -4.192 41 HA ALA 5 HA ALA 5 4.960 11.729 -1.581 42 HB1 ALA 5 1HB ALA 5 4.902 9.476 -2.789 43 HB2 ALA 5 2HB ALA 5 3.361 10.274 -2.474 44 HB3 ALA 5 3HB ALA 5 4.073 10.337 -4.086 45 H SER 6 H SER 6 7.043 11.480 -1.128 46 HA SER 6 HA SER 6 8.952 10.723 -3.156 47 HB2 SER 6 2HB SER 6 8.943 13.122 -3.517 48 HB3 SER 6 3HB SER 6 9.147 13.418 -1.790 49 HG SER 6 HG SER 6 11.182 13.486 -2.398 50 H ARG 7 H ARG 7 9.241 12.427 -0.044 51 HA ARG 7 HA ARG 7 11.287 10.753 0.923 52 HB2 ARG 7 2HB ARG 7 9.683 12.976 1.930 53 HB3 ARG 7 3HB ARG 7 10.094 11.812 3.182 54 HG2 ARG 7 2HG ARG 7 12.308 12.612 1.416 55 HG3 ARG 7 3HG ARG 7 11.662 13.875 2.467 56 HD2 ARG 7 2HD ARG 7 11.831 11.913 4.257 57 HD3 ARG 7 3HD ARG 7 13.094 11.370 3.153 58 HE ARG 7 HE ARG 7 13.376 14.128 3.798 59 HH11 ARG 7 1HH1 ARG 7 13.926 10.911 5.009 60 HH12 ARG 7 2HH1 ARG 7 15.236 11.382 6.040 61 HH21 ARG 7 1HH2 ARG 7 15.099 14.761 5.152 62 HH22 ARG 7 2HH2 ARG 7 15.902 13.572 6.122 63 H ASP 8 H ASP 8 7.794 10.791 1.534 64 HA ASP 8 HA ASP 8 7.681 8.782 3.457 65 HB2 ASP 8 2HB ASP 8 5.829 10.360 2.392 66 HB3 ASP 8 3HB ASP 8 5.517 8.932 1.409 67 H TRP 9 H TRP 9 7.833 8.570 -0.051 68 HA TRP 9 HA TRP 9 7.338 5.771 -0.197 69 HB2 TRP 9 2HB TRP 9 6.946 7.114 -2.151 70 HB3 TRP 9 3HB TRP 9 8.606 7.704 -2.143 71 HD1 TRP 9 HD1 TRP 9 10.530 5.926 -2.897 72 HE1 TRP 9 HE1 TRP 9 10.396 3.891 -4.467 73 HE3 TRP 9 HE3 TRP 9 5.461 5.260 -2.933 74 HZ2 TRP 9 HZ2 TRP 9 8.406 2.224 -5.574 75 HZ3 TRP 9 HZ3 TRP 9 4.523 3.423 -4.273 76 HH2 TRP 9 HH2 TRP 9 5.966 1.938 -5.567 77 H LYS 10 H LYS 10 10.291 7.737 -0.213 78 HA LYS 10 HA LYS 10 12.159 5.732 -0.639 79 HB2 LYS 10 2HB LYS 10 12.528 8.254 -0.493 80 HB3 LYS 10 3HB LYS 10 12.600 8.039 1.251 81 HG2 LYS 10 2HG LYS 10 14.806 7.867 0.833 82 HG3 LYS 10 3HG LYS 10 14.380 6.183 0.515 83 HD2 LYS 10 2HD LYS 10 14.306 8.227 -1.677 84 HD3 LYS 10 3HD LYS 10 15.824 7.454 -1.213 85 HE2 LYS 10 2HE LYS 10 14.289 5.278 -1.428 86 HE3 LYS 10 3HE LYS 10 13.442 6.324 -2.567 87 HZ1 LYS 10 3HZ LYS 10 15.707 4.851 -3.060 88 HZ2 LYS 10 1HZ LYS 10 16.257 6.448 -2.951 89 HZ3 LYS 10 2HZ LYS 10 15.042 6.044 -4.057 90 H MET 11 H MET 11 10.655 6.793 2.384 91 HA MET 11 HA MET 11 12.177 5.051 4.048 92 HB2 MET 11 2HB MET 11 9.698 6.697 4.425 93 HB3 MET 11 3HB MET 11 10.186 5.544 5.660 94 HG2 MET 11 2HG MET 11 12.450 7.098 4.913 95 HG3 MET 11 3HG MET 11 11.102 8.179 5.257 96 HE1 MET 11 3HE MET 11 13.931 7.514 6.329 97 HE2 MET 11 1HE MET 11 13.796 7.908 8.043 98 HE3 MET 11 2HE MET 11 14.017 6.233 7.539 99 H ALA 12 H ALA 12 8.916 4.890 2.657 100 HA ALA 12 HA ALA 12 8.003 2.563 3.824 101 HB1 ALA 12 1HB ALA 12 6.538 2.316 1.894 102 HB2 ALA 12 2HB ALA 12 6.626 4.003 2.403 103 HB3 ALA 12 3HB ALA 12 7.524 3.461 0.985 104 H ILE 13 H ILE 13 10.255 2.961 1.159 105 HA ILE 13 HA ILE 13 10.334 0.122 0.596 106 HB ILE 13 HB ILE 13 12.050 2.363 -0.480 107 HG12 ILE 13 2HG1 ILE 13 9.652 2.547 -1.068 108 HG13 ILE 13 3HG1 ILE 13 10.659 2.220 -2.473 109 HG21 ILE 13 1HG2 ILE 13 12.095 0.315 -2.307 110 HG22 ILE 13 2HG2 ILE 13 13.374 0.697 -1.157 111 HG23 ILE 13 3HG2 ILE 13 12.174 -0.534 -0.764 112 HD11 ILE 13 3HD1 ILE 13 8.396 0.811 -1.583 113 HD12 ILE 13 1HD1 ILE 13 9.444 0.441 -2.952 114 HD13 ILE 13 2HD1 ILE 13 9.785 -0.254 -1.367 115 H LYS 14 H LYS 14 12.297 2.531 2.238 116 HA LYS 14 HA LYS 14 14.643 1.068 2.591 117 HB2 LYS 14 2HB LYS 14 13.930 3.550 3.244 118 HB3 LYS 14 3HB LYS 14 13.691 2.803 4.818 119 HG2 LYS 14 2HG LYS 14 15.859 3.496 5.000 120 HG3 LYS 14 3HG LYS 14 16.094 1.855 4.394 121 HD2 LYS 14 2HD LYS 14 17.414 2.888 2.882 122 HD3 LYS 14 3HD LYS 14 15.881 3.203 2.065 123 HE2 LYS 14 2HE LYS 14 17.194 5.238 2.201 124 HE3 LYS 14 3HE LYS 14 15.746 5.381 3.195 125 HZ1 LYS 14 3HZ LYS 14 17.891 4.333 4.718 126 HZ2 LYS 14 1HZ LYS 14 16.989 5.741 4.976 127 HZ3 LYS 14 2HZ LYS 14 18.360 5.784 3.986 128 H ARG 15 H ARG 15 11.570 0.864 4.225 129 HA ARG 15 HA ARG 15 12.655 -0.955 6.237 130 HB2 ARG 15 2HB ARG 15 10.265 0.733 5.998 131 HB3 ARG 15 3HB ARG 15 9.951 -0.855 6.684 132 HG2 ARG 15 2HG ARG 15 10.399 0.373 8.565 133 HG3 ARG 15 3HG ARG 15 11.992 -0.294 8.203 134 HD2 ARG 15 2HD ARG 15 11.993 2.009 6.736 135 HD3 ARG 15 3HD ARG 15 11.048 2.478 8.148 136 HE ARG 15 HE ARG 15 13.856 2.000 8.050 137 HH11 ARG 15 1HH1 ARG 15 11.048 1.777 10.095 138 HH12 ARG 15 2HH1 ARG 15 11.949 1.910 11.569 139 HH21 ARG 15 1HH2 ARG 15 15.054 2.176 9.982 140 HH22 ARG 15 2HH2 ARG 15 14.228 2.138 11.503 141 H CYS 16 H CYS 16 10.025 -0.917 3.831 142 HA CYS 16 HA CYS 16 9.267 -3.581 4.053 143 HB2 CYS 16 2HB CYS 16 8.132 -1.706 2.741 144 HB3 CYS 16 3HB CYS 16 9.270 -2.063 1.448 145 HG CYS 16 HG CYS 16 6.969 -3.287 0.658 146 H SER 17 H SER 17 12.044 -2.172 2.544 147 HA SER 17 HA SER 17 12.760 -4.065 0.667 148 HB2 SER 17 2HB SER 17 14.284 -2.384 0.578 149 HB3 SER 17 3HB SER 17 14.202 -2.083 2.314 150 HG SER 17 HG SER 17 16.098 -3.336 1.011 151 H ASN 18 H ASN 18 12.897 -4.249 4.145 152 HA ASN 18 HA ASN 18 14.393 -6.756 4.052 153 HB2 ASN 18 2HB ASN 18 14.859 -4.906 5.751 154 HB3 ASN 18 3HB ASN 18 13.348 -5.378 6.524 155 HD21 ASN 18 1HD2 ASN 18 14.476 -5.956 8.398 156 HD22 ASN 18 2HD2 ASN 18 15.386 -7.422 8.489 157 H VAL 19 H VAL 19 11.823 -6.793 2.887 158 HA VAL 19 HA VAL 19 10.114 -8.150 4.833 159 HB VAL 19 HB VAL 19 9.132 -6.443 3.301 160 HG11 VAL 19 1HG1 VAL 19 10.510 -6.999 1.329 161 HG12 VAL 19 2HG1 VAL 19 9.619 -8.514 1.162 162 HG13 VAL 19 3HG1 VAL 19 8.784 -6.972 0.968 163 HG21 VAL 19 3HG2 VAL 19 8.165 -9.079 3.894 164 HG22 VAL 19 1HG2 VAL 19 7.279 -7.556 3.812 165 HG23 VAL 19 2HG2 VAL 19 7.503 -8.526 2.356 166 H ALA 20 H ALA 20 9.639 -10.289 4.771 167 HA ALA 20 HA ALA 20 10.969 -11.892 2.684 168 HB1 ALA 20 1HB ALA 20 10.425 -12.875 5.470 169 HB2 ALA 20 2HB ALA 20 11.508 -13.554 4.254 170 HB3 ALA 20 3HB ALA 20 11.913 -12.029 5.042 171 H VAL 21 H VAL 21 9.879 -13.678 1.860 172 HA VAL 21 HA VAL 21 7.093 -13.468 1.621 173 HB VAL 21 HB VAL 21 8.716 -15.962 1.118 174 HG11 VAL 21 1HG1 VAL 21 6.027 -15.647 1.012 175 HG12 VAL 21 2HG1 VAL 21 6.481 -15.230 -0.641 176 HG13 VAL 21 3HG1 VAL 21 6.934 -16.797 0.030 177 HG21 VAL 21 3HG2 VAL 21 8.897 -13.384 -0.127 178 HG22 VAL 21 1HG2 VAL 21 9.828 -14.847 -0.449 179 HG23 VAL 21 2HG2 VAL 21 8.300 -14.571 -1.286 180 H GLY 22 H GLY 22 9.110 -15.525 3.674 181 HA2 GLY 22 2HA GLY 22 6.653 -16.474 5.010 182 HA3 GLY 22 3HA GLY 22 8.162 -17.373 4.957 183 H VAL 23 H VAL 23 7.644 -17.425 7.335 184 HA VAL 23 HA VAL 23 7.925 -15.058 8.887 185 HB VAL 23 HB VAL 23 8.201 -16.605 10.811 186 HG11 VAL 23 1HG1 VAL 23 5.968 -15.949 9.621 187 HG12 VAL 23 2HG1 VAL 23 5.927 -17.661 9.193 188 HG13 VAL 23 3HG1 VAL 23 5.973 -17.175 10.889 189 HG21 VAL 23 3HG2 VAL 23 9.425 -18.370 9.588 190 HG22 VAL 23 1HG2 VAL 23 8.045 -18.996 10.491 191 HG23 VAL 23 2HG2 VAL 23 7.934 -18.786 8.743 192 H GLY 24 H GLY 24 10.159 -17.396 7.582 193 HA2 GLY 24 2HA GLY 24 12.422 -15.984 7.520 194 HA3 GLY 24 3HA GLY 24 12.363 -16.431 9.219 195 H GLY 25 H GLY 25 14.521 -17.327 8.192 196 HA2 GLY 25 2HA GLY 25 15.635 -19.385 8.195 197 HA3 GLY 25 3HA GLY 25 14.092 -20.195 7.968 198 H LYS 26 H LYS 26 14.097 -21.302 6.138 199 HA LYS 26 HA LYS 26 15.791 -20.565 3.930 200 HB2 LYS 26 2HB LYS 26 13.777 -22.783 4.310 201 HB3 LYS 26 3HB LYS 26 14.712 -22.569 2.835 202 HG2 LYS 26 2HG LYS 26 16.784 -22.820 4.146 203 HG3 LYS 26 3HG LYS 26 15.808 -23.116 5.586 204 HD2 LYS 26 2HD LYS 26 15.333 -24.770 3.150 205 HD3 LYS 26 3HD LYS 26 16.744 -25.112 4.155 206 HE2 LYS 26 2HE LYS 26 15.308 -25.388 6.101 207 HE3 LYS 26 3HE LYS 26 13.891 -24.988 5.131 208 HZ1 LYS 26 3HZ LYS 26 13.743 -27.187 4.857 209 HZ2 LYS 26 1HZ LYS 26 15.344 -27.469 5.328 210 HZ3 LYS 26 2HZ LYS 26 14.999 -27.010 3.737 211 H SER 27 H SER 27 14.505 -18.403 3.949 212 HA SER 27 HA SER 27 12.458 -18.626 1.852 213 HB2 SER 27 2HB SER 27 11.064 -16.979 2.897 214 HB3 SER 27 3HB SER 27 11.426 -18.198 4.119 215 HG SER 27 HG SER 27 11.676 -15.805 4.612 216 H LYS 28 H LYS 28 12.095 -16.505 0.731 217 HA LYS 28 HA LYS 28 14.648 -15.050 0.503 218 HB2 LYS 28 2HB LYS 28 12.996 -16.334 -1.475 219 HB3 LYS 28 3HB LYS 28 13.116 -14.615 -1.824 220 HG2 LYS 28 2HG LYS 28 15.355 -14.711 -2.247 221 HG3 LYS 28 3HG LYS 28 15.611 -16.087 -1.172 222 HD2 LYS 28 2HD LYS 28 14.084 -16.303 -3.756 223 HD3 LYS 28 3HD LYS 28 15.831 -16.542 -3.657 224 HE2 LYS 28 2HE LYS 28 15.421 -18.302 -1.942 225 HE3 LYS 28 3HE LYS 28 13.692 -18.121 -2.233 226 HZ1 LYS 28 3HZ LYS 28 14.042 -18.767 -4.531 227 HZ2 LYS 28 1HZ LYS 28 14.623 -19.966 -3.488 228 HZ3 LYS 28 2HZ LYS 28 15.705 -18.923 -4.264 229 H LYS 29 H LYS 29 14.560 -12.793 0.049 230 HA LYS 29 HA LYS 29 12.119 -11.528 1.087 231 HB2 LYS 29 2HB LYS 29 13.628 -9.544 1.454 232 HB3 LYS 29 3HB LYS 29 14.012 -10.963 2.419 233 HG2 LYS 29 2HG LYS 29 15.939 -11.416 1.228 234 HG3 LYS 29 3HG LYS 29 15.404 -10.500 -0.183 235 HD2 LYS 29 2HD LYS 29 16.644 -8.808 0.569 236 HD3 LYS 29 3HD LYS 29 15.477 -8.636 1.882 237 HE2 LYS 29 2HE LYS 29 17.702 -8.794 2.800 238 HE3 LYS 29 3HE LYS 29 16.792 -10.246 3.215 239 HZ1 LYS 29 3HZ LYS 29 18.346 -10.370 0.762 240 HZ2 LYS 29 1HZ LYS 29 18.116 -11.542 1.961 241 HZ3 LYS 29 2HZ LYS 29 19.240 -10.300 2.196 242 H PHE 30 H PHE 30 11.981 -9.128 0.216 243 HA PHE 30 HA PHE 30 12.129 -9.294 -2.722 244 HB2 PHE 30 2HB PHE 30 10.133 -7.793 -1.014 245 HB3 PHE 30 3HB PHE 30 10.174 -7.789 -2.774 246 HD1 PHE 30 HD2 PHE 30 10.528 -10.506 -3.542 247 HD2 PHE 30 HD1 PHE 30 8.285 -8.934 -0.284 248 HE1 PHE 30 HE2 PHE 30 9.084 -12.498 -3.580 249 HE2 PHE 30 HE1 PHE 30 6.838 -10.924 -0.316 250 HZ PHE 30 HZ PHE 30 7.236 -12.708 -1.967 251 H GLY 31 H GLY 31 11.849 -6.882 -3.622 252 HA2 GLY 31 2HA GLY 31 13.489 -5.014 -2.084 253 HA3 GLY 31 3HA GLY 31 14.125 -5.548 -3.632 254 H GLU 32 H GLU 32 13.997 -3.082 -3.829 255 HA GLU 32 HA GLU 32 11.572 -1.734 -4.110 256 HB2 GLU 32 2HB GLU 32 14.047 -1.177 -5.744 257 HB3 GLU 32 3HB GLU 32 12.792 -0.038 -5.275 258 HG2 GLU 32 2HG GLU 32 13.988 0.506 -3.503 259 HG3 GLU 32 3HG GLU 32 13.797 -1.137 -2.893 260 H GLY 33 H GLY 33 13.536 -3.386 -6.576 261 HA2 GLY 33 2HA GLY 33 11.876 -2.833 -8.770 262 HA3 GLY 33 3HA GLY 33 12.995 -4.184 -8.658 263 H ASN 34 H ASN 34 11.553 -5.157 -6.211 264 HA ASN 34 HA ASN 34 9.687 -6.839 -7.599 265 HB2 ASN 34 2HB ASN 34 11.247 -7.251 -5.446 266 HB3 ASN 34 3HB ASN 34 9.742 -6.835 -4.632 267 HD21 ASN 34 1HD2 ASN 34 11.275 -9.056 -6.853 268 HD22 ASN 34 2HD2 ASN 34 10.123 -10.331 -6.675 269 H PHE 35 H PHE 35 9.423 -4.408 -5.016 270 HA PHE 35 HA PHE 35 6.678 -4.518 -4.623 271 HB2 PHE 35 2HB PHE 35 8.341 -1.998 -4.504 272 HB3 PHE 35 3HB PHE 35 6.857 -2.339 -3.620 273 HD1 PHE 35 HD2 PHE 35 7.337 -5.033 -2.604 274 HD2 PHE 35 HD1 PHE 35 9.979 -1.709 -2.902 275 HE1 PHE 35 HE2 PHE 35 8.658 -5.919 -0.727 276 HE2 PHE 35 HE1 PHE 35 11.305 -2.591 -1.027 277 HZ PHE 35 HZ PHE 35 10.645 -4.698 0.064 278 H ARG 36 H ARG 36 8.533 -2.576 -6.938 279 HA ARG 36 HA ARG 36 6.295 -1.218 -8.023 280 HB2 ARG 36 2HB ARG 36 8.938 -1.778 -9.377 281 HB3 ARG 36 3HB ARG 36 7.794 -0.505 -9.781 282 HG2 ARG 36 2HG ARG 36 8.280 0.698 -7.817 283 HG3 ARG 36 3HG ARG 36 9.124 -0.674 -7.096 284 HD2 ARG 36 2HD ARG 36 10.945 -0.456 -8.597 285 HD3 ARG 36 3HD ARG 36 10.056 0.674 -9.618 286 HE ARG 36 HE ARG 36 11.519 1.285 -7.226 287 HH11 ARG 36 1HH1 ARG 36 8.905 2.277 -9.301 288 HH12 ARG 36 2HH1 ARG 36 8.981 3.939 -8.820 289 HH21 ARG 36 1HH2 ARG 36 11.629 3.471 -6.585 290 HH22 ARG 36 2HH2 ARG 36 10.531 4.618 -7.276 291 H TRP 37 H TRP 37 8.150 -4.038 -9.143 292 HA TRP 37 HA TRP 37 6.796 -4.542 -11.503 293 HB2 TRP 37 2HB TRP 37 8.795 -5.766 -10.981 294 HB3 TRP 37 3HB TRP 37 8.058 -6.463 -9.541 295 HD1 TRP 37 HD1 TRP 37 8.453 -7.022 -13.238 296 HE1 TRP 37 HE1 TRP 37 7.258 -9.199 -13.915 297 HE3 TRP 37 HE3 TRP 37 5.902 -7.929 -8.901 298 HZ2 TRP 37 HZ2 TRP 37 5.470 -11.054 -12.763 299 HZ3 TRP 37 HZ3 TRP 37 4.470 -9.926 -8.771 300 HH2 TRP 37 HH2 TRP 37 4.260 -11.455 -10.663 301 H ALA 38 H ALA 38 5.804 -5.107 -8.218 302 HA ALA 38 HA ALA 38 3.637 -6.874 -8.898 303 HB1 ALA 38 1HB ALA 38 4.498 -5.501 -6.374 304 HB2 ALA 38 2HB ALA 38 2.967 -6.371 -6.474 305 HB3 ALA 38 3HB ALA 38 4.485 -7.224 -6.752 306 H ILE 39 H ILE 39 3.666 -3.626 -7.413 307 HA ILE 39 HA ILE 39 0.978 -3.057 -7.720 308 HB ILE 39 HB ILE 39 2.411 -1.645 -6.374 309 HG12 ILE 39 2HG1 ILE 39 1.729 0.442 -8.274 310 HG13 ILE 39 3HG1 ILE 39 0.435 -0.743 -8.131 311 HG21 ILE 39 1HG2 ILE 39 4.092 -0.215 -7.258 312 HG22 ILE 39 2HG2 ILE 39 4.384 -1.825 -7.915 313 HG23 ILE 39 3HG2 ILE 39 3.625 -0.588 -8.917 314 HD11 ILE 39 3HD1 ILE 39 -0.219 0.510 -6.408 315 HD12 ILE 39 1HD1 ILE 39 1.065 -0.315 -5.526 316 HD13 ILE 39 2HD1 ILE 39 1.361 1.274 -6.233 317 H ARG 40 H ARG 40 3.616 -2.653 -10.023 318 HA ARG 40 HA ARG 40 2.095 -1.238 -11.965 319 HB2 ARG 40 2HB ARG 40 4.477 -1.049 -12.040 320 HB3 ARG 40 3HB ARG 40 4.674 -2.794 -12.134 321 HG2 ARG 40 2HG ARG 40 3.059 -1.716 -14.301 322 HG3 ARG 40 3HG ARG 40 4.692 -1.050 -14.250 323 HD2 ARG 40 2HD ARG 40 5.680 -3.083 -14.643 324 HD3 ARG 40 3HD ARG 40 4.341 -3.989 -13.940 325 HE ARG 40 HE ARG 40 3.403 -2.740 -16.248 326 HH11 ARG 40 1HH1 ARG 40 5.697 -5.197 -15.340 327 HH12 ARG 40 2HH1 ARG 40 5.546 -6.072 -16.827 328 HH21 ARG 40 1HH2 ARG 40 3.196 -3.884 -18.211 329 HH22 ARG 40 2HH2 ARG 40 4.124 -5.324 -18.460 330 H MET 41 H MET 41 3.161 -4.635 -11.770 331 HA MET 41 HA MET 41 1.975 -5.595 -14.069 332 HB2 MET 41 2HB MET 41 3.477 -6.951 -12.723 333 HB3 MET 41 3HB MET 41 2.311 -6.986 -11.406 334 HG2 MET 41 2HG MET 41 2.238 -9.075 -12.560 335 HG3 MET 41 3HG MET 41 0.744 -8.198 -12.880 336 HE1 MET 41 3HE MET 41 1.108 -10.061 -16.200 337 HE2 MET 41 1HE MET 41 0.770 -10.330 -14.489 338 HE3 MET 41 2HE MET 41 -0.112 -9.087 -15.378 339 H ALA 42 H ALA 42 0.510 -4.776 -11.012 340 HA ALA 42 HA ALA 42 -1.983 -6.088 -11.515 341 HB1 ALA 42 1HB ALA 42 -1.511 -5.768 -9.252 342 HB2 ALA 42 2HB ALA 42 -1.062 -4.078 -9.489 343 HB3 ALA 42 3HB ALA 42 -2.753 -4.565 -9.604 344 H ASN 43 H ASN 43 -0.947 -2.678 -11.570 345 HA ASN 43 HA ASN 43 -3.340 -1.541 -12.387 346 HB2 ASN 43 2HB ASN 43 -0.468 -0.762 -12.646 347 HB3 ASN 43 3HB ASN 43 -1.667 0.151 -13.557 348 HD21 ASN 43 1HD2 ASN 43 -0.290 1.528 -11.783 349 HD22 ASN 43 2HD2 ASN 43 -1.230 1.887 -10.378 350 H VAL 44 H VAL 44 -1.009 -3.362 -14.203 351 HA VAL 44 HA VAL 44 -2.056 -2.564 -16.778 352 HB VAL 44 HB VAL 44 -0.128 -4.794 -16.118 353 HG11 VAL 44 1HG1 VAL 44 -0.883 -3.460 -18.712 354 HG12 VAL 44 2HG1 VAL 44 0.526 -4.505 -18.516 355 HG13 VAL 44 3HG1 VAL 44 -1.096 -5.154 -18.271 356 HG21 VAL 44 3HG2 VAL 44 0.225 -1.984 -15.983 357 HG22 VAL 44 1HG2 VAL 44 1.434 -3.253 -15.787 358 HG23 VAL 44 2HG2 VAL 44 1.120 -2.573 -17.384 359 H SER 45 H SER 45 -1.787 -5.704 -15.100 360 HA SER 45 HA SER 45 -3.429 -7.170 -16.774 361 HB2 SER 45 2HB SER 45 -2.379 -8.555 -15.283 362 HB3 SER 45 3HB SER 45 -2.563 -7.426 -13.941 363 HG SER 45 HG SER 45 -4.584 -9.075 -15.063 364 H THR 46 H THR 46 -4.302 -5.182 -13.986 365 HA THR 46 HA THR 46 -7.093 -5.846 -14.140 366 HB THR 46 HB THR 46 -7.433 -4.251 -12.378 367 HG1 THR 46 HG1 THR 46 -6.274 -2.480 -12.683 368 HG21 THR 46 3HG2 THR 46 -4.931 -5.019 -11.236 369 HG22 THR 46 1HG2 THR 46 -5.538 -6.348 -12.223 370 HG23 THR 46 2HG2 THR 46 -6.535 -5.684 -10.929 371 H GLY 47 H GLY 47 -5.006 -3.462 -15.541 372 HA2 GLY 47 2HA GLY 47 -7.298 -2.382 -17.014 373 HA3 GLY 47 3HA GLY 47 -6.288 -1.251 -16.126 374 H ARG 48 H ARG 48 -4.217 -0.780 -16.864 375 HA ARG 48 HA ARG 48 -2.868 -2.097 -18.926 376 HB2 ARG 48 2HB ARG 48 -5.073 -0.793 -19.939 377 HB3 ARG 48 3HB ARG 48 -3.785 0.378 -20.189 378 HG2 ARG 48 2HG ARG 48 -3.000 -0.760 -21.918 379 HG3 ARG 48 3HG ARG 48 -2.919 -2.248 -20.972 380 HD2 ARG 48 2HD ARG 48 -4.368 -2.529 -22.908 381 HD3 ARG 48 3HD ARG 48 -5.290 -2.655 -21.410 382 HE ARG 48 HE ARG 48 -5.370 0.000 -22.340 383 HH11 ARG 48 1HH1 ARG 48 -6.587 -3.169 -23.112 384 HH12 ARG 48 2HH1 ARG 48 -8.018 -2.573 -23.886 385 HH21 ARG 48 1HH2 ARG 48 -7.250 0.796 -23.357 386 HH22 ARG 48 2HH2 ARG 48 -8.394 -0.318 -24.025 387 H GLU 49 H GLU 49 -0.814 -1.447 -18.833 388 HA GLU 49 HA GLU 49 1.045 -0.225 -18.358 389 HB2 GLU 49 2HB GLU 49 -0.888 1.716 -19.367 390 HB3 GLU 49 3HB GLU 49 0.285 2.435 -18.274 391 HG2 GLU 49 2HG GLU 49 1.958 2.248 -19.743 392 HG3 GLU 49 3HG GLU 49 1.451 0.643 -20.268 393 HA PRO 50 HA PRO 50 1.101 0.595 -14.050 394 HB2 PRO 50 2HB PRO 50 3.133 2.381 -13.818 395 HB3 PRO 50 3HB PRO 50 3.393 0.672 -14.190 396 HG2 PRO 50 2HG PRO 50 3.332 3.025 -16.040 397 HG3 PRO 50 3HG PRO 50 4.451 1.650 -16.015 398 HD2 PRO 50 2HD PRO 50 2.379 1.811 -17.750 399 HD3 PRO 50 3HD PRO 50 2.971 0.264 -17.111 400 H GLY 51 H GLY 51 1.483 3.627 -15.903 401 HA2 GLY 51 2HA GLY 51 0.396 5.645 -15.717 402 HA3 GLY 51 3HA GLY 51 -0.835 4.815 -14.777 403 H ASP 52 H ASP 52 -0.611 4.679 -12.509 404 HA ASP 52 HA ASP 52 1.579 6.093 -11.238 405 HB2 ASP 52 2HB ASP 52 -1.260 7.037 -10.805 406 HB3 ASP 52 3HB ASP 52 0.205 7.720 -10.106 407 H ILE 53 H ILE 53 0.625 6.372 -8.717 408 HA ILE 53 HA ILE 53 -0.154 3.624 -7.984 409 HB ILE 53 HB ILE 53 1.039 4.161 -5.785 410 HG12 ILE 53 2HG1 ILE 53 2.747 6.044 -7.328 411 HG13 ILE 53 3HG1 ILE 53 1.220 6.668 -6.715 412 HG21 ILE 53 1HG2 ILE 53 3.172 4.095 -7.777 413 HG22 ILE 53 2HG2 ILE 53 2.725 2.908 -6.552 414 HG23 ILE 53 3HG2 ILE 53 1.869 2.949 -8.093 415 HD11 ILE 53 3HD1 ILE 53 2.922 5.171 -4.818 416 HD12 ILE 53 1HD1 ILE 53 3.474 6.768 -5.323 417 HD13 ILE 53 2HD1 ILE 53 1.895 6.581 -4.559 418 HA PRO 54 HA PRO 54 -3.613 5.183 -5.776 419 HB2 PRO 54 2HB PRO 54 -3.736 3.461 -3.681 420 HB3 PRO 54 3HB PRO 54 -4.168 2.998 -5.331 421 HG2 PRO 54 2HG PRO 54 -1.620 2.517 -3.835 422 HG3 PRO 54 3HG PRO 54 -2.529 1.411 -4.882 423 HD2 PRO 54 2HD PRO 54 -0.324 2.737 -5.728 424 HD3 PRO 54 3HD PRO 54 -1.671 2.332 -6.812 425 H GLU 55 H GLU 55 -2.535 7.201 -5.197 426 HA GLU 55 HA GLU 55 -0.931 7.602 -2.967 427 HB2 GLU 55 2HB GLU 55 -1.792 9.949 -3.011 428 HB3 GLU 55 3HB GLU 55 -1.215 9.364 -4.565 429 HG2 GLU 55 2HG GLU 55 -3.944 8.744 -4.479 430 HG3 GLU 55 3HG GLU 55 -3.794 10.382 -3.846 431 H THR 56 H THR 56 -4.337 7.014 -3.182 432 HA THR 56 HA THR 56 -4.718 7.710 -0.358 433 HB THR 56 HB THR 56 -7.067 7.658 -0.736 434 HG1 THR 56 HG1 THR 56 -7.871 6.980 -2.839 435 HG21 THR 56 3HG2 THR 56 -5.828 8.869 -3.209 436 HG22 THR 56 1HG2 THR 56 -5.858 9.639 -1.624 437 HG23 THR 56 2HG2 THR 56 -7.369 9.311 -2.473 438 H LEU 57 H LEU 57 -5.464 6.227 1.151 439 HA LEU 57 HA LEU 57 -4.582 3.565 0.851 440 HB2 LEU 57 2HB LEU 57 -5.580 5.223 2.928 441 HB3 LEU 57 3HB LEU 57 -6.508 3.725 2.937 442 HG LEU 57 HG LEU 57 -3.521 4.014 3.240 443 HD11 LEU 57 1HD1 LEU 57 -4.247 2.706 5.401 444 HD12 LEU 57 2HD1 LEU 57 -5.794 3.492 5.087 445 HD13 LEU 57 3HD1 LEU 57 -4.343 4.465 5.325 446 HD21 LEU 57 3HD2 LEU 57 -5.245 1.656 2.666 447 HD22 LEU 57 1HD2 LEU 57 -3.877 1.460 3.762 448 HD23 LEU 57 2HD2 LEU 57 -3.611 2.025 2.113 449 H ASP 58 H ASP 58 -7.767 5.062 0.620 450 HA ASP 58 HA ASP 58 -9.310 2.727 0.496 451 HB2 ASP 58 2HB ASP 58 -9.921 5.287 -0.983 452 HB3 ASP 58 3HB ASP 58 -11.066 4.094 -0.376 453 H GLN 59 H GLN 59 -7.755 4.610 -2.073 454 HA GLN 59 HA GLN 59 -8.738 3.133 -4.246 455 HB2 GLN 59 2HB GLN 59 -6.338 4.885 -3.840 456 HB3 GLN 59 3HB GLN 59 -6.538 3.998 -5.345 457 HG2 GLN 59 2HG GLN 59 -8.944 5.421 -4.562 458 HG3 GLN 59 3HG GLN 59 -7.555 6.487 -4.767 459 HE21 GLN 59 1HE2 GLN 59 -8.757 7.363 -6.559 460 HE22 GLN 59 2HE2 GLN 59 -8.707 6.569 -8.093 461 H LEU 60 H LEU 60 -5.611 2.874 -2.556 462 HA LEU 60 HA LEU 60 -4.558 0.738 -3.967 463 HB2 LEU 60 2HB LEU 60 -3.230 1.984 -2.401 464 HB3 LEU 60 3HB LEU 60 -4.250 1.467 -1.060 465 HG LEU 60 HG LEU 60 -3.348 -0.919 -2.071 466 HD11 LEU 60 1HD1 LEU 60 -1.157 1.132 -2.317 467 HD12 LEU 60 2HD1 LEU 60 -1.790 0.081 -3.583 468 HD13 LEU 60 3HD1 LEU 60 -0.883 -0.608 -2.237 469 HD21 LEU 60 3HD2 LEU 60 -2.038 -1.045 -0.070 470 HD22 LEU 60 1HD2 LEU 60 -3.515 -0.153 0.294 471 HD23 LEU 60 2HD2 LEU 60 -1.995 0.714 0.072 472 H ARG 61 H ARG 61 -6.843 0.741 -1.288 473 HA ARG 61 HA ARG 61 -6.820 -2.018 -0.751 474 HB2 ARG 61 2HB ARG 61 -8.394 0.286 0.012 475 HB3 ARG 61 3HB ARG 61 -9.424 -1.115 -0.248 476 HG2 ARG 61 2HG ARG 61 -8.328 -2.364 1.412 477 HG3 ARG 61 3HG ARG 61 -6.971 -1.238 1.474 478 HD2 ARG 61 2HD ARG 61 -7.985 -0.129 3.107 479 HD3 ARG 61 3HD ARG 61 -9.315 0.244 2.012 480 HE ARG 61 HE ARG 61 -9.626 -2.362 3.044 481 HH11 ARG 61 1HH1 ARG 61 -9.845 0.980 3.994 482 HH12 ARG 61 2HH1 ARG 61 -11.028 0.689 5.226 483 HH21 ARG 61 1HH2 ARG 61 -11.184 -2.759 4.663 484 HH22 ARG 61 2HH2 ARG 61 -11.788 -1.439 5.606 485 H LEU 62 H LEU 62 -8.939 -0.080 -2.849 486 HA LEU 62 HA LEU 62 -10.492 -2.255 -3.767 487 HB2 LEU 62 2HB LEU 62 -11.266 0.036 -3.934 488 HB3 LEU 62 3HB LEU 62 -9.939 0.428 -5.025 489 HG LEU 62 HG LEU 62 -10.896 -0.969 -6.752 490 HD11 LEU 62 1HD1 LEU 62 -12.720 -1.799 -4.551 491 HD12 LEU 62 2HD1 LEU 62 -11.932 -2.771 -5.792 492 HD13 LEU 62 3HD1 LEU 62 -13.330 -1.780 -6.205 493 HD21 LEU 62 3HD2 LEU 62 -13.269 0.224 -6.762 494 HD22 LEU 62 1HD2 LEU 62 -11.773 1.104 -7.079 495 HD23 LEU 62 2HD2 LEU 62 -12.511 1.168 -5.478 496 H VAL 63 H VAL 63 -7.358 -1.102 -4.608 497 HA VAL 63 HA VAL 63 -7.215 -2.177 -7.237 498 HB VAL 63 HB VAL 63 -4.983 -1.545 -5.301 499 HG11 VAL 63 1HG1 VAL 63 -4.979 -2.206 -8.235 500 HG12 VAL 63 2HG1 VAL 63 -3.642 -1.371 -7.441 501 HG13 VAL 63 3HG1 VAL 63 -4.091 -3.000 -6.935 502 HG21 VAL 63 3HG2 VAL 63 -5.159 0.611 -5.870 503 HG22 VAL 63 1HG2 VAL 63 -5.392 0.229 -7.576 504 HG23 VAL 63 2HG2 VAL 63 -6.764 0.195 -6.470 505 H ILE 64 H ILE 64 -5.648 -3.287 -4.227 506 HA ILE 64 HA ILE 64 -4.745 -5.732 -5.168 507 HB ILE 64 HB ILE 64 -4.001 -4.887 -3.034 508 HG12 ILE 64 2HG1 ILE 64 -5.551 -7.459 -2.660 509 HG13 ILE 64 3HG1 ILE 64 -3.955 -7.331 -3.392 510 HG21 ILE 64 1HG2 ILE 64 -5.412 -4.751 -1.090 511 HG22 ILE 64 2HG2 ILE 64 -6.145 -3.823 -2.397 512 HG23 ILE 64 3HG2 ILE 64 -6.776 -5.418 -1.987 513 HD11 ILE 64 3HD1 ILE 64 -4.630 -7.647 -0.667 514 HD12 ILE 64 1HD1 ILE 64 -3.030 -7.524 -1.399 515 HD13 ILE 64 2HD1 ILE 64 -3.866 -6.069 -0.856 516 H CYS 65 H CYS 65 -7.888 -4.879 -3.806 517 HA CYS 65 HA CYS 65 -8.910 -7.517 -3.686 518 HB2 CYS 65 2HB CYS 65 -9.938 -5.747 -2.392 519 HB3 CYS 65 3HB CYS 65 -10.324 -4.850 -3.855 520 HG CYS 65 HG CYS 65 -11.633 -7.884 -3.970 521 H ASP 66 H ASP 66 -9.173 -4.949 -6.119 522 HA ASP 66 HA ASP 66 -10.887 -6.294 -7.883 523 HB2 ASP 66 2HB ASP 66 -10.533 -3.938 -8.157 524 HB3 ASP 66 3HB ASP 66 -8.800 -4.167 -8.374 525 H LEU 67 H LEU 67 -7.342 -6.160 -7.758 526 HA LEU 67 HA LEU 67 -6.938 -7.809 -10.032 527 HB2 LEU 67 2HB LEU 67 -5.208 -6.316 -9.270 528 HB3 LEU 67 3HB LEU 67 -5.138 -7.136 -7.711 529 HG LEU 67 HG LEU 67 -4.496 -9.206 -9.227 530 HD11 LEU 67 1HD1 LEU 67 -3.006 -8.401 -11.073 531 HD12 LEU 67 2HD1 LEU 67 -3.747 -6.812 -10.890 532 HD13 LEU 67 3HD1 LEU 67 -4.733 -8.195 -11.365 533 HD21 LEU 67 3HD2 LEU 67 -2.797 -6.970 -8.197 534 HD22 LEU 67 1HD2 LEU 67 -2.062 -8.335 -9.038 535 HD23 LEU 67 2HD2 LEU 67 -2.999 -8.606 -7.568 536 H GLN 68 H GLN 68 -6.724 -8.473 -6.539 537 HA GLN 68 HA GLN 68 -6.148 -11.203 -6.747 538 HB2 GLN 68 2HB GLN 68 -5.878 -9.956 -4.664 539 HB3 GLN 68 3HB GLN 68 -7.618 -9.725 -4.557 540 HG2 GLN 68 2HG GLN 68 -7.965 -12.081 -4.242 541 HG3 GLN 68 3HG GLN 68 -6.253 -12.405 -4.509 542 HE21 GLN 68 1HE2 GLN 68 -7.793 -13.128 -2.220 543 HE22 GLN 68 2HE2 GLN 68 -7.100 -12.322 -0.858 544 H GLU 69 H GLU 69 -9.135 -9.460 -7.059 545 HA GLU 69 HA GLU 69 -10.882 -11.672 -6.666 546 HB2 GLU 69 2HB GLU 69 -11.689 -9.393 -6.413 547 HB3 GLU 69 3HB GLU 69 -11.310 -9.043 -8.093 548 HG2 GLU 69 2HG GLU 69 -13.137 -10.125 -8.882 549 HG3 GLU 69 3HG GLU 69 -13.146 -11.302 -7.570 550 H ARG 70 H ARG 70 -10.052 -9.901 -9.652 551 HA ARG 70 HA ARG 70 -11.163 -11.799 -11.400 552 HB2 ARG 70 2HB ARG 70 -9.405 -9.441 -11.639 553 HB3 ARG 70 3HB ARG 70 -9.257 -10.621 -12.935 554 HG2 ARG 70 2HG ARG 70 -12.025 -10.113 -12.361 555 HG3 ARG 70 3HG ARG 70 -11.167 -8.603 -12.676 556 HD2 ARG 70 2HD ARG 70 -10.547 -9.259 -14.819 557 HD3 ARG 70 3HD ARG 70 -10.797 -10.969 -14.471 558 HE ARG 70 HE ARG 70 -13.255 -9.652 -14.249 559 HH11 ARG 70 1HH1 ARG 70 -10.908 -10.504 -16.675 560 HH12 ARG 70 2HH1 ARG 70 -12.072 -10.597 -17.955 561 HH21 ARG 70 1HH2 ARG 70 -14.797 -9.771 -15.926 562 HH22 ARG 70 2HH2 ARG 70 -14.284 -10.179 -17.528 563 H ARG 71 H ARG 71 -7.820 -11.319 -10.303 564 HA ARG 71 HA ARG 71 -6.590 -13.289 -11.830 565 HB2 ARG 71 2HB ARG 71 -5.953 -12.220 -9.082 566 HB3 ARG 71 3HB ARG 71 -4.919 -13.375 -9.912 567 HG2 ARG 71 2HG ARG 71 -5.674 -10.671 -10.998 568 HG3 ARG 71 3HG ARG 71 -4.173 -11.032 -10.143 569 HD2 ARG 71 2HD ARG 71 -3.329 -11.485 -12.163 570 HD3 ARG 71 3HD ARG 71 -4.252 -12.984 -12.066 571 HE ARG 71 HE ARG 71 -5.830 -10.857 -13.100 572 HH11 ARG 71 1HH1 ARG 71 -3.335 -13.133 -13.946 573 HH12 ARG 71 2HH1 ARG 71 -3.742 -13.152 -15.630 574 HH21 ARG 71 1HH2 ARG 71 -6.376 -10.874 -15.314 575 HH22 ARG 71 2HH2 ARG 71 -5.472 -11.866 -16.407 576 H GLU 72 H GLU 72 -8.105 -13.544 -8.629 577 HA GLU 72 HA GLU 72 -7.494 -16.217 -8.115 578 HB2 GLU 72 2HB GLU 72 -8.377 -14.809 -6.372 579 HB3 GLU 72 3HB GLU 72 -9.868 -14.555 -7.268 580 HG2 GLU 72 2HG GLU 72 -10.766 -16.485 -6.577 581 HG3 GLU 72 3HG GLU 72 -9.243 -17.362 -6.713 582 H LYS 73 H LYS 73 -10.371 -14.818 -9.668 583 HA LYS 73 HA LYS 73 -11.786 -17.161 -10.121 584 HB2 LYS 73 2HB LYS 73 -11.649 -14.684 -11.850 585 HB3 LYS 73 3HB LYS 73 -12.877 -15.937 -11.982 586 HG2 LYS 73 2HG LYS 73 -12.523 -14.724 -9.314 587 HG3 LYS 73 3HG LYS 73 -13.208 -13.691 -10.571 588 HD2 LYS 73 2HD LYS 73 -15.170 -14.748 -10.481 589 HD3 LYS 73 3HD LYS 73 -14.396 -16.331 -10.596 590 HE2 LYS 73 2HE LYS 73 -13.770 -15.783 -8.077 591 HE3 LYS 73 3HE LYS 73 -15.209 -14.772 -8.200 592 HZ1 LYS 73 3HZ LYS 73 -15.083 -17.683 -8.778 593 HZ2 LYS 73 1HZ LYS 73 -16.463 -16.714 -8.912 594 HZ3 LYS 73 2HZ LYS 73 -15.758 -16.976 -7.398 595 H PHE 74 H PHE 74 -9.178 -15.705 -11.993 596 HA PHE 74 HA PHE 74 -9.364 -17.604 -14.135 597 HB2 PHE 74 2HB PHE 74 -8.460 -15.290 -14.408 598 HB3 PHE 74 3HB PHE 74 -7.063 -15.767 -13.448 599 HD1 PHE 74 HD1 PHE 74 -8.950 -17.301 -16.282 600 HD2 PHE 74 HD2 PHE 74 -5.191 -16.043 -14.732 601 HE1 PHE 74 HE1 PHE 74 -7.839 -18.122 -18.319 602 HE2 PHE 74 HE2 PHE 74 -4.074 -16.860 -16.766 603 HZ PHE 74 HZ PHE 74 -5.398 -17.901 -18.563 604 H GLY 75 H GLY 75 -7.725 -17.431 -11.085 605 HA2 GLY 75 2HA GLY 75 -7.159 -19.841 -10.391 606 HA3 GLY 75 3HA GLY 75 -6.095 -19.781 -11.788 607 H SER 76 H SER 76 -5.005 -20.372 -9.391 608 HA SER 76 HA SER 76 -3.874 -17.901 -8.310 609 HB2 SER 76 2HB SER 76 -4.750 -19.734 -6.798 610 HB3 SER 76 3HB SER 76 -3.392 -20.722 -7.334 611 HG SER 76 HG SER 76 -2.028 -19.472 -6.253 612 H SER 77 H SER 77 -1.630 -17.548 -8.173 613 HA SER 77 HA SER 77 0.245 -19.331 -9.404 614 HB2 SER 77 2HB SER 77 0.607 -18.341 -11.427 615 HB3 SER 77 3HB SER 77 -1.077 -17.854 -11.234 616 HG SER 77 HG SER 77 0.173 -16.056 -11.751 617 H LYS 78 H LYS 78 2.410 -18.700 -9.086 618 HA LYS 78 HA LYS 78 2.987 -17.366 -6.736 619 HB2 LYS 78 2HB LYS 78 4.437 -18.739 -8.675 620 HB3 LYS 78 3HB LYS 78 5.157 -17.134 -8.660 621 HG2 LYS 78 2HG LYS 78 5.245 -17.429 -6.106 622 HG3 LYS 78 3HG LYS 78 4.990 -19.142 -6.448 623 HD2 LYS 78 2HD LYS 78 6.969 -18.584 -8.199 624 HD3 LYS 78 3HD LYS 78 7.356 -17.443 -6.910 625 HE2 LYS 78 2HE LYS 78 6.730 -20.271 -6.203 626 HE3 LYS 78 3HE LYS 78 8.311 -19.892 -6.885 627 HZ1 LYS 78 3HZ LYS 78 7.140 -18.611 -4.475 628 HZ2 LYS 78 1HZ LYS 78 8.678 -18.313 -5.114 629 HZ3 LYS 78 2HZ LYS 78 8.315 -19.829 -4.459 630 H GLU 79 H GLU 79 2.788 -16.105 -10.015 631 HA GLU 79 HA GLU 79 3.895 -13.562 -9.495 632 HB2 GLU 79 2HB GLU 79 2.115 -14.674 -11.636 633 HB3 GLU 79 3HB GLU 79 2.424 -12.945 -11.564 634 HG2 GLU 79 2HG GLU 79 4.123 -13.489 -12.929 635 HG3 GLU 79 3HG GLU 79 4.939 -13.837 -11.406 636 H ILE 80 H ILE 80 0.553 -14.745 -9.480 637 HA ILE 80 HA ILE 80 -0.637 -12.244 -8.890 638 HB ILE 80 HB ILE 80 -1.696 -15.018 -8.335 639 HG12 ILE 80 2HG1 ILE 80 -2.397 -13.220 -10.652 640 HG13 ILE 80 3HG1 ILE 80 -1.083 -14.388 -10.742 641 HG21 ILE 80 1HG2 ILE 80 -3.140 -12.376 -8.508 642 HG22 ILE 80 2HG2 ILE 80 -3.894 -13.955 -8.289 643 HG23 ILE 80 3HG2 ILE 80 -2.842 -13.299 -7.035 644 HD11 ILE 80 3HD1 ILE 80 -3.708 -14.850 -11.381 645 HD12 ILE 80 1HD1 ILE 80 -2.484 -16.080 -11.068 646 HD13 ILE 80 2HD1 ILE 80 -3.558 -15.554 -9.772 647 H ASP 81 H ASP 81 -0.027 -15.073 -6.802 648 HA ASP 81 HA ASP 81 -0.835 -13.973 -4.394 649 HB2 ASP 81 2HB ASP 81 -0.186 -16.371 -4.820 650 HB3 ASP 81 3HB ASP 81 1.499 -15.865 -4.720 651 H MET 82 H MET 82 2.229 -13.635 -6.088 652 HA MET 82 HA MET 82 3.679 -12.411 -4.007 653 HB2 MET 82 2HB MET 82 3.959 -12.597 -6.967 654 HB3 MET 82 3HB MET 82 4.909 -11.379 -6.127 655 HG2 MET 82 2HG MET 82 6.003 -13.029 -4.808 656 HG3 MET 82 3HG MET 82 4.913 -14.289 -5.381 657 HE1 MET 82 3HE MET 82 8.757 -14.620 -6.706 658 HE2 MET 82 1HE MET 82 8.556 -13.066 -5.895 659 HE3 MET 82 2HE MET 82 7.874 -14.528 -5.181 660 H ALA 83 H ALA 83 2.022 -10.950 -6.808 661 HA ALA 83 HA ALA 83 2.441 -8.289 -6.218 662 HB1 ALA 83 1HB ALA 83 1.373 -9.246 -8.284 663 HB2 ALA 83 2HB ALA 83 -0.130 -9.352 -7.366 664 HB3 ALA 83 3HB ALA 83 0.620 -7.781 -7.652 665 H ILE 84 H ILE 84 0.023 -10.487 -4.904 666 HA ILE 84 HA ILE 84 -1.462 -8.502 -3.511 667 HB ILE 84 HB ILE 84 -1.280 -11.465 -2.953 668 HG12 ILE 84 2HG1 ILE 84 -3.416 -9.993 -4.497 669 HG13 ILE 84 3HG1 ILE 84 -2.032 -10.753 -5.275 670 HG21 ILE 84 1HG2 ILE 84 -2.161 -10.179 -1.067 671 HG22 ILE 84 2HG2 ILE 84 -3.365 -9.449 -2.129 672 HG23 ILE 84 3HG2 ILE 84 -3.410 -11.182 -1.805 673 HD11 ILE 84 3HD1 ILE 84 -4.205 -12.094 -3.692 674 HD12 ILE 84 1HD1 ILE 84 -3.874 -12.246 -5.417 675 HD13 ILE 84 2HD1 ILE 84 -2.740 -12.908 -4.239 676 H VAL 85 H VAL 85 0.932 -10.906 -2.415 677 HA VAL 85 HA VAL 85 1.027 -10.141 0.263 678 HB VAL 85 HB VAL 85 3.272 -11.262 -1.420 679 HG11 VAL 85 1HG1 VAL 85 3.969 -12.166 0.887 680 HG12 VAL 85 2HG1 VAL 85 4.310 -10.476 0.513 681 HG13 VAL 85 3HG1 VAL 85 2.935 -10.894 1.536 682 HG21 VAL 85 3HG2 VAL 85 0.818 -12.405 -0.696 683 HG22 VAL 85 1HG2 VAL 85 2.228 -13.224 -1.367 684 HG23 VAL 85 2HG2 VAL 85 2.018 -13.120 0.381 685 H THR 86 H THR 86 2.873 -8.953 -2.513 686 HA THR 86 HA THR 86 4.638 -7.279 -1.124 687 HB THR 86 HB THR 86 4.767 -5.991 -3.301 688 HG1 THR 86 HG1 THR 86 3.005 -6.270 -4.467 689 HG21 THR 86 3HG2 THR 86 5.487 -8.206 -4.578 690 HG22 THR 86 1HG2 THR 86 5.286 -8.900 -2.969 691 HG23 THR 86 2HG2 THR 86 6.418 -7.571 -3.222 692 H LEU 87 H LEU 87 1.533 -6.500 -2.691 693 HA LEU 87 HA LEU 87 1.449 -3.797 -2.013 694 HB2 LEU 87 2HB LEU 87 -0.724 -5.813 -2.505 695 HB3 LEU 87 3HB LEU 87 -1.070 -4.115 -2.188 696 HG LEU 87 HG LEU 87 0.764 -4.877 -4.426 697 HD11 LEU 87 1HD1 LEU 87 -1.526 -6.130 -4.433 698 HD12 LEU 87 2HD1 LEU 87 -0.935 -5.351 -5.899 699 HD13 LEU 87 3HD1 LEU 87 -2.161 -4.556 -4.912 700 HD21 LEU 87 3HD2 LEU 87 0.796 -2.637 -4.463 701 HD22 LEU 87 1HD2 LEU 87 -0.656 -2.502 -3.471 702 HD23 LEU 87 2HD2 LEU 87 -0.797 -2.780 -5.207 703 H LYS 88 H LYS 88 0.685 -6.644 -0.142 704 HA LYS 88 HA LYS 88 -0.687 -5.279 1.957 705 HB2 LYS 88 2HB LYS 88 0.405 -8.024 1.545 706 HB3 LYS 88 3HB LYS 88 0.047 -7.513 3.189 707 HG2 LYS 88 2HG LYS 88 -2.236 -6.782 1.997 708 HG3 LYS 88 3HG LYS 88 -1.774 -8.127 0.951 709 HD2 LYS 88 2HD LYS 88 -1.315 -9.174 3.423 710 HD3 LYS 88 3HD LYS 88 -2.701 -8.128 3.737 711 HE2 LYS 88 2HE LYS 88 -3.576 -9.278 1.507 712 HE3 LYS 88 3HE LYS 88 -2.487 -10.557 2.041 713 HZ1 LYS 88 3HZ LYS 88 -3.887 -9.839 4.284 714 HZ2 LYS 88 1HZ LYS 88 -4.136 -11.224 3.344 715 HZ3 LYS 88 2HZ LYS 88 -5.048 -9.829 3.054 716 H VAL 89 H VAL 89 2.478 -6.932 1.993 717 HA VAL 89 HA VAL 89 3.387 -5.881 4.396 718 HB VAL 89 HB VAL 89 5.672 -6.386 3.594 719 HG11 VAL 89 1HG1 VAL 89 4.896 -8.317 4.466 720 HG12 VAL 89 2HG1 VAL 89 3.419 -8.285 3.501 721 HG13 VAL 89 3HG1 VAL 89 4.930 -8.847 2.785 722 HG21 VAL 89 3HG2 VAL 89 5.755 -5.813 1.351 723 HG22 VAL 89 1HG2 VAL 89 5.698 -7.575 1.288 724 HG23 VAL 89 2HG2 VAL 89 4.239 -6.634 0.979 725 H PHE 90 H PHE 90 3.517 -4.531 1.152 726 HA PHE 90 HA PHE 90 5.234 -2.354 1.833 727 HB2 PHE 90 2HB PHE 90 5.165 -3.037 -0.460 728 HB3 PHE 90 3HB PHE 90 3.414 -2.860 -0.523 729 HD1 PHE 90 HD1 PHE 90 6.020 -0.558 0.802 730 HD2 PHE 90 HD2 PHE 90 2.990 -1.236 -2.109 731 HE1 PHE 90 HE1 PHE 90 6.288 1.749 -0.009 732 HE2 PHE 90 HE2 PHE 90 3.253 1.070 -2.925 733 HZ PHE 90 HZ PHE 90 4.904 2.566 -1.875 734 H ALA 91 H ALA 91 1.776 -2.876 1.809 735 HA ALA 91 HA ALA 91 0.978 -0.170 2.021 736 HB1 ALA 91 1HB ALA 91 -1.140 -1.218 3.001 737 HB2 ALA 91 2HB ALA 91 -0.694 -1.663 1.354 738 HB3 ALA 91 3HB ALA 91 -0.364 -2.770 2.687 739 H VAL 92 H VAL 92 1.588 -2.681 4.456 740 HA VAL 92 HA VAL 92 1.020 -0.907 6.652 741 HB VAL 92 HB VAL 92 2.407 -3.586 6.765 742 HG11 VAL 92 1HG1 VAL 92 2.598 -3.063 8.922 743 HG12 VAL 92 2HG1 VAL 92 1.573 -1.638 8.741 744 HG13 VAL 92 3HG1 VAL 92 0.844 -3.219 9.024 745 HG21 VAL 92 3HG2 VAL 92 -0.512 -2.889 6.648 746 HG22 VAL 92 1HG2 VAL 92 0.384 -4.055 5.675 747 HG23 VAL 92 2HG2 VAL 92 0.059 -4.390 7.375 748 H ALA 93 H ALA 93 3.972 -2.623 5.607 749 HA ALA 93 HA ALA 93 5.732 -1.264 7.309 750 HB1 ALA 93 1HB ALA 93 7.505 -2.172 5.979 751 HB2 ALA 93 2HB ALA 93 6.228 -3.382 6.099 752 HB3 ALA 93 3HB ALA 93 6.414 -2.441 4.620 753 H GLY 94 H GLY 94 4.189 -0.255 4.412 754 HA2 GLY 94 2HA GLY 94 6.120 1.904 3.969 755 HA3 GLY 94 3HA GLY 94 4.800 1.461 2.897 756 H LEU 95 H LEU 95 2.568 1.849 3.813 757 HA LEU 95 HA LEU 95 2.257 4.560 4.418 758 HB2 LEU 95 2HB LEU 95 0.222 2.444 5.057 759 HB3 LEU 95 3HB LEU 95 -0.058 4.128 4.618 760 HG LEU 95 HG LEU 95 0.913 1.935 2.787 761 HD11 LEU 95 1HD1 LEU 95 -1.721 3.100 3.406 762 HD12 LEU 95 2HD1 LEU 95 -1.298 1.503 2.788 763 HD13 LEU 95 3HD1 LEU 95 -1.354 2.885 1.694 764 HD21 LEU 95 3HD2 LEU 95 1.893 3.675 1.738 765 HD22 LEU 95 1HD2 LEU 95 0.882 4.873 2.547 766 HD23 LEU 95 2HD2 LEU 95 0.252 3.978 1.164 767 H LEU 96 H LEU 96 2.024 1.707 6.522 768 HA LEU 96 HA LEU 96 1.675 3.370 8.871 769 HB2 LEU 96 2HB LEU 96 1.165 0.657 8.163 770 HB3 LEU 96 3HB LEU 96 2.211 0.681 9.581 771 HG LEU 96 HG LEU 96 -0.176 0.522 10.157 772 HD11 LEU 96 1HD1 LEU 96 -0.064 2.898 11.468 773 HD12 LEU 96 2HD1 LEU 96 1.633 2.643 11.064 774 HD13 LEU 96 3HD1 LEU 96 0.754 1.424 11.986 775 HD21 LEU 96 3HD2 LEU 96 -0.362 3.259 8.903 776 HD22 LEU 96 1HD2 LEU 96 -1.636 2.452 9.817 777 HD23 LEU 96 2HD2 LEU 96 -1.092 1.779 8.279 778 H ASN 97 H ASN 97 4.258 2.573 7.036 779 HA ASN 97 HA ASN 97 6.513 2.458 7.348 780 HB2 ASN 97 2HB ASN 97 5.835 4.066 9.822 781 HB3 ASN 97 3HB ASN 97 7.425 3.952 9.072 782 HD21 ASN 97 1HD2 ASN 97 5.299 6.126 9.530 783 HD22 ASN 97 2HD2 ASN 97 5.222 6.927 8.001 784 H MET 98 H MET 98 4.888 0.312 8.492 785 HA MET 98 HA MET 98 5.955 -0.448 11.015 786 HB2 MET 98 2HB MET 98 4.103 -1.538 9.059 787 HB3 MET 98 3HB MET 98 5.126 -2.788 9.754 788 HG2 MET 98 2HG MET 98 3.969 -0.900 11.682 789 HG3 MET 98 3HG MET 98 2.812 -1.925 10.837 790 HE1 MET 98 3HE MET 98 4.295 -3.101 14.628 791 HE2 MET 98 1HE MET 98 5.019 -1.665 13.903 792 HE3 MET 98 2HE MET 98 3.264 -1.842 13.945 793 H THR 99 H THR 99 7.268 -2.399 11.384 794 HA THR 99 HA THR 99 9.387 -2.626 9.350 795 HB THR 99 HB THR 99 10.772 -3.482 11.338 796 HG1 THR 99 HG1 THR 99 8.873 -3.657 12.733 797 HG21 THR 99 3HG2 THR 99 9.901 -0.668 10.853 798 HG22 THR 99 1HG2 THR 99 11.468 -1.424 10.566 799 HG23 THR 99 2HG2 THR 99 10.974 -1.012 12.209 800 H VAL 100 H VAL 100 7.228 -4.186 8.882 801 HA VAL 100 HA VAL 100 7.526 -6.784 10.095 802 HB VAL 100 HB VAL 100 5.822 -7.493 8.413 803 HG11 VAL 100 1HG1 VAL 100 5.437 -6.262 10.719 804 HG12 VAL 100 2HG1 VAL 100 4.747 -5.022 9.670 805 HG13 VAL 100 3HG1 VAL 100 4.092 -6.660 9.650 806 HG21 VAL 100 3HG2 VAL 100 6.618 -5.054 7.171 807 HG22 VAL 100 1HG2 VAL 100 5.504 -6.286 6.578 808 HG23 VAL 100 2HG2 VAL 100 4.903 -4.955 7.567 809 H SER 101 H SER 101 8.926 -8.287 9.487 810 HA SER 101 HA SER 101 10.168 -8.064 6.831 811 HB2 SER 101 2HB SER 101 11.129 -9.209 9.443 812 HB3 SER 101 3HB SER 101 11.889 -9.663 7.917 813 HG SER 101 HG SER 101 11.731 -7.108 9.116 814 H THR 102 H THR 102 7.588 -9.452 7.809 815 HA THR 102 HA THR 102 8.015 -11.873 6.239 816 HB THR 102 HB THR 102 7.068 -13.372 7.826 817 HG1 THR 102 HG1 THR 102 6.501 -12.441 9.981 818 HG21 THR 102 3HG2 THR 102 9.446 -12.885 8.172 819 HG22 THR 102 1HG2 THR 102 8.641 -13.256 9.696 820 HG23 THR 102 2HG2 THR 102 9.019 -11.584 9.284 821 H ALA 103 H ALA 103 6.332 -12.327 4.944 822 HA ALA 103 HA ALA 103 4.272 -10.529 4.498 823 HB1 ALA 103 1HB ALA 103 4.455 -13.456 3.809 824 HB2 ALA 103 2HB ALA 103 3.202 -12.374 3.198 825 HB3 ALA 103 3HB ALA 103 4.894 -12.082 2.793 826 H ALA 104 H ALA 104 4.453 -13.197 6.733 827 HA ALA 104 HA ALA 104 1.677 -13.445 7.258 828 HB1 ALA 104 1HB ALA 104 4.061 -14.700 8.114 829 HB2 ALA 104 2HB ALA 104 3.194 -14.169 9.556 830 HB3 ALA 104 3HB ALA 104 2.395 -15.215 8.381 831 H ALA 105 H ALA 105 4.286 -11.666 8.884 832 HA ALA 105 HA ALA 105 2.718 -10.620 10.975 833 HB1 ALA 105 1HB ALA 105 4.552 -8.906 11.144 834 HB2 ALA 105 2HB ALA 105 5.079 -10.588 11.213 835 HB3 ALA 105 3HB ALA 105 5.284 -9.660 9.728 836 H ALA 106 H ALA 106 3.330 -9.516 7.697 837 HA ALA 106 HA ALA 106 2.281 -6.911 7.965 838 HB1 ALA 106 1HB ALA 106 3.554 -7.207 6.056 839 HB2 ALA 106 2HB ALA 106 2.769 -8.732 5.644 840 HB3 ALA 106 3HB ALA 106 1.910 -7.209 5.416 841 H GLU 107 H GLU 107 0.780 -9.843 6.586 842 HA GLU 107 HA GLU 107 -1.761 -8.767 6.189 843 HB2 GLU 107 2HB GLU 107 -2.557 -11.088 6.129 844 HB3 GLU 107 3HB GLU 107 -1.069 -10.894 5.214 845 HG2 GLU 107 2HG GLU 107 0.215 -11.899 6.968 846 HG3 GLU 107 3HG GLU 107 -1.192 -11.945 8.029 847 H ASN 108 H ASN 108 -0.260 -10.081 9.063 848 HA ASN 108 HA ASN 108 -2.583 -10.412 10.623 849 HB2 ASN 108 2HB ASN 108 -0.014 -11.074 10.998 850 HB3 ASN 108 3HB ASN 108 -0.055 -9.603 11.965 851 HD21 ASN 108 1HD2 ASN 108 -0.734 -12.893 11.870 852 HD22 ASN 108 2HD2 ASN 108 -1.603 -13.015 13.358 853 H MET 109 H MET 109 -0.194 -7.760 10.634 854 HA MET 109 HA MET 109 -1.750 -6.094 12.328 855 HB2 MET 109 2HB MET 109 0.849 -6.077 11.371 856 HB3 MET 109 3HB MET 109 0.120 -4.677 10.595 857 HG2 MET 109 2HG MET 109 -0.699 -4.589 13.272 858 HG3 MET 109 3HG MET 109 1.013 -5.005 13.295 859 HE1 MET 109 3HE MET 109 -1.643 -2.737 11.750 860 HE2 MET 109 1HE MET 109 -0.784 -1.254 11.332 861 HE3 MET 109 2HE MET 109 -0.565 -2.704 10.354 862 H TYR 110 H TYR 110 -1.742 -6.701 8.934 863 HA TYR 110 HA TYR 110 -2.891 -4.274 8.044 864 HB2 TYR 110 2HB TYR 110 -1.789 -5.899 6.539 865 HB3 TYR 110 3HB TYR 110 -3.109 -7.030 6.814 866 HD1 TYR 110 HD1 TYR 110 -5.432 -6.386 6.055 867 HD2 TYR 110 HD2 TYR 110 -1.961 -4.209 4.906 868 HE1 TYR 110 HE1 TYR 110 -6.685 -5.385 4.190 869 HE2 TYR 110 HE2 TYR 110 -3.205 -3.201 3.039 870 HH TYR 110 HH TYR 110 -6.245 -4.346 2.024 871 H SER 111 H SER 111 -4.296 -7.374 9.032 872 HA SER 111 HA SER 111 -6.992 -6.336 8.689 873 HB2 SER 111 2HB SER 111 -5.852 -9.032 9.387 874 HB3 SER 111 3HB SER 111 -7.565 -8.688 9.621 875 HG SER 111 HG SER 111 -6.517 -9.504 7.437 876 H GLN 112 H GLN 112 -4.733 -7.127 11.247 877 HA GLN 112 HA GLN 112 -6.458 -7.120 13.437 878 HB2 GLN 112 2HB GLN 112 -3.550 -6.539 13.068 879 HB3 GLN 112 3HB GLN 112 -4.297 -6.177 14.619 880 HG2 GLN 112 2HG GLN 112 -4.817 -8.855 13.490 881 HG3 GLN 112 3HG GLN 112 -3.177 -8.527 14.046 882 HE21 GLN 112 1HE2 GLN 112 -5.168 -10.358 15.119 883 HE22 GLN 112 2HE2 GLN 112 -5.416 -9.890 16.763 884 H MET 113 H MET 113 -4.658 -4.421 11.978 885 HA MET 113 HA MET 113 -6.172 -2.542 13.634 886 HB2 MET 113 2HB MET 113 -3.548 -2.531 12.344 887 HB3 MET 113 3HB MET 113 -4.445 -1.040 12.089 888 HG2 MET 113 2HG MET 113 -3.224 -0.631 14.015 889 HG3 MET 113 3HG MET 113 -4.825 -1.055 14.616 890 HE1 MET 113 3HE MET 113 -2.864 -1.096 16.802 891 HE2 MET 113 1HE MET 113 -1.740 -2.446 16.959 892 HE3 MET 113 2HE MET 113 -1.483 -1.226 15.712 893 H GLY 114 H GLY 114 -6.967 -4.095 11.043 894 HA2 GLY 114 2HA GLY 114 -8.243 -3.695 9.174 895 HA3 GLY 114 3HA GLY 114 -8.879 -2.341 10.096 896 H LEU 115 H LEU 115 -5.508 -2.541 9.226 897 HA LEU 115 HA LEU 115 -4.184 -1.233 7.921 898 HB2 LEU 115 2HB LEU 115 -5.690 -2.337 6.193 899 HB3 LEU 115 3HB LEU 115 -6.586 -0.820 6.162 900 HG LEU 115 HG LEU 115 -4.604 0.352 5.367 901 HD11 LEU 115 1HD1 LEU 115 -2.778 -1.433 4.537 902 HD12 LEU 115 2HD1 LEU 115 -3.320 -2.221 6.018 903 HD13 LEU 115 3HD1 LEU 115 -2.677 -0.580 6.077 904 HD21 LEU 115 3HD2 LEU 115 -5.577 -0.172 3.426 905 HD22 LEU 115 1HD2 LEU 115 -5.908 -1.827 3.938 906 HD23 LEU 115 2HD2 LEU 115 -4.328 -1.408 3.276 907 H ASP 116 H ASP 116 -5.664 -0.011 10.075 908 HA ASP 116 HA ASP 116 -6.867 2.406 9.500 909 HB2 ASP 116 2HB ASP 116 -6.262 3.108 11.741 910 HB3 ASP 116 3HB ASP 116 -6.698 1.401 11.765 911 H THR 117 H THR 117 -5.977 4.613 9.801 912 HA THR 117 HA THR 117 -3.710 4.982 8.075 913 HB THR 117 HB THR 117 -5.692 6.494 8.035 914 HG1 THR 117 HG1 THR 117 -4.421 8.358 7.768 915 HG21 THR 117 3HG2 THR 117 -6.107 8.069 9.739 916 HG22 THR 117 1HG2 THR 117 -4.571 7.735 10.537 917 HG23 THR 117 2HG2 THR 117 -5.867 6.539 10.582 918 H ARG 118 H ARG 118 -2.017 6.658 8.721 919 HA ARG 118 HA ARG 118 -0.446 5.653 10.788 920 HB2 ARG 118 2HB ARG 118 -0.395 8.071 9.075 921 HB3 ARG 118 3HB ARG 118 0.554 8.143 10.554 922 HG2 ARG 118 2HG ARG 118 1.721 6.085 9.879 923 HG3 ARG 118 3HG ARG 118 0.802 6.083 8.372 924 HD2 ARG 118 2HD ARG 118 2.441 8.454 9.204 925 HD3 ARG 118 3HD ARG 118 3.169 7.087 8.360 926 HE ARG 118 HE ARG 118 0.967 7.821 6.871 927 HH11 ARG 118 1HH1 ARG 118 3.930 9.308 7.932 928 HH12 ARG 118 2HH1 ARG 118 4.050 10.355 6.558 929 HH21 ARG 118 1HH2 ARG 118 1.113 9.195 5.056 930 HH22 ARG 118 2HH2 ARG 118 2.446 10.291 4.923 931 HA PRO 119 HA PRO 119 -1.850 7.479 14.521 932 HB2 PRO 119 2HB PRO 119 0.473 8.095 15.785 933 HB3 PRO 119 3HB PRO 119 -0.099 6.435 15.581 934 HG2 PRO 119 2HG PRO 119 1.937 7.946 13.989 935 HG3 PRO 119 3HG PRO 119 1.989 6.272 14.571 936 HD2 PRO 119 2HD PRO 119 1.345 6.908 12.019 937 HD3 PRO 119 3HD PRO 119 0.657 5.502 12.855 938 H SER 120 H SER 120 -2.131 9.436 15.667 939 HA SER 120 HA SER 120 -2.087 11.770 14.107 940 HB2 SER 120 2HB SER 120 -3.292 11.005 16.467 941 HB3 SER 120 3HB SER 120 -2.159 12.246 16.998 942 HG SER 120 HG SER 120 -3.202 13.726 15.837 943 H MET 121 H MET 121 -0.896 13.713 14.364 944 HA MET 121 HA MET 121 1.719 13.376 15.677 945 HB2 MET 121 2HB MET 121 2.655 14.805 13.826 946 HB3 MET 121 3HB MET 121 2.144 13.194 13.339 947 HG2 MET 121 2HG MET 121 0.749 14.025 11.841 948 HG3 MET 121 3HG MET 121 -0.032 15.034 13.056 949 HE1 MET 121 3HE MET 121 2.279 16.334 9.566 950 HE2 MET 121 1HE MET 121 3.239 15.155 10.460 951 HE3 MET 121 2HE MET 121 1.586 14.766 9.983 952 H LYS 122 H LYS 122 -0.642 14.596 16.767 953 HA LYS 122 HA LYS 122 -0.192 17.462 16.620 954 HB2 LYS 122 2HB LYS 122 -2.278 15.686 17.789 955 HB3 LYS 122 3HB LYS 122 -2.060 17.275 18.511 956 HG2 LYS 122 2HG LYS 122 -2.143 17.904 15.873 957 HG3 LYS 122 3HG LYS 122 -3.230 16.515 15.936 958 HD2 LYS 122 2HD LYS 122 -4.600 17.571 17.584 959 HD3 LYS 122 3HD LYS 122 -3.432 18.878 17.797 960 HE2 LYS 122 2HE LYS 122 -3.883 19.733 15.616 961 HE3 LYS 122 3HE LYS 122 -4.847 18.318 15.198 962 HZ1 LYS 122 3HZ LYS 122 -6.257 19.083 17.220 963 HZ2 LYS 122 1HZ LYS 122 -6.455 19.843 15.722 964 HZ3 LYS 122 2HZ LYS 122 -5.537 20.586 16.932 965 H GLU 123 H GLU 123 0.155 14.823 18.942 966 HA GLU 123 HA GLU 123 1.936 16.540 20.518 967 HB2 GLU 123 2HB GLU 123 -0.528 16.172 21.431 968 HB3 GLU 123 3HB GLU 123 0.155 14.649 21.983 969 HG2 GLU 123 2HG GLU 123 0.949 15.687 23.761 970 HG3 GLU 123 3HG GLU 123 1.992 16.642 22.708 971 H ALA 124 H ALA 124 2.376 14.385 18.575 972 HA ALA 124 HA ALA 124 3.717 12.439 20.338 973 HB1 ALA 124 1HB ALA 124 3.369 11.505 17.624 974 HB2 ALA 124 2HB ALA 124 2.892 10.752 19.146 975 HB3 ALA 124 3HB ALA 124 1.827 11.924 18.371 976 H GLY 125 H GLY 125 5.710 11.481 19.420 977 HA2 GLY 125 2HA GLY 125 7.058 13.065 17.379 978 HA3 GLY 125 3HA GLY 125 7.748 13.138 18.993 979 H GLY 126 H GLY 126 8.290 11.802 16.150 980 HA2 GLY 126 2HA GLY 126 9.621 9.487 17.349 981 HA3 GLY 126 3HA GLY 126 8.498 9.183 16.032 982 H LYS 127 H LYS 127 11.672 9.593 16.755 983 HA LYS 127 HA LYS 127 12.300 10.598 14.056 984 HB2 LYS 127 2HB LYS 127 13.959 10.757 16.579 985 HB3 LYS 127 3HB LYS 127 14.500 11.274 14.987 986 HG2 LYS 127 2HG LYS 127 13.590 13.264 15.296 987 HG3 LYS 127 3HG LYS 127 12.006 12.528 15.553 988 HD2 LYS 127 2HD LYS 127 13.868 12.334 17.825 989 HD3 LYS 127 3HD LYS 127 13.342 13.969 17.419 990 HE2 LYS 127 2HE LYS 127 11.384 11.714 17.706 991 HE3 LYS 127 3HE LYS 127 11.945 12.627 19.105 992 HZ1 LYS 127 3HZ LYS 127 10.839 14.009 16.744 993 HZ2 LYS 127 1HZ LYS 127 10.957 14.562 18.339 994 HZ3 LYS 127 2HZ LYS 127 9.815 13.381 17.936 995 H GLU 128 H GLU 128 13.791 9.495 12.811 996 HA GLU 128 HA GLU 128 14.792 6.951 13.896 997 HB2 GLU 128 2HB GLU 128 12.781 6.593 12.464 998 HB3 GLU 128 3HB GLU 128 13.653 7.321 11.122 999 HG2 GLU 128 2HG GLU 128 13.767 4.957 10.887 1000 HG3 GLU 128 3HG GLU 128 15.367 5.538 11.344 1001 H GLU 129 H GLU 129 16.648 8.553 14.141 1002 HA GLU 129 HA GLU 129 18.055 9.627 12.008 1003 HB2 GLU 129 2HB GLU 129 19.234 8.463 14.537 1004 HB3 GLU 129 3HB GLU 129 20.007 9.628 13.472 1005 HG2 GLU 129 2HG GLU 129 19.229 11.115 14.952 1006 HG3 GLU 129 3HG GLU 129 17.729 10.944 14.042 1007 H GLY 130 H GLY 130 19.899 8.920 10.841 1008 HA2 GLY 130 2HA GLY 130 21.064 6.393 10.970 1009 HA3 GLY 130 3HA GLY 130 19.706 6.273 9.861 1010 HA PRO 131 HA PRO 131 23.540 7.722 7.594 1011 HB2 PRO 131 2HB PRO 131 23.554 5.718 5.762 1012 HB3 PRO 131 3HB PRO 131 24.375 5.599 7.323 1013 HG2 PRO 131 2HG PRO 131 21.710 4.515 6.497 1014 HG3 PRO 131 3HG PRO 131 22.986 3.738 7.452 1015 HD2 PRO 131 2HD PRO 131 20.791 4.848 8.584 1016 HD3 PRO 131 3HD PRO 131 22.373 4.826 9.389 1017 HA PRO 132 HA PRO 132 21.324 9.616 4.302 1018 HB2 PRO 132 2HB PRO 132 23.147 9.649 2.291 1019 HB3 PRO 132 3HB PRO 132 23.273 10.683 3.718 1020 HG2 PRO 132 2HG PRO 132 24.664 8.100 3.122 1021 HG3 PRO 132 3HG PRO 132 25.321 9.588 3.830 1022 HD2 PRO 132 2HD PRO 132 24.641 7.438 5.329 1023 HD3 PRO 132 3HD PRO 132 24.497 9.103 5.927 1024 H GLN 133 H GLN 133 23.050 6.667 3.336 1025 HA GLN 133 HA GLN 133 22.538 4.998 1.875 1026 HB2 GLN 133 2HB GLN 133 20.556 5.029 3.565 1027 HB3 GLN 133 3HB GLN 133 19.635 5.674 2.212 1028 HG2 GLN 133 2HG GLN 133 19.261 3.587 1.587 1029 HG3 GLN 133 3HG GLN 133 20.968 3.478 1.162 1030 HE21 GLN 133 1HE2 GLN 133 21.498 1.479 1.762 1031 HE22 GLN 133 2HE2 GLN 133 21.301 0.831 3.351 1032 H ALA 134 H ALA 134 23.370 5.907 -0.001 1033 HA ALA 134 HA ALA 134 21.353 6.692 -1.955 1034 HB1 ALA 134 1HB ALA 134 23.685 8.411 -1.163 1035 HB2 ALA 134 2HB ALA 134 22.902 8.557 -2.737 1036 HB3 ALA 134 3HB ALA 134 21.979 8.845 -1.262 1037 H TYR 135 H TYR 135 24.915 6.625 -1.721 1038 HA TYR 135 HA TYR 135 24.950 4.967 -4.150 1039 HB2 TYR 135 2HB TYR 135 26.162 7.272 -3.974 1040 HB3 TYR 135 3HB TYR 135 27.368 6.372 -3.061 1041 HD1 TYR 135 HD1 TYR 135 25.665 6.593 -6.343 1042 HD2 TYR 135 HD2 TYR 135 28.948 4.996 -4.158 1043 HE1 TYR 135 HE1 TYR 135 26.704 5.863 -8.450 1044 HE2 TYR 135 HE2 TYR 135 29.997 4.263 -6.259 1045 HH TYR 135 HH TYR 135 28.674 3.735 -8.888 Start of MODEL 4 1 H21 MYR 1 1H2 MYR 1 5.139 12.036 -0.140 2 H22 MYR 1 2H2 MYR 1 5.170 11.820 -1.879 3 H31 MYR 1 1H3 MYR 1 2.978 11.077 -1.800 4 H32 MYR 1 2H3 MYR 1 2.468 12.677 -1.258 5 H41 MYR 1 1H4 MYR 1 1.704 11.022 0.397 6 H42 MYR 1 2H4 MYR 1 2.949 12.020 1.151 7 H51 MYR 1 1H5 MYR 1 4.535 10.272 1.219 8 H52 MYR 1 2H5 MYR 1 3.922 9.498 -0.244 9 H61 MYR 1 1H6 MYR 1 1.944 8.602 0.976 10 H62 MYR 1 2H6 MYR 1 2.359 9.521 2.425 11 H71 MYR 1 1H7 MYR 1 3.500 7.657 3.131 12 H72 MYR 1 2H7 MYR 1 4.745 8.090 1.957 13 H81 MYR 1 1H8 MYR 1 4.085 6.445 0.411 14 H82 MYR 1 2H8 MYR 1 2.376 6.559 0.837 15 H91 MYR 1 1H9 MYR 1 2.657 5.200 2.838 16 H92 MYR 1 2H9 MYR 1 4.412 5.380 2.828 17 H101 MYR 1 1H10 MYR 1 3.721 3.115 2.028 18 H102 MYR 1 2H10 MYR 1 4.627 3.968 0.788 19 H111 MYR 1 1H11 MYR 1 2.895 3.625 -0.678 20 H112 MYR 1 2H11 MYR 1 1.871 4.643 0.322 21 H121 MYR 1 1H12 MYR 1 0.863 2.825 1.471 22 H122 MYR 1 2H12 MYR 1 2.220 1.734 1.188 23 H131 MYR 1 1H13 MYR 1 1.375 2.308 -1.450 24 H132 MYR 1 2H13 MYR 1 -0.152 2.314 -0.564 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 3.311 14.239 0.101 29 HA2 GLY 2 2HA GLY 2 4.949 16.327 -1.194 30 HA3 GLY 2 3HA GLY 2 3.198 16.457 -1.110 31 H ASN 3 H ASN 3 2.533 15.838 1.384 32 HA ASN 3 HA ASN 3 3.875 17.923 2.949 33 HB2 ASN 3 2HB ASN 3 1.444 18.161 2.620 34 HB3 ASN 3 3HB ASN 3 1.190 16.598 3.391 35 HD21 ASN 3 1HD2 ASN 3 -0.168 17.758 4.869 36 HD22 ASN 3 2HD2 ASN 3 0.535 18.606 6.200 37 H GLY 4 H GLY 4 5.576 16.064 3.087 38 HA2 GLY 4 2HA GLY 4 6.756 14.824 4.639 39 HA3 GLY 4 3HA GLY 4 5.428 15.050 5.768 40 H ALA 5 H ALA 5 5.283 12.964 6.488 41 HA ALA 5 HA ALA 5 4.676 10.771 6.512 42 HB1 ALA 5 1HB ALA 5 3.265 11.404 3.925 43 HB2 ALA 5 2HB ALA 5 2.912 10.080 5.037 44 HB3 ALA 5 3HB ALA 5 2.616 11.747 5.529 45 H SER 6 H SER 6 7.212 11.187 5.581 46 HA SER 6 HA SER 6 7.522 9.560 3.172 47 HB2 SER 6 2HB SER 6 9.934 10.201 3.366 48 HB3 SER 6 3HB SER 6 8.847 11.582 3.219 49 HG SER 6 HG SER 6 10.530 11.680 4.907 50 H ARG 7 H ARG 7 7.942 9.423 6.613 51 HA ARG 7 HA ARG 7 9.761 7.329 6.857 52 HB2 ARG 7 2HB ARG 7 7.595 8.449 8.557 53 HB3 ARG 7 3HB ARG 7 8.210 6.858 8.985 54 HG2 ARG 7 2HG ARG 7 10.305 7.657 9.508 55 HG3 ARG 7 3HG ARG 7 10.122 9.095 8.501 56 HD2 ARG 7 2HD ARG 7 9.052 10.257 10.121 57 HD3 ARG 7 3HD ARG 7 8.225 8.831 10.745 58 HE ARG 7 HE ARG 7 11.009 8.738 11.305 59 HH11 ARG 7 1HH1 ARG 7 8.024 10.219 12.312 60 HH12 ARG 7 2HH1 ARG 7 8.547 10.468 13.945 61 HH21 ARG 7 1HH2 ARG 7 11.709 9.060 13.452 62 HH22 ARG 7 2HH2 ARG 7 10.644 9.809 14.592 63 H ASP 8 H ASP 8 6.229 7.227 6.525 64 HA ASP 8 HA ASP 8 5.823 4.503 6.804 65 HB2 ASP 8 2HB ASP 8 4.389 6.714 5.444 66 HB3 ASP 8 3HB ASP 8 3.956 5.080 4.949 67 H TRP 9 H TRP 9 6.824 6.330 3.954 68 HA TRP 9 HA TRP 9 6.705 4.153 2.141 69 HB2 TRP 9 2HB TRP 9 6.692 6.396 1.275 70 HB3 TRP 9 3HB TRP 9 8.229 6.761 2.054 71 HD1 TRP 9 HD1 TRP 9 10.445 5.926 0.855 72 HE1 TRP 9 HE1 TRP 9 10.914 5.041 -1.515 73 HE3 TRP 9 HE3 TRP 9 5.643 4.982 -0.623 74 HZ2 TRP 9 HZ2 TRP 9 9.443 4.071 -3.721 75 HZ3 TRP 9 HZ3 TRP 9 5.260 4.077 -2.879 76 HH2 TRP 9 HH2 TRP 9 7.122 3.632 -4.395 77 H LYS 10 H LYS 10 9.536 5.763 3.606 78 HA LYS 10 HA LYS 10 11.460 3.953 2.754 79 HB2 LYS 10 2HB LYS 10 11.267 5.923 4.975 80 HB3 LYS 10 3HB LYS 10 12.562 4.736 5.060 81 HG2 LYS 10 2HG LYS 10 13.349 5.445 2.852 82 HG3 LYS 10 3HG LYS 10 12.062 6.652 2.791 83 HD2 LYS 10 2HD LYS 10 13.060 7.478 5.033 84 HD3 LYS 10 3HD LYS 10 14.488 6.559 4.549 85 HE2 LYS 10 2HE LYS 10 14.788 7.871 2.606 86 HE3 LYS 10 3HE LYS 10 13.186 8.593 2.756 87 HZ1 LYS 10 3HZ LYS 10 13.922 10.112 4.204 88 HZ2 LYS 10 1HZ LYS 10 15.459 9.741 3.601 89 HZ3 LYS 10 2HZ LYS 10 14.915 9.019 5.030 90 H MET 11 H MET 11 9.129 3.688 5.309 91 HA MET 11 HA MET 11 10.421 1.568 6.721 92 HB2 MET 11 2HB MET 11 8.718 3.089 7.726 93 HB3 MET 11 3HB MET 11 7.493 2.317 6.728 94 HG2 MET 11 2HG MET 11 7.179 1.020 8.518 95 HG3 MET 11 3HG MET 11 8.599 0.162 7.925 96 HE1 MET 11 3HE MET 11 7.591 2.366 11.451 97 HE2 MET 11 1HE MET 11 6.864 1.056 10.521 98 HE3 MET 11 2HE MET 11 8.021 0.691 11.802 99 H ALA 12 H ALA 12 7.476 1.593 4.702 100 HA ALA 12 HA ALA 12 7.101 -1.142 4.533 101 HB1 ALA 12 1HB ALA 12 5.850 -0.681 2.452 102 HB2 ALA 12 2HB ALA 12 5.423 0.412 3.769 103 HB3 ALA 12 3HB ALA 12 6.480 0.967 2.470 104 H ILE 13 H ILE 13 9.136 0.952 2.539 105 HA ILE 13 HA ILE 13 9.903 -1.086 0.705 106 HB ILE 13 HB ILE 13 11.281 1.522 1.357 107 HG12 ILE 13 2HG1 ILE 13 8.959 1.769 0.529 108 HG13 ILE 13 3HG1 ILE 13 10.146 2.397 -0.609 109 HG21 ILE 13 1HG2 ILE 13 11.947 0.956 -1.204 110 HG22 ILE 13 2HG2 ILE 13 12.952 0.570 0.192 111 HG23 ILE 13 3HG2 ILE 13 11.902 -0.663 -0.507 112 HD11 ILE 13 3HD1 ILE 13 9.419 1.047 -2.202 113 HD12 ILE 13 1HD1 ILE 13 9.578 -0.366 -1.159 114 HD13 ILE 13 2HD1 ILE 13 8.097 0.591 -1.127 115 H LYS 14 H LYS 14 11.227 0.136 3.723 116 HA LYS 14 HA LYS 14 13.754 -1.036 3.641 117 HB2 LYS 14 2HB LYS 14 11.988 0.081 5.687 118 HB3 LYS 14 3HB LYS 14 13.030 -1.195 6.303 119 HG2 LYS 14 2HG LYS 14 14.300 0.884 4.624 120 HG3 LYS 14 3HG LYS 14 13.762 1.360 6.236 121 HD2 LYS 14 2HD LYS 14 15.076 -1.144 6.462 122 HD3 LYS 14 3HD LYS 14 16.100 -0.083 5.491 123 HE2 LYS 14 2HE LYS 14 15.800 1.662 7.274 124 HE3 LYS 14 3HE LYS 14 15.016 0.426 8.256 125 HZ1 LYS 14 3HZ LYS 14 17.831 0.711 7.526 126 HZ2 LYS 14 1HZ LYS 14 17.222 -0.861 7.669 127 HZ3 LYS 14 2HZ LYS 14 17.138 0.201 8.982 128 H ARG 15 H ARG 15 10.701 -2.348 4.905 129 HA ARG 15 HA ARG 15 11.877 -4.885 5.553 130 HB2 ARG 15 2HB ARG 15 9.121 -3.730 5.621 131 HB3 ARG 15 3HB ARG 15 9.311 -5.476 5.698 132 HG2 ARG 15 2HG ARG 15 10.882 -3.738 7.544 133 HG3 ARG 15 3HG ARG 15 9.184 -4.078 7.883 134 HD2 ARG 15 2HD ARG 15 9.709 -6.509 7.691 135 HD3 ARG 15 3HD ARG 15 11.413 -6.079 7.550 136 HE ARG 15 HE ARG 15 9.860 -6.171 9.942 137 HH11 ARG 15 1HH1 ARG 15 12.528 -4.563 8.388 138 HH12 ARG 15 2HH1 ARG 15 13.302 -4.127 9.875 139 HH21 ARG 15 1HH2 ARG 15 10.868 -5.602 11.907 140 HH22 ARG 15 2HH2 ARG 15 12.357 -4.720 11.877 141 H CYS 16 H CYS 16 10.099 -3.526 2.860 142 HA CYS 16 HA CYS 16 9.442 -5.937 1.557 143 HB2 CYS 16 2HB CYS 16 9.624 -3.071 0.764 144 HB3 CYS 16 3HB CYS 16 9.574 -4.272 -0.520 145 HG CYS 16 HG CYS 16 7.153 -3.356 1.648 146 H SER 17 H SER 17 12.392 -4.174 1.833 147 HA SER 17 HA SER 17 13.748 -4.937 -0.469 148 HB2 SER 17 2HB SER 17 14.759 -4.436 2.334 149 HB3 SER 17 3HB SER 17 15.829 -4.705 0.958 150 HG SER 17 HG SER 17 15.250 -2.810 0.111 151 H ASN 18 H ASN 18 12.867 -6.791 2.315 152 HA ASN 18 HA ASN 18 14.646 -8.986 1.568 153 HB2 ASN 18 2HB ASN 18 12.783 -8.666 3.932 154 HB3 ASN 18 3HB ASN 18 13.851 -10.041 3.666 155 HD21 ASN 18 1HD2 ASN 18 13.713 -7.998 5.813 156 HD22 ASN 18 2HD2 ASN 18 15.305 -7.332 5.902 157 H VAL 19 H VAL 19 12.490 -8.271 -0.194 158 HA VAL 19 HA VAL 19 10.729 -10.619 0.073 159 HB VAL 19 HB VAL 19 10.267 -8.066 -1.475 160 HG11 VAL 19 1HG1 VAL 19 9.294 -9.966 -2.630 161 HG12 VAL 19 2HG1 VAL 19 8.504 -10.491 -1.142 162 HG13 VAL 19 3HG1 VAL 19 8.025 -8.976 -1.908 163 HG21 VAL 19 3HG2 VAL 19 8.468 -8.956 0.704 164 HG22 VAL 19 1HG2 VAL 19 10.043 -8.312 1.170 165 HG23 VAL 19 2HG2 VAL 19 8.936 -7.328 0.213 166 H ALA 20 H ALA 20 10.536 -12.057 -1.594 167 HA ALA 20 HA ALA 20 12.461 -11.736 -3.797 168 HB1 ALA 20 1HB ALA 20 12.410 -13.745 -2.045 169 HB2 ALA 20 2HB ALA 20 11.276 -14.390 -3.233 170 HB3 ALA 20 3HB ALA 20 12.915 -13.957 -3.722 171 H VAL 21 H VAL 21 11.746 -13.139 -5.778 172 HA VAL 21 HA VAL 21 9.088 -12.174 -6.526 173 HB VAL 21 HB VAL 21 11.247 -13.357 -8.278 174 HG11 VAL 21 1HG1 VAL 21 9.010 -13.613 -9.212 175 HG12 VAL 21 2HG1 VAL 21 8.709 -11.888 -8.987 176 HG13 VAL 21 3HG1 VAL 21 9.942 -12.428 -10.127 177 HG21 VAL 21 3HG2 VAL 21 12.248 -11.373 -8.299 178 HG22 VAL 21 1HG2 VAL 21 10.735 -10.576 -8.733 179 HG23 VAL 21 2HG2 VAL 21 11.141 -10.834 -7.036 180 H GLY 22 H GLY 22 10.976 -15.151 -6.319 181 HA2 GLY 22 2HA GLY 22 8.626 -16.708 -7.138 182 HA3 GLY 22 3HA GLY 22 10.270 -17.316 -7.009 183 H VAL 23 H VAL 23 8.918 -19.048 -5.895 184 HA VAL 23 HA VAL 23 8.356 -18.361 -3.098 185 HB VAL 23 HB VAL 23 7.706 -20.924 -4.558 186 HG11 VAL 23 1HG1 VAL 23 7.113 -19.869 -1.823 187 HG12 VAL 23 2HG1 VAL 23 6.008 -21.006 -2.599 188 HG13 VAL 23 3HG1 VAL 23 7.686 -21.465 -2.307 189 HG21 VAL 23 3HG2 VAL 23 6.333 -19.447 -5.656 190 HG22 VAL 23 1HG2 VAL 23 5.318 -19.866 -4.276 191 HG23 VAL 23 2HG2 VAL 23 6.224 -18.353 -4.277 192 H GLY 24 H GLY 24 10.267 -20.553 -5.106 193 HA2 GLY 24 2HA GLY 24 11.918 -21.130 -2.726 194 HA3 GLY 24 3HA GLY 24 11.463 -22.403 -3.848 195 H GLY 25 H GLY 25 13.280 -19.388 -3.542 196 HA2 GLY 25 2HA GLY 25 15.606 -20.152 -4.699 197 HA3 GLY 25 3HA GLY 25 14.600 -19.758 -6.085 198 H LYS 26 H LYS 26 16.961 -18.553 -4.270 199 HA LYS 26 HA LYS 26 15.917 -15.824 -4.110 200 HB2 LYS 26 2HB LYS 26 17.460 -17.203 -2.361 201 HB3 LYS 26 3HB LYS 26 18.704 -16.377 -3.290 202 HG2 LYS 26 2HG LYS 26 18.386 -14.624 -1.974 203 HG3 LYS 26 3HG LYS 26 16.816 -14.412 -2.753 204 HD2 LYS 26 2HD LYS 26 15.919 -16.069 -1.045 205 HD3 LYS 26 3HD LYS 26 17.450 -15.859 -0.192 206 HE2 LYS 26 2HE LYS 26 16.981 -13.383 -0.205 207 HE3 LYS 26 3HE LYS 26 15.364 -13.770 -0.791 208 HZ1 LYS 26 3HZ LYS 26 15.558 -13.470 1.664 209 HZ2 LYS 26 1HZ LYS 26 16.493 -14.880 1.716 210 HZ3 LYS 26 2HZ LYS 26 14.887 -14.949 1.190 211 H SER 27 H SER 27 16.310 -16.885 -6.693 212 HA SER 27 HA SER 27 18.817 -15.807 -7.684 213 HB2 SER 27 2HB SER 27 16.501 -17.057 -9.183 214 HB3 SER 27 3HB SER 27 18.078 -16.662 -9.866 215 HG SER 27 HG SER 27 18.064 -18.826 -9.301 216 H LYS 28 H LYS 28 15.420 -14.982 -7.607 217 HA LYS 28 HA LYS 28 16.088 -12.349 -8.716 218 HB2 LYS 28 2HB LYS 28 14.591 -14.292 -10.083 219 HB3 LYS 28 3HB LYS 28 13.413 -13.135 -9.477 220 HG2 LYS 28 2HG LYS 28 15.854 -12.371 -11.061 221 HG3 LYS 28 3HG LYS 28 14.261 -12.653 -11.766 222 HD2 LYS 28 2HD LYS 28 13.323 -10.809 -10.629 223 HD3 LYS 28 3HD LYS 28 14.711 -10.672 -9.548 224 HE2 LYS 28 2HE LYS 28 15.868 -9.435 -11.014 225 HE3 LYS 28 3HE LYS 28 15.411 -10.459 -12.374 226 HZ1 LYS 28 3HZ LYS 28 14.589 -8.008 -12.234 227 HZ2 LYS 28 1HZ LYS 28 13.403 -8.657 -11.215 228 HZ3 LYS 28 2HZ LYS 28 13.554 -9.219 -12.804 229 H LYS 29 H LYS 29 15.449 -10.774 -7.408 230 HA LYS 29 HA LYS 29 13.138 -11.251 -5.646 231 HB2 LYS 29 2HB LYS 29 14.293 -9.910 -3.906 232 HB3 LYS 29 3HB LYS 29 15.127 -11.411 -4.285 233 HG2 LYS 29 2HG LYS 29 16.361 -9.717 -5.989 234 HG3 LYS 29 3HG LYS 29 15.981 -8.626 -4.653 235 HD2 LYS 29 2HD LYS 29 17.097 -10.121 -3.091 236 HD3 LYS 29 3HD LYS 29 17.429 -11.263 -4.396 237 HE2 LYS 29 2HE LYS 29 19.430 -10.113 -4.216 238 HE3 LYS 29 3HE LYS 29 18.614 -9.252 -5.520 239 HZ1 LYS 29 3HZ LYS 29 17.766 -7.890 -3.388 240 HZ2 LYS 29 1HZ LYS 29 19.134 -7.467 -4.290 241 HZ3 LYS 29 2HZ LYS 29 19.305 -8.348 -2.856 242 H PHE 30 H PHE 30 12.617 -8.945 -4.561 243 HA PHE 30 HA PHE 30 12.246 -7.118 -6.834 244 HB2 PHE 30 2HB PHE 30 10.596 -7.751 -4.419 245 HB3 PHE 30 3HB PHE 30 10.443 -6.167 -5.171 246 HD1 PHE 30 HD1 PHE 30 9.825 -6.055 -7.619 247 HD2 PHE 30 HD2 PHE 30 9.511 -9.616 -5.310 248 HE1 PHE 30 HE1 PHE 30 8.275 -6.993 -9.284 249 HE2 PHE 30 HE2 PHE 30 7.962 -10.561 -6.971 250 HZ PHE 30 HZ PHE 30 7.342 -9.250 -8.962 251 H GLY 31 H GLY 31 12.017 -4.758 -6.152 252 HA2 GLY 31 2HA GLY 31 13.479 -3.936 -3.810 253 HA3 GLY 31 3HA GLY 31 14.381 -3.713 -5.301 254 H GLU 32 H GLU 32 14.007 -1.481 -4.000 255 HA GLU 32 HA GLU 32 11.620 -0.091 -4.231 256 HB2 GLU 32 2HB GLU 32 13.633 0.686 -2.988 257 HB3 GLU 32 3HB GLU 32 14.396 1.067 -4.525 258 HG2 GLU 32 2HG GLU 32 11.976 2.379 -4.667 259 HG3 GLU 32 3HG GLU 32 12.459 2.574 -2.983 260 H GLY 33 H GLY 33 13.968 -0.894 -6.663 261 HA2 GLY 33 2HA GLY 33 13.251 1.041 -8.600 262 HA3 GLY 33 3HA GLY 33 14.059 -0.487 -8.922 263 H ASN 34 H ASN 34 12.338 -2.402 -8.377 264 HA ASN 34 HA ASN 34 10.503 -2.316 -10.509 265 HB2 ASN 34 2HB ASN 34 11.028 -4.206 -8.251 266 HB3 ASN 34 3HB ASN 34 9.560 -4.407 -9.203 267 HD21 ASN 34 1HD2 ASN 34 10.180 -3.997 -11.694 268 HD22 ASN 34 2HD2 ASN 34 11.451 -5.032 -12.241 269 H PHE 35 H PHE 35 10.240 -1.436 -7.166 270 HA PHE 35 HA PHE 35 7.433 -1.561 -6.901 271 HB2 PHE 35 2HB PHE 35 9.642 -0.188 -5.434 272 HB3 PHE 35 3HB PHE 35 7.986 0.315 -5.115 273 HD1 PHE 35 HD1 PHE 35 9.439 -3.048 -5.784 274 HD2 PHE 35 HD2 PHE 35 7.409 -0.505 -3.040 275 HE1 PHE 35 HE1 PHE 35 9.169 -4.941 -4.235 276 HE2 PHE 35 HE2 PHE 35 7.137 -2.393 -1.486 277 HZ PHE 35 HZ PHE 35 8.018 -4.614 -2.082 278 H ARG 36 H ARG 36 9.553 1.249 -7.481 279 HA ARG 36 HA ARG 36 7.491 3.097 -7.918 280 HB2 ARG 36 2HB ARG 36 9.239 4.473 -9.025 281 HB3 ARG 36 3HB ARG 36 9.736 3.849 -7.458 282 HG2 ARG 36 2HG ARG 36 11.071 2.140 -8.512 283 HG3 ARG 36 3HG ARG 36 10.499 2.638 -10.106 284 HD2 ARG 36 2HD ARG 36 11.559 4.806 -9.833 285 HD3 ARG 36 3HD ARG 36 12.075 4.369 -8.204 286 HE ARG 36 HE ARG 36 13.840 3.256 -9.123 287 HH11 ARG 36 1HH1 ARG 36 11.389 3.662 -11.563 288 HH12 ARG 36 2HH1 ARG 36 12.366 3.011 -12.837 289 HH21 ARG 36 1HH2 ARG 36 15.135 2.398 -10.793 290 HH22 ARG 36 2HH2 ARG 36 14.496 2.291 -12.398 291 H TRP 37 H TRP 37 9.139 0.882 -10.092 292 HA TRP 37 HA TRP 37 8.233 1.925 -12.530 293 HB2 TRP 37 2HB TRP 37 9.995 0.299 -12.533 294 HB3 TRP 37 3HB TRP 37 8.978 -0.889 -11.722 295 HD1 TRP 37 HD1 TRP 37 9.760 0.537 -15.149 296 HE1 TRP 37 HE1 TRP 37 8.550 -0.861 -16.940 297 HE3 TRP 37 HE3 TRP 37 6.819 -2.321 -12.096 298 HZ2 TRP 37 HZ2 TRP 37 6.605 -2.904 -17.044 299 HZ3 TRP 37 HZ3 TRP 37 5.311 -3.973 -13.121 300 HH2 TRP 37 HH2 TRP 37 5.208 -4.257 -15.544 301 H ALA 38 H ALA 38 6.800 -0.481 -10.359 302 HA ALA 38 HA ALA 38 4.520 -0.913 -12.053 303 HB1 ALA 38 1HB ALA 38 5.120 -2.763 -10.745 304 HB2 ALA 38 2HB ALA 38 5.237 -1.796 -9.275 305 HB3 ALA 38 3HB ALA 38 3.658 -2.134 -9.985 306 H ILE 39 H ILE 39 5.015 0.661 -8.895 307 HA ILE 39 HA ILE 39 2.448 1.547 -8.425 308 HB ILE 39 HB ILE 39 5.013 3.009 -7.787 309 HG12 ILE 39 2HG1 ILE 39 3.439 1.377 -5.832 310 HG13 ILE 39 3HG1 ILE 39 4.517 0.560 -6.958 311 HG21 ILE 39 1HG2 ILE 39 3.704 4.092 -6.008 312 HG22 ILE 39 2HG2 ILE 39 3.105 4.492 -7.617 313 HG23 ILE 39 3HG2 ILE 39 2.247 3.312 -6.626 314 HD11 ILE 39 3HD1 ILE 39 6.309 2.178 -6.114 315 HD12 ILE 39 1HD1 ILE 39 5.194 2.503 -4.787 316 HD13 ILE 39 2HD1 ILE 39 5.802 0.868 -5.048 317 H ARG 40 H ARG 40 5.013 3.194 -10.253 318 HA ARG 40 HA ARG 40 3.446 5.468 -10.904 319 HB2 ARG 40 2HB ARG 40 5.872 5.566 -10.967 320 HB3 ARG 40 3HB ARG 40 5.918 4.332 -12.219 321 HG2 ARG 40 2HG ARG 40 5.279 5.775 -13.865 322 HG3 ARG 40 3HG ARG 40 4.384 6.816 -12.757 323 HD2 ARG 40 2HD ARG 40 6.407 7.763 -11.904 324 HD3 ARG 40 3HD ARG 40 7.387 6.587 -12.780 325 HE ARG 40 HE ARG 40 6.218 8.999 -13.828 326 HH11 ARG 40 1HH1 ARG 40 7.468 5.842 -14.595 327 HH12 ARG 40 2HH1 ARG 40 7.848 6.248 -16.236 328 HH21 ARG 40 1HH2 ARG 40 6.714 9.546 -15.986 329 HH22 ARG 40 2HH2 ARG 40 7.420 8.356 -17.026 330 H MET 41 H MET 41 4.405 2.624 -12.829 331 HA MET 41 HA MET 41 3.057 3.224 -15.166 332 HB2 MET 41 2HB MET 41 4.608 1.357 -15.000 333 HB3 MET 41 3HB MET 41 3.519 0.516 -13.904 334 HG2 MET 41 2HG MET 41 1.842 0.412 -15.714 335 HG3 MET 41 3HG MET 41 3.014 1.154 -16.800 336 HE1 MET 41 3HE MET 41 3.474 -2.387 -14.299 337 HE2 MET 41 1HE MET 41 1.960 -1.537 -14.610 338 HE3 MET 41 2HE MET 41 2.357 -2.993 -15.523 339 H ALA 42 H ALA 42 1.809 2.065 -12.132 340 HA ALA 42 HA ALA 42 -0.736 1.230 -13.135 341 HB1 ALA 42 1HB ALA 42 -1.368 0.941 -10.855 342 HB2 ALA 42 2HB ALA 42 0.306 0.409 -11.013 343 HB3 ALA 42 3HB ALA 42 -0.056 1.981 -10.299 344 H ASN 43 H ASN 43 0.319 4.065 -11.244 345 HA ASN 43 HA ASN 43 -2.107 5.407 -11.164 346 HB2 ASN 43 2HB ASN 43 0.747 6.207 -10.942 347 HB3 ASN 43 3HB ASN 43 -0.420 7.494 -11.229 348 HD21 ASN 43 1HD2 ASN 43 0.899 7.670 -8.967 349 HD22 ASN 43 2HD2 ASN 43 -0.071 7.212 -7.612 350 H VAL 44 H VAL 44 0.152 5.047 -13.774 351 HA VAL 44 HA VAL 44 -1.097 7.140 -15.364 352 HB VAL 44 HB VAL 44 1.104 5.207 -16.107 353 HG11 VAL 44 1HG1 VAL 44 -0.347 7.304 -17.587 354 HG12 VAL 44 2HG1 VAL 44 1.408 7.302 -17.768 355 HG13 VAL 44 3HG1 VAL 44 0.476 5.860 -18.175 356 HG21 VAL 44 3HG2 VAL 44 2.571 6.559 -15.113 357 HG22 VAL 44 1HG2 VAL 44 1.850 7.990 -15.850 358 HG23 VAL 44 2HG2 VAL 44 1.198 7.351 -14.341 359 H SER 45 H SER 45 -0.463 3.650 -15.766 360 HA SER 45 HA SER 45 -1.993 3.223 -18.027 361 HB2 SER 45 2HB SER 45 -1.345 1.414 -15.700 362 HB3 SER 45 3HB SER 45 -2.246 0.847 -17.105 363 HG SER 45 HG SER 45 -0.495 1.148 -18.369 364 H THR 46 H THR 46 -2.999 3.229 -14.638 365 HA THR 46 HA THR 46 -5.730 2.563 -15.276 366 HB THR 46 HB THR 46 -6.187 2.731 -12.938 367 HG1 THR 46 HG1 THR 46 -3.844 4.292 -12.924 368 HG21 THR 46 3HG2 THR 46 -3.562 1.703 -12.388 369 HG22 THR 46 1HG2 THR 46 -4.115 1.130 -13.961 370 HG23 THR 46 2HG2 THR 46 -5.091 0.836 -12.522 371 H GLY 47 H GLY 47 -3.846 5.439 -14.956 372 HA2 GLY 47 2HA GLY 47 -6.251 7.027 -15.510 373 HA3 GLY 47 3HA GLY 47 -5.235 7.496 -14.155 374 H ARG 48 H ARG 48 -3.231 8.439 -14.531 375 HA ARG 48 HA ARG 48 -1.941 8.632 -17.000 376 HB2 ARG 48 2HB ARG 48 -4.253 10.163 -16.995 377 HB3 ARG 48 3HB ARG 48 -2.988 11.326 -16.622 378 HG2 ARG 48 2HG ARG 48 -1.882 10.951 -18.642 379 HG3 ARG 48 3HG ARG 48 -2.734 9.432 -18.928 380 HD2 ARG 48 2HD ARG 48 -3.579 11.199 -20.381 381 HD3 ARG 48 3HD ARG 48 -4.820 10.657 -19.253 382 HE ARG 48 HE ARG 48 -3.528 12.841 -18.104 383 HH11 ARG 48 1HH1 ARG 48 -5.536 12.136 -20.859 384 HH12 ARG 48 2HH1 ARG 48 -6.236 13.720 -20.918 385 HH21 ARG 48 1HH2 ARG 48 -4.441 14.930 -18.172 386 HH22 ARG 48 2HH2 ARG 48 -5.612 15.309 -19.390 387 H GLU 49 H GLU 49 0.085 9.248 -16.593 388 HA GLU 49 HA GLU 49 1.914 10.095 -15.538 389 HB2 GLU 49 2HB GLU 49 -0.152 12.130 -15.204 390 HB3 GLU 49 3HB GLU 49 1.051 12.168 -13.922 391 HG2 GLU 49 2HG GLU 49 1.830 13.645 -15.561 392 HG3 GLU 49 3HG GLU 49 2.801 12.186 -15.744 393 HA PRO 50 HA PRO 50 2.170 8.296 -11.547 394 HB2 PRO 50 2HB PRO 50 4.133 9.756 -10.369 395 HB3 PRO 50 3HB PRO 50 4.446 8.592 -11.662 396 HG2 PRO 50 2HG PRO 50 4.182 11.570 -11.816 397 HG3 PRO 50 3HG PRO 50 5.360 10.509 -12.611 398 HD2 PRO 50 2HD PRO 50 3.190 11.497 -13.895 399 HD3 PRO 50 3HD PRO 50 3.883 9.907 -14.275 400 H GLY 51 H GLY 51 2.223 11.861 -11.394 401 HA2 GLY 51 2HA GLY 51 1.044 13.321 -10.064 402 HA3 GLY 51 3HA GLY 51 -0.034 11.988 -9.678 403 H ASP 52 H ASP 52 0.425 10.662 -7.879 404 HA ASP 52 HA ASP 52 2.654 11.337 -6.161 405 HB2 ASP 52 2HB ASP 52 0.122 12.583 -5.775 406 HB3 ASP 52 3HB ASP 52 0.366 11.436 -4.461 407 H ILE 53 H ILE 53 2.236 10.076 -3.939 408 HA ILE 53 HA ILE 53 1.147 7.425 -4.611 409 HB ILE 53 HB ILE 53 3.672 7.851 -3.017 410 HG12 ILE 53 2HG1 ILE 53 4.044 8.539 -5.338 411 HG13 ILE 53 3HG1 ILE 53 4.881 7.028 -4.998 412 HG21 ILE 53 1HG2 ILE 53 3.862 5.344 -3.734 413 HG22 ILE 53 2HG2 ILE 53 2.864 5.804 -2.356 414 HG23 ILE 53 3HG2 ILE 53 2.113 5.474 -3.917 415 HD11 ILE 53 3HD1 ILE 53 2.882 7.615 -6.977 416 HD12 ILE 53 1HD1 ILE 53 3.925 6.203 -6.812 417 HD13 ILE 53 2HD1 ILE 53 2.384 6.266 -5.956 418 HA PRO 54 HA PRO 54 -0.720 8.919 -0.663 419 HB2 PRO 54 2HB PRO 54 -3.192 7.941 -1.212 420 HB3 PRO 54 3HB PRO 54 -2.641 9.526 -1.768 421 HG2 PRO 54 2HG PRO 54 -2.759 6.932 -3.258 422 HG3 PRO 54 3HG PRO 54 -3.210 8.558 -3.804 423 HD2 PRO 54 2HD PRO 54 -0.854 7.399 -4.467 424 HD3 PRO 54 3HD PRO 54 -1.026 9.152 -4.244 425 H GLU 55 H GLU 55 -0.850 7.728 1.159 426 HA GLU 55 HA GLU 55 -0.562 4.830 0.902 427 HB2 GLU 55 2HB GLU 55 0.309 4.830 3.107 428 HB3 GLU 55 3HB GLU 55 1.024 6.219 2.301 429 HG2 GLU 55 2HG GLU 55 -0.842 7.588 3.357 430 HG3 GLU 55 3HG GLU 55 -1.144 6.177 4.369 431 H THR 56 H THR 56 -3.131 6.289 0.556 432 HA THR 56 HA THR 56 -4.708 5.541 2.869 433 HB THR 56 HB THR 56 -6.570 6.554 1.786 434 HG1 THR 56 HG1 THR 56 -5.163 7.013 -0.604 435 HG21 THR 56 3HG2 THR 56 -4.214 8.217 0.915 436 HG22 THR 56 1HG2 THR 56 -4.705 8.059 2.601 437 HG23 THR 56 2HG2 THR 56 -5.807 8.774 1.425 438 H LEU 57 H LEU 57 -5.598 3.610 3.149 439 HA LEU 57 HA LEU 57 -5.296 1.441 1.471 440 HB2 LEU 57 2HB LEU 57 -6.824 2.070 3.859 441 HB3 LEU 57 3HB LEU 57 -7.652 0.908 2.823 442 HG LEU 57 HG LEU 57 -6.350 -0.226 4.530 443 HD11 LEU 57 1HD1 LEU 57 -6.315 -0.759 1.824 444 HD12 LEU 57 2HD1 LEU 57 -5.845 -1.866 3.113 445 HD13 LEU 57 3HD1 LEU 57 -4.621 -0.893 2.297 446 HD21 LEU 57 3HD2 LEU 57 -3.943 1.116 3.305 447 HD22 LEU 57 1HD2 LEU 57 -3.935 -0.062 4.618 448 HD23 LEU 57 2HD2 LEU 57 -4.658 1.528 4.864 449 H ASP 58 H ASP 58 -7.744 3.921 1.441 450 HA ASP 58 HA ASP 58 -9.643 2.601 -0.181 451 HB2 ASP 58 2HB ASP 58 -10.374 4.526 1.002 452 HB3 ASP 58 3HB ASP 58 -9.076 5.516 0.341 453 H GLN 59 H GLN 59 -7.237 5.090 -1.051 454 HA GLN 59 HA GLN 59 -7.638 4.939 -3.818 455 HB2 GLN 59 2HB GLN 59 -5.214 5.780 -2.225 456 HB3 GLN 59 3HB GLN 59 -5.355 5.981 -3.966 457 HG2 GLN 59 2HG GLN 59 -7.211 7.194 -1.931 458 HG3 GLN 59 3HG GLN 59 -5.871 8.030 -2.712 459 HE21 GLN 59 1HE2 GLN 59 -8.876 8.351 -2.728 460 HE22 GLN 59 2HE2 GLN 59 -9.281 8.448 -4.404 461 H LEU 60 H LEU 60 -5.154 3.391 -1.790 462 HA LEU 60 HA LEU 60 -3.805 2.016 -3.792 463 HB2 LEU 60 2HB LEU 60 -3.468 2.252 -1.157 464 HB3 LEU 60 3HB LEU 60 -4.197 0.648 -1.191 465 HG LEU 60 HG LEU 60 -1.757 0.536 -1.130 466 HD11 LEU 60 1HD1 LEU 60 -1.462 -1.043 -2.896 467 HD12 LEU 60 2HD1 LEU 60 -2.784 -0.336 -3.824 468 HD13 LEU 60 3HD1 LEU 60 -3.122 -1.184 -2.315 469 HD21 LEU 60 3HD2 LEU 60 -0.380 1.376 -2.874 470 HD22 LEU 60 1HD2 LEU 60 -1.423 2.703 -2.359 471 HD23 LEU 60 2HD2 LEU 60 -1.779 1.829 -3.850 472 H ARG 61 H ARG 61 -6.613 1.001 -1.874 473 HA ARG 61 HA ARG 61 -6.863 -1.594 -2.851 474 HB2 ARG 61 2HB ARG 61 -8.157 -0.878 -0.953 475 HB3 ARG 61 3HB ARG 61 -8.971 0.352 -1.910 476 HG2 ARG 61 2HG ARG 61 -10.095 -1.356 -3.207 477 HG3 ARG 61 3HG ARG 61 -9.228 -2.618 -2.329 478 HD2 ARG 61 2HD ARG 61 -10.932 -2.645 -0.897 479 HD3 ARG 61 3HD ARG 61 -10.378 -1.067 -0.339 480 HE ARG 61 HE ARG 61 -12.093 -0.935 -2.640 481 HH11 ARG 61 1HH1 ARG 61 -11.979 -1.094 0.836 482 HH12 ARG 61 2HH1 ARG 61 -13.534 -0.361 1.051 483 HH21 ARG 61 1HH2 ARG 61 -14.141 0.031 -2.370 484 HH22 ARG 61 2HH2 ARG 61 -14.763 0.277 -0.774 485 H LEU 62 H LEU 62 -8.134 1.450 -4.132 486 HA LEU 62 HA LEU 62 -9.623 0.294 -6.244 487 HB2 LEU 62 2HB LEU 62 -10.028 2.555 -5.422 488 HB3 LEU 62 3HB LEU 62 -8.437 3.055 -5.994 489 HG LEU 62 HG LEU 62 -9.207 2.556 -8.321 490 HD11 LEU 62 1HD1 LEU 62 -11.929 2.377 -7.041 491 HD12 LEU 62 2HD1 LEU 62 -11.022 1.004 -7.675 492 HD13 LEU 62 3HD1 LEU 62 -11.556 2.286 -8.762 493 HD21 LEU 62 3HD2 LEU 62 -9.334 4.819 -7.030 494 HD22 LEU 62 1HD2 LEU 62 -11.075 4.549 -7.118 495 HD23 LEU 62 2HD2 LEU 62 -10.123 4.651 -8.599 496 H VAL 63 H VAL 63 -6.335 1.585 -6.037 497 HA VAL 63 HA VAL 63 -5.625 1.495 -8.717 498 HB VAL 63 HB VAL 63 -3.828 0.841 -6.378 499 HG11 VAL 63 1HG1 VAL 63 -2.078 1.817 -7.907 500 HG12 VAL 63 2HG1 VAL 63 -2.724 0.248 -8.392 501 HG13 VAL 63 3HG1 VAL 63 -3.269 1.716 -9.203 502 HG21 VAL 63 3HG2 VAL 63 -5.167 3.277 -7.112 503 HG22 VAL 63 1HG2 VAL 63 -4.145 2.939 -5.716 504 HG23 VAL 63 2HG2 VAL 63 -3.419 3.479 -7.230 505 H ILE 64 H ILE 64 -5.506 -1.078 -6.284 506 HA ILE 64 HA ILE 64 -4.284 -3.024 -7.918 507 HB ILE 64 HB ILE 64 -6.145 -3.436 -5.575 508 HG12 ILE 64 2HG1 ILE 64 -3.124 -3.311 -5.709 509 HG13 ILE 64 3HG1 ILE 64 -4.174 -2.083 -5.010 510 HG21 ILE 64 1HG2 ILE 64 -4.181 -5.322 -6.871 511 HG22 ILE 64 2HG2 ILE 64 -5.098 -5.644 -5.400 512 HG23 ILE 64 3HG2 ILE 64 -5.939 -5.442 -6.936 513 HD11 ILE 64 3HD1 ILE 64 -3.478 -4.790 -3.977 514 HD12 ILE 64 1HD1 ILE 64 -3.449 -3.229 -3.156 515 HD13 ILE 64 2HD1 ILE 64 -4.989 -4.021 -3.494 516 H CYS 65 H CYS 65 -7.713 -2.609 -7.024 517 HA CYS 65 HA CYS 65 -8.765 -4.634 -8.602 518 HB2 CYS 65 2HB CYS 65 -9.958 -3.217 -6.853 519 HB3 CYS 65 3HB CYS 65 -10.155 -2.002 -8.110 520 HG CYS 65 HG CYS 65 -11.197 -5.030 -9.050 521 H ASP 66 H ASP 66 -8.151 -1.243 -9.429 522 HA ASP 66 HA ASP 66 -9.262 -1.235 -11.986 523 HB2 ASP 66 2HB ASP 66 -7.164 0.375 -10.604 524 HB3 ASP 66 3HB ASP 66 -7.325 0.544 -12.350 525 H LEU 67 H LEU 67 -5.935 -1.970 -10.974 526 HA LEU 67 HA LEU 67 -4.926 -2.470 -13.554 527 HB2 LEU 67 2HB LEU 67 -3.980 -2.557 -10.886 528 HB3 LEU 67 3HB LEU 67 -3.593 -4.104 -11.637 529 HG LEU 67 HG LEU 67 -2.880 -1.535 -13.002 530 HD11 LEU 67 1HD1 LEU 67 -1.919 -1.212 -10.859 531 HD12 LEU 67 2HD1 LEU 67 -0.627 -1.780 -11.915 532 HD13 LEU 67 3HD1 LEU 67 -1.382 -2.889 -10.771 533 HD21 LEU 67 3HD2 LEU 67 -2.391 -3.186 -14.476 534 HD22 LEU 67 1HD2 LEU 67 -2.202 -4.408 -13.218 535 HD23 LEU 67 2HD2 LEU 67 -0.905 -3.254 -13.528 536 H GLN 68 H GLN 68 -6.655 -4.472 -11.267 537 HA GLN 68 HA GLN 68 -6.102 -6.977 -12.446 538 HB2 GLN 68 2HB GLN 68 -7.413 -6.135 -10.191 539 HB3 GLN 68 3HB GLN 68 -8.743 -6.702 -11.193 540 HG2 GLN 68 2HG GLN 68 -6.317 -8.400 -10.785 541 HG3 GLN 68 3HG GLN 68 -7.593 -8.341 -9.571 542 HE21 GLN 68 1HE2 GLN 68 -9.854 -8.592 -10.572 543 HE22 GLN 68 2HE2 GLN 68 -10.023 -9.877 -11.714 544 H GLU 69 H GLU 69 -8.974 -4.878 -12.716 545 HA GLU 69 HA GLU 69 -10.369 -6.377 -14.588 546 HB2 GLU 69 2HB GLU 69 -10.781 -3.993 -13.306 547 HB3 GLU 69 3HB GLU 69 -10.568 -3.471 -14.971 548 HG2 GLU 69 2HG GLU 69 -12.494 -4.429 -15.669 549 HG3 GLU 69 3HG GLU 69 -12.383 -5.756 -14.514 550 H ARG 70 H ARG 70 -7.942 -3.846 -15.106 551 HA ARG 70 HA ARG 70 -8.108 -3.938 -17.951 552 HB2 ARG 70 2HB ARG 70 -6.752 -2.380 -15.983 553 HB3 ARG 70 3HB ARG 70 -5.558 -2.976 -17.129 554 HG2 ARG 70 2HG ARG 70 -6.145 -1.064 -18.191 555 HG3 ARG 70 3HG ARG 70 -7.368 -2.137 -18.874 556 HD2 ARG 70 2HD ARG 70 -8.636 -1.334 -16.638 557 HD3 ARG 70 3HD ARG 70 -7.645 0.089 -16.957 558 HE ARG 70 HE ARG 70 -8.979 -0.772 -19.309 559 HH11 ARG 70 1HH1 ARG 70 -9.486 0.891 -16.293 560 HH12 ARG 70 2HH1 ARG 70 -10.814 1.833 -16.886 561 HH21 ARG 70 1HH2 ARG 70 -10.726 0.463 -20.101 562 HH22 ARG 70 2HH2 ARG 70 -11.519 1.588 -19.052 563 H ARG 71 H ARG 71 -6.320 -5.695 -15.542 564 HA ARG 71 HA ARG 71 -4.268 -6.707 -17.200 565 HB2 ARG 71 2HB ARG 71 -4.067 -6.792 -14.788 566 HB3 ARG 71 3HB ARG 71 -5.490 -7.818 -14.670 567 HG2 ARG 71 2HG ARG 71 -3.273 -8.818 -16.347 568 HG3 ARG 71 3HG ARG 71 -2.996 -8.762 -14.604 569 HD2 ARG 71 2HD ARG 71 -5.527 -9.830 -14.809 570 HD3 ARG 71 3HD ARG 71 -4.677 -10.546 -16.178 571 HE ARG 71 HE ARG 71 -3.022 -10.787 -13.959 572 HH11 ARG 71 1HH1 ARG 71 -6.130 -11.936 -15.025 573 HH12 ARG 71 2HH1 ARG 71 -6.036 -13.416 -14.129 574 HH21 ARG 71 1HH2 ARG 71 -2.886 -12.732 -12.774 575 HH22 ARG 71 2HH2 ARG 71 -4.191 -13.867 -12.848 576 H GLU 72 H GLU 72 -7.536 -7.797 -16.489 577 HA GLU 72 HA GLU 72 -7.231 -10.294 -17.881 578 HB2 GLU 72 2HB GLU 72 -9.197 -9.058 -16.189 579 HB3 GLU 72 3HB GLU 72 -9.973 -9.657 -17.649 580 HG2 GLU 72 2HG GLU 72 -8.144 -11.619 -16.647 581 HG3 GLU 72 3HG GLU 72 -9.243 -11.107 -15.367 582 H LYS 73 H LYS 73 -9.198 -7.382 -18.501 583 HA LYS 73 HA LYS 73 -10.119 -8.035 -21.019 584 HB2 LYS 73 2HB LYS 73 -10.166 -5.777 -19.371 585 HB3 LYS 73 3HB LYS 73 -9.436 -5.222 -20.871 586 HG2 LYS 73 2HG LYS 73 -11.436 -6.429 -21.996 587 HG3 LYS 73 3HG LYS 73 -12.169 -6.325 -20.393 588 HD2 LYS 73 2HD LYS 73 -12.908 -4.352 -21.274 589 HD3 LYS 73 3HD LYS 73 -11.373 -3.807 -20.594 590 HE2 LYS 73 2HE LYS 73 -10.361 -3.654 -22.657 591 HE3 LYS 73 3HE LYS 73 -11.439 -4.839 -23.392 592 HZ1 LYS 73 3HZ LYS 73 -11.635 -2.165 -23.693 593 HZ2 LYS 73 1HZ LYS 73 -12.776 -2.459 -22.478 594 HZ3 LYS 73 2HZ LYS 73 -12.894 -3.264 -23.961 595 H PHE 74 H PHE 74 -6.968 -6.899 -20.054 596 HA PHE 74 HA PHE 74 -6.137 -6.537 -22.829 597 HB2 PHE 74 2HB PHE 74 -5.498 -4.948 -20.917 598 HB3 PHE 74 3HB PHE 74 -4.387 -6.211 -20.399 599 HD1 PHE 74 HD1 PHE 74 -5.178 -3.827 -23.086 600 HD2 PHE 74 HD2 PHE 74 -2.353 -6.620 -21.558 601 HE1 PHE 74 HE1 PHE 74 -3.496 -2.990 -24.675 602 HE2 PHE 74 HE2 PHE 74 -0.666 -5.787 -23.144 603 HZ PHE 74 HZ PHE 74 -1.237 -3.969 -24.704 604 H GLY 75 H GLY 75 -5.882 -8.794 -20.213 605 HA2 GLY 75 2HA GLY 75 -5.352 -11.088 -20.646 606 HA3 GLY 75 3HA GLY 75 -4.313 -10.562 -21.962 607 H SER 76 H SER 76 -3.332 -12.374 -20.216 608 HA SER 76 HA SER 76 -1.969 -11.227 -18.001 609 HB2 SER 76 2HB SER 76 -0.791 -13.354 -17.862 610 HB3 SER 76 3HB SER 76 -2.501 -13.646 -18.179 611 HG SER 76 HG SER 76 -1.796 -14.768 -19.805 612 H SER 77 H SER 77 0.168 -10.614 -17.773 613 HA SER 77 HA SER 77 2.021 -10.738 -19.963 614 HB2 SER 77 2HB SER 77 1.934 -8.624 -20.772 615 HB3 SER 77 3HB SER 77 0.304 -8.617 -20.099 616 HG SER 77 HG SER 77 1.808 -6.837 -19.493 617 H LYS 78 H LYS 78 4.118 -10.435 -19.313 618 HA LYS 78 HA LYS 78 4.794 -10.835 -16.660 619 HB2 LYS 78 2HB LYS 78 6.443 -9.581 -18.862 620 HB3 LYS 78 3HB LYS 78 7.093 -10.138 -17.326 621 HG2 LYS 78 2HG LYS 78 6.474 -12.410 -17.835 622 HG3 LYS 78 3HG LYS 78 5.675 -11.892 -19.321 623 HD2 LYS 78 2HD LYS 78 7.702 -11.368 -20.365 624 HD3 LYS 78 3HD LYS 78 8.581 -11.322 -18.835 625 HE2 LYS 78 2HE LYS 78 9.077 -13.333 -20.194 626 HE3 LYS 78 3HE LYS 78 8.411 -13.710 -18.606 627 HZ1 LYS 78 3HZ LYS 78 6.837 -13.637 -21.124 628 HZ2 LYS 78 1HZ LYS 78 6.273 -14.104 -19.598 629 HZ3 LYS 78 2HZ LYS 78 7.429 -15.046 -20.397 630 H GLU 79 H GLU 79 4.280 -7.840 -18.400 631 HA GLU 79 HA GLU 79 5.385 -6.135 -16.399 632 HB2 GLU 79 2HB GLU 79 3.562 -5.656 -18.748 633 HB3 GLU 79 3HB GLU 79 4.021 -4.363 -17.648 634 HG2 GLU 79 2HG GLU 79 5.719 -4.042 -19.054 635 HG3 GLU 79 3HG GLU 79 6.442 -5.438 -18.256 636 H ILE 80 H ILE 80 1.993 -6.546 -17.429 637 HA ILE 80 HA ILE 80 0.807 -5.216 -15.311 638 HB ILE 80 HB ILE 80 -0.318 -7.606 -16.776 639 HG12 ILE 80 2HG1 ILE 80 0.394 -5.824 -18.309 640 HG13 ILE 80 3HG1 ILE 80 -1.361 -5.954 -18.261 641 HG21 ILE 80 1HG2 ILE 80 -1.695 -7.269 -14.920 642 HG22 ILE 80 2HG2 ILE 80 -1.546 -5.515 -15.013 643 HG23 ILE 80 3HG2 ILE 80 -2.499 -6.384 -16.216 644 HD11 ILE 80 3HD1 ILE 80 -0.692 -3.640 -18.282 645 HD12 ILE 80 1HD1 ILE 80 -1.437 -4.035 -16.732 646 HD13 ILE 80 2HD1 ILE 80 0.317 -3.890 -16.857 647 H ASP 81 H ASP 81 2.007 -8.501 -15.491 648 HA ASP 81 HA ASP 81 0.780 -9.493 -13.150 649 HB2 ASP 81 2HB ASP 81 1.701 -11.049 -14.725 650 HB3 ASP 81 3HB ASP 81 3.298 -10.317 -14.601 651 H MET 82 H MET 82 4.136 -8.387 -13.664 652 HA MET 82 HA MET 82 4.919 -8.479 -10.986 653 HB2 MET 82 2HB MET 82 5.947 -7.322 -13.470 654 HB3 MET 82 3HB MET 82 6.402 -6.407 -12.039 655 HG2 MET 82 2HG MET 82 7.068 -8.748 -11.105 656 HG3 MET 82 3HG MET 82 7.104 -9.197 -12.808 657 HE1 MET 82 3HE MET 82 10.225 -8.933 -13.718 658 HE2 MET 82 1HE MET 82 10.579 -9.262 -12.021 659 HE3 MET 82 2HE MET 82 9.146 -9.962 -12.774 660 H ALA 83 H ALA 83 2.931 -6.223 -12.661 661 HA ALA 83 HA ALA 83 3.297 -3.991 -10.936 662 HB1 ALA 83 1HB ALA 83 1.802 -2.925 -12.257 663 HB2 ALA 83 2HB ALA 83 2.146 -4.276 -13.337 664 HB3 ALA 83 3HB ALA 83 0.705 -4.305 -12.320 665 H ILE 84 H ILE 84 0.501 -6.190 -11.263 666 HA ILE 84 HA ILE 84 -0.814 -5.356 -8.945 667 HB ILE 84 HB ILE 84 -1.975 -6.657 -10.618 668 HG12 ILE 84 2HG1 ILE 84 -2.065 -8.630 -8.427 669 HG13 ILE 84 3HG1 ILE 84 -2.262 -6.955 -7.924 670 HG21 ILE 84 1HG2 ILE 84 -1.524 -8.996 -11.018 671 HG22 ILE 84 2HG2 ILE 84 -0.057 -8.058 -11.289 672 HG23 ILE 84 3HG2 ILE 84 -0.246 -8.988 -9.803 673 HD11 ILE 84 3HD1 ILE 84 -4.366 -6.972 -8.590 674 HD12 ILE 84 1HD1 ILE 84 -3.885 -7.448 -10.219 675 HD13 ILE 84 2HD1 ILE 84 -4.194 -8.680 -8.995 676 H VAL 85 H VAL 85 1.626 -7.854 -9.436 677 HA VAL 85 HA VAL 85 1.480 -9.058 -6.903 678 HB VAL 85 HB VAL 85 3.866 -8.792 -8.737 679 HG11 VAL 85 1HG1 VAL 85 4.433 -11.005 -7.446 680 HG12 VAL 85 2HG1 VAL 85 4.860 -9.432 -6.768 681 HG13 VAL 85 3HG1 VAL 85 3.425 -10.281 -6.193 682 HG21 VAL 85 3HG2 VAL 85 3.114 -10.568 -9.908 683 HG22 VAL 85 1HG2 VAL 85 2.423 -11.346 -8.484 684 HG23 VAL 85 2HG2 VAL 85 1.542 -10.051 -9.296 685 H THR 86 H THR 86 3.629 -6.487 -8.105 686 HA THR 86 HA THR 86 5.015 -6.063 -5.703 687 HB THR 86 HB THR 86 5.494 -3.766 -6.655 688 HG1 THR 86 HG1 THR 86 3.977 -3.206 -8.051 689 HG21 THR 86 3HG2 THR 86 6.524 -4.911 -8.844 690 HG22 THR 86 1HG2 THR 86 6.106 -6.366 -7.941 691 HG23 THR 86 2HG2 THR 86 7.191 -5.169 -7.233 692 H LEU 87 H LEU 87 2.191 -4.370 -7.053 693 HA LEU 87 HA LEU 87 1.834 -2.501 -5.028 694 HB2 LEU 87 2HB LEU 87 -0.046 -3.839 -6.935 695 HB3 LEU 87 3HB LEU 87 -0.654 -2.721 -5.717 696 HG LEU 87 HG LEU 87 1.336 -2.058 -7.887 697 HD11 LEU 87 1HD1 LEU 87 -0.622 -0.544 -8.575 698 HD12 LEU 87 2HD1 LEU 87 -1.613 -1.621 -7.592 699 HD13 LEU 87 3HD1 LEU 87 -0.714 -2.261 -8.968 700 HD21 LEU 87 3HD2 LEU 87 0.369 -0.611 -5.491 701 HD22 LEU 87 1HD2 LEU 87 0.509 0.312 -6.988 702 HD23 LEU 87 2HD2 LEU 87 1.920 -0.517 -6.328 703 H LYS 88 H LYS 88 0.937 -5.882 -5.169 704 HA LYS 88 HA LYS 88 -0.738 -5.826 -2.851 705 HB2 LYS 88 2HB LYS 88 0.574 -8.078 -4.374 706 HB3 LYS 88 3HB LYS 88 -0.457 -8.343 -2.974 707 HG2 LYS 88 2HG LYS 88 -1.539 -6.685 -5.179 708 HG3 LYS 88 3HG LYS 88 -1.385 -8.422 -5.451 709 HD2 LYS 88 2HD LYS 88 -2.536 -8.538 -3.075 710 HD3 LYS 88 3HD LYS 88 -3.120 -6.938 -3.540 711 HE2 LYS 88 2HE LYS 88 -4.785 -8.089 -4.518 712 HE3 LYS 88 3HE LYS 88 -3.608 -8.341 -5.806 713 HZ1 LYS 88 3HZ LYS 88 -4.217 -10.478 -5.420 714 HZ2 LYS 88 1HZ LYS 88 -4.588 -10.216 -3.790 715 HZ3 LYS 88 2HZ LYS 88 -2.975 -10.372 -4.276 716 H VAL 89 H VAL 89 2.389 -7.468 -3.370 717 HA VAL 89 HA VAL 89 2.971 -8.024 -0.732 718 HB VAL 89 HB VAL 89 4.293 -8.931 -2.564 719 HG11 VAL 89 1HG1 VAL 89 4.272 -6.694 -3.820 720 HG12 VAL 89 2HG1 VAL 89 5.687 -6.289 -2.846 721 HG13 VAL 89 3HG1 VAL 89 5.726 -7.685 -3.924 722 HG21 VAL 89 3HG2 VAL 89 6.487 -7.551 -1.265 723 HG22 VAL 89 1HG2 VAL 89 5.259 -8.074 -0.113 724 HG23 VAL 89 2HG2 VAL 89 6.018 -9.249 -1.187 725 H PHE 90 H PHE 90 3.392 -5.025 -2.498 726 HA PHE 90 HA PHE 90 5.009 -3.727 -0.553 727 HB2 PHE 90 2HB PHE 90 5.046 -2.862 -2.777 728 HB3 PHE 90 3HB PHE 90 3.295 -2.685 -2.808 729 HD1 PHE 90 HD2 PHE 90 5.762 -1.661 -0.220 730 HD2 PHE 90 HD1 PHE 90 2.893 -0.431 -3.112 731 HE1 PHE 90 HE2 PHE 90 5.988 0.664 0.551 732 HE2 PHE 90 HE1 PHE 90 3.115 1.897 -2.347 733 HZ PHE 90 HZ PHE 90 4.663 2.447 -0.512 734 H ALA 91 H ALA 91 1.529 -3.675 -1.249 735 HA ALA 91 HA ALA 91 0.857 -1.837 0.798 736 HB1 ALA 91 1HB ALA 91 -1.470 -2.741 0.463 737 HB2 ALA 91 2HB ALA 91 -0.680 -2.115 -0.985 738 HB3 ALA 91 3HB ALA 91 -0.781 -3.855 -0.718 739 H VAL 92 H VAL 92 1.015 -5.362 0.671 740 HA VAL 92 HA VAL 92 -0.075 -5.743 3.290 741 HB VAL 92 HB VAL 92 1.592 -7.698 1.705 742 HG11 VAL 92 1HG1 VAL 92 1.395 -8.700 3.742 743 HG12 VAL 92 2HG1 VAL 92 -0.104 -7.857 4.137 744 HG13 VAL 92 3HG1 VAL 92 -0.127 -9.225 3.024 745 HG21 VAL 92 3HG2 VAL 92 -0.043 -7.757 0.198 746 HG22 VAL 92 1HG2 VAL 92 -1.124 -8.341 1.464 747 HG23 VAL 92 2HG2 VAL 92 -1.008 -6.613 1.130 748 H ALA 93 H ALA 93 3.192 -6.407 2.011 749 HA ALA 93 HA ALA 93 4.398 -6.682 4.539 750 HB1 ALA 93 1HB ALA 93 5.758 -5.892 1.968 751 HB2 ALA 93 2HB ALA 93 6.498 -6.652 3.378 752 HB3 ALA 93 3HB ALA 93 5.331 -7.547 2.405 753 H GLY 94 H GLY 94 3.370 -3.914 2.845 754 HA2 GLY 94 2HA GLY 94 5.224 -2.150 4.277 755 HA3 GLY 94 3HA GLY 94 4.147 -1.675 2.971 756 H LEU 95 H LEU 95 1.770 -1.816 3.503 757 HA LEU 95 HA LEU 95 1.195 -0.175 5.695 758 HB2 LEU 95 2HB LEU 95 -0.805 -1.999 4.395 759 HB3 LEU 95 3HB LEU 95 -1.081 -0.422 5.132 760 HG LEU 95 HG LEU 95 0.319 -0.967 2.516 761 HD11 LEU 95 1HD1 LEU 95 -1.601 -0.478 1.473 762 HD12 LEU 95 2HD1 LEU 95 -2.018 0.794 2.621 763 HD13 LEU 95 3HD1 LEU 95 -2.355 -0.892 3.012 764 HD21 LEU 95 3HD2 LEU 95 -0.228 1.752 2.761 765 HD22 LEU 95 1HD2 LEU 95 1.355 0.975 2.824 766 HD23 LEU 95 2HD2 LEU 95 0.465 1.285 4.315 767 H LEU 96 H LEU 96 0.819 -3.676 5.277 768 HA LEU 96 HA LEU 96 -0.091 -3.979 8.019 769 HB2 LEU 96 2HB LEU 96 -0.180 -5.537 5.591 770 HB3 LEU 96 3HB LEU 96 0.412 -6.504 6.940 771 HG LEU 96 HG LEU 96 -2.011 -6.730 6.610 772 HD11 LEU 96 1HD1 LEU 96 -1.074 -5.415 9.147 773 HD12 LEU 96 2HD1 LEU 96 -1.232 -7.138 8.808 774 HD13 LEU 96 3HD1 LEU 96 -2.674 -6.134 8.964 775 HD21 LEU 96 3HD2 LEU 96 -3.515 -4.909 6.979 776 HD22 LEU 96 1HD2 LEU 96 -2.351 -4.410 5.751 777 HD23 LEU 96 2HD2 LEU 96 -2.187 -3.829 7.408 778 H ASN 97 H ASN 97 2.833 -3.569 6.603 779 HA ASN 97 HA ASN 97 4.993 -4.045 7.151 780 HB2 ASN 97 2HB ASN 97 3.675 -4.268 9.862 781 HB3 ASN 97 3HB ASN 97 5.420 -4.268 9.625 782 HD21 ASN 97 1HD2 ASN 97 2.544 -2.387 9.695 783 HD22 ASN 97 2HD2 ASN 97 3.291 -0.839 9.515 784 H MET 98 H MET 98 3.300 -6.276 6.299 785 HA MET 98 HA MET 98 3.693 -8.604 7.768 786 HB2 MET 98 2HB MET 98 2.615 -7.941 5.281 787 HB3 MET 98 3HB MET 98 3.903 -9.080 4.913 788 HG2 MET 98 2HG MET 98 1.873 -10.296 5.185 789 HG3 MET 98 3HG MET 98 2.921 -10.647 6.558 790 HE1 MET 98 3HE MET 98 1.530 -10.305 9.337 791 HE2 MET 98 1HE MET 98 0.098 -11.056 8.632 792 HE3 MET 98 2HE MET 98 1.702 -11.498 8.049 793 H THR 99 H THR 99 5.081 -10.492 6.880 794 HA THR 99 HA THR 99 7.791 -9.513 6.272 795 HB THR 99 HB THR 99 8.777 -11.085 7.791 796 HG1 THR 99 HG1 THR 99 7.488 -12.846 7.801 797 HG21 THR 99 3HG2 THR 99 7.380 -8.899 8.607 798 HG22 THR 99 1HG2 THR 99 8.414 -9.869 9.655 799 HG23 THR 99 2HG2 THR 99 6.674 -10.155 9.623 800 H VAL 100 H VAL 100 6.197 -10.314 4.241 801 HA VAL 100 HA VAL 100 6.634 -13.129 3.693 802 HB VAL 100 HB VAL 100 5.513 -12.628 1.520 803 HG11 VAL 100 1HG1 VAL 100 4.290 -13.354 3.564 804 HG12 VAL 100 2HG1 VAL 100 3.955 -11.657 3.911 805 HG13 VAL 100 3HG1 VAL 100 3.314 -12.403 2.446 806 HG21 VAL 100 3HG2 VAL 100 4.355 -10.122 2.173 807 HG22 VAL 100 1HG2 VAL 100 6.108 -9.955 2.277 808 HG23 VAL 100 2HG2 VAL 100 5.364 -10.537 0.788 809 H SER 101 H SER 101 8.393 -13.899 2.744 810 HA SER 101 HA SER 101 10.221 -12.042 1.415 811 HB2 SER 101 2HB SER 101 10.519 -14.724 2.703 812 HB3 SER 101 3HB SER 101 11.673 -14.255 1.455 813 HG SER 101 HG SER 101 11.423 -13.367 4.028 814 H THR 102 H THR 102 7.664 -13.383 0.332 815 HA THR 102 HA THR 102 8.817 -14.028 -2.270 816 HB THR 102 HB THR 102 7.642 -16.074 -2.565 817 HG1 THR 102 HG1 THR 102 6.386 -16.844 -0.611 818 HG21 THR 102 3HG2 THR 102 8.861 -16.067 0.198 819 HG22 THR 102 1HG2 THR 102 9.729 -16.301 -1.319 820 HG23 THR 102 2HG2 THR 102 8.552 -17.500 -0.782 821 H ALA 103 H ALA 103 7.761 -12.952 -3.796 822 HA ALA 103 HA ALA 103 5.577 -11.299 -3.343 823 HB1 ALA 103 1HB ALA 103 5.664 -12.170 -6.093 824 HB2 ALA 103 2HB ALA 103 6.036 -10.592 -5.399 825 HB3 ALA 103 3HB ALA 103 7.282 -11.838 -5.475 826 H ALA 104 H ALA 104 5.685 -14.684 -4.078 827 HA ALA 104 HA ALA 104 3.031 -14.968 -5.045 828 HB1 ALA 104 1HB ALA 104 3.598 -17.108 -5.346 829 HB2 ALA 104 2HB ALA 104 5.218 -16.612 -4.854 830 HB3 ALA 104 3HB ALA 104 4.109 -17.301 -3.668 831 H ALA 105 H ALA 105 4.494 -15.449 -1.841 832 HA ALA 105 HA ALA 105 2.130 -16.245 -0.531 833 HB1 ALA 105 1HB ALA 105 4.603 -14.936 0.592 834 HB2 ALA 105 2HB ALA 105 3.338 -15.711 1.546 835 HB3 ALA 105 3HB ALA 105 4.312 -16.668 0.430 836 H ALA 106 H ALA 106 3.572 -13.082 -1.111 837 HA ALA 106 HA ALA 106 1.923 -11.569 0.584 838 HB1 ALA 106 1HB ALA 106 2.492 -9.867 -1.492 839 HB2 ALA 106 2HB ALA 106 3.516 -10.153 -0.085 840 HB3 ALA 106 3HB ALA 106 3.803 -11.043 -1.580 841 H GLU 107 H GLU 107 1.627 -12.184 -2.917 842 HA GLU 107 HA GLU 107 -0.765 -10.826 -3.332 843 HB2 GLU 107 2HB GLU 107 0.610 -11.619 -5.175 844 HB3 GLU 107 3HB GLU 107 0.293 -13.289 -4.727 845 HG2 GLU 107 2HG GLU 107 -2.221 -12.132 -5.055 846 HG3 GLU 107 3HG GLU 107 -1.243 -11.511 -6.383 847 H ASN 108 H ASN 108 -0.229 -14.226 -2.460 848 HA ASN 108 HA ASN 108 -2.952 -14.968 -2.448 849 HB2 ASN 108 2HB ASN 108 -0.454 -16.137 -1.265 850 HB3 ASN 108 3HB ASN 108 -2.025 -16.820 -0.855 851 HD21 ASN 108 1HD2 ASN 108 0.397 -17.663 -2.527 852 HD22 ASN 108 2HD2 ASN 108 -0.311 -18.246 -3.991 853 H MET 109 H MET 109 -0.923 -13.377 -0.119 854 HA MET 109 HA MET 109 -2.527 -13.854 2.174 855 HB2 MET 109 2HB MET 109 -0.087 -12.559 1.602 856 HB3 MET 109 3HB MET 109 -1.126 -11.346 2.340 857 HG2 MET 109 2HG MET 109 -1.389 -13.730 3.840 858 HG3 MET 109 3HG MET 109 0.330 -13.441 3.579 859 HE1 MET 109 3HE MET 109 -2.259 -10.100 4.221 860 HE2 MET 109 1HE MET 109 -2.907 -11.737 4.109 861 HE3 MET 109 2HE MET 109 -2.772 -10.948 5.680 862 H TYR 110 H TYR 110 -2.214 -11.002 0.057 863 HA TYR 110 HA TYR 110 -4.212 -9.465 1.264 864 HB2 TYR 110 2HB TYR 110 -2.437 -8.897 -0.602 865 HB3 TYR 110 3HB TYR 110 -3.765 -9.289 -1.688 866 HD1 TYR 110 HD2 TYR 110 -3.033 -7.200 1.321 867 HD2 TYR 110 HD1 TYR 110 -5.233 -7.608 -2.298 868 HE1 TYR 110 HE2 TYR 110 -3.940 -4.934 1.625 869 HE2 TYR 110 HE1 TYR 110 -6.145 -5.342 -2.005 870 HH TYR 110 HH TYR 110 -5.914 -3.629 0.898 871 H SER 111 H SER 111 -4.386 -11.880 -1.300 872 HA SER 111 HA SER 111 -7.139 -11.435 -1.898 873 HB2 SER 111 2HB SER 111 -5.332 -12.568 -3.364 874 HB3 SER 111 3HB SER 111 -5.692 -14.020 -2.431 875 HG SER 111 HG SER 111 -7.152 -12.791 -4.396 876 H GLN 112 H GLN 112 -5.501 -14.165 -0.284 877 HA GLN 112 HA GLN 112 -7.769 -15.495 0.590 878 HB2 GLN 112 2HB GLN 112 -5.428 -16.364 0.682 879 HB3 GLN 112 3HB GLN 112 -5.141 -15.325 2.072 880 HG2 GLN 112 2HG GLN 112 -6.577 -16.551 3.438 881 HG3 GLN 112 3HG GLN 112 -7.363 -17.331 2.066 882 HE21 GLN 112 1HE2 GLN 112 -5.691 -18.565 0.651 883 HE22 GLN 112 2HE2 GLN 112 -4.631 -19.610 1.528 884 H MET 113 H MET 113 -6.108 -12.740 1.988 885 HA MET 113 HA MET 113 -7.320 -12.737 4.515 886 HB2 MET 113 2HB MET 113 -5.388 -11.343 3.999 887 HB3 MET 113 3HB MET 113 -6.340 -10.411 2.851 888 HG2 MET 113 2HG MET 113 -7.167 -9.104 4.443 889 HG3 MET 113 3HG MET 113 -7.552 -10.474 5.481 890 HE1 MET 113 3HE MET 113 -6.768 -9.998 7.869 891 HE2 MET 113 1HE MET 113 -5.571 -8.743 8.190 892 HE3 MET 113 2HE MET 113 -7.008 -8.367 7.240 893 H GLY 114 H GLY 114 -8.519 -11.826 1.391 894 HA2 GLY 114 2HA GLY 114 -10.880 -11.730 0.995 895 HA3 GLY 114 3HA GLY 114 -11.096 -11.153 2.641 896 H LEU 115 H LEU 115 -8.524 -9.781 0.813 897 HA LEU 115 HA LEU 115 -10.047 -7.277 0.617 898 HB2 LEU 115 2HB LEU 115 -7.069 -7.583 0.360 899 HB3 LEU 115 3HB LEU 115 -7.989 -6.114 0.677 900 HG LEU 115 HG LEU 115 -7.654 -8.414 2.602 901 HD11 LEU 115 1HD1 LEU 115 -6.311 -5.730 2.405 902 HD12 LEU 115 2HD1 LEU 115 -5.560 -7.325 2.412 903 HD13 LEU 115 3HD1 LEU 115 -6.320 -6.703 3.876 904 HD21 LEU 115 3HD2 LEU 115 -8.759 -7.034 4.207 905 HD22 LEU 115 1HD2 LEU 115 -9.787 -7.124 2.776 906 HD23 LEU 115 2HD2 LEU 115 -8.823 -5.678 3.079 907 H ASP 116 H ASP 116 -8.386 -9.685 -1.236 908 HA ASP 116 HA ASP 116 -9.056 -8.203 -3.689 909 HB2 ASP 116 2HB ASP 116 -6.715 -8.027 -3.639 910 HB3 ASP 116 3HB ASP 116 -6.515 -9.656 -2.999 911 H THR 117 H THR 117 -9.885 -9.390 -5.377 912 HA THR 117 HA THR 117 -10.936 -12.000 -4.664 913 HB THR 117 HB THR 117 -11.562 -11.225 -7.367 914 HG1 THR 117 HG1 THR 117 -12.429 -9.316 -5.467 915 HG21 THR 117 3HG2 THR 117 -12.967 -12.702 -6.107 916 HG22 THR 117 1HG2 THR 117 -13.880 -11.225 -6.415 917 HG23 THR 117 2HG2 THR 117 -13.167 -11.506 -4.827 918 H ARG 118 H ARG 118 -10.554 -13.908 -5.773 919 HA ARG 118 HA ARG 118 -8.784 -13.994 -8.040 920 HB2 ARG 118 2HB ARG 118 -7.187 -13.754 -6.170 921 HB3 ARG 118 3HB ARG 118 -7.868 -15.191 -5.420 922 HG2 ARG 118 2HG ARG 118 -7.206 -15.987 -8.002 923 HG3 ARG 118 3HG ARG 118 -5.867 -14.962 -7.480 924 HD2 ARG 118 2HD ARG 118 -5.666 -16.298 -5.428 925 HD3 ARG 118 3HD ARG 118 -6.982 -17.332 -5.983 926 HE ARG 118 HE ARG 118 -4.794 -17.155 -7.837 927 HH11 ARG 118 1HH1 ARG 118 -6.043 -18.794 -5.032 928 HH12 ARG 118 2HH1 ARG 118 -5.119 -20.235 -5.301 929 HH21 ARG 118 1HH2 ARG 118 -3.572 -19.046 -8.202 930 HH22 ARG 118 2HH2 ARG 118 -3.713 -20.377 -7.104 931 HA PRO 119 HA PRO 119 -11.902 -17.424 -7.641 932 HB2 PRO 119 2HB PRO 119 -12.945 -17.089 -10.125 933 HB3 PRO 119 3HB PRO 119 -13.521 -16.196 -8.713 934 HG2 PRO 119 2HG PRO 119 -11.626 -15.325 -10.860 935 HG3 PRO 119 3HG PRO 119 -12.956 -14.424 -10.109 936 HD2 PRO 119 2HD PRO 119 -10.367 -14.058 -9.404 937 HD3 PRO 119 3HD PRO 119 -11.705 -13.880 -8.251 938 H SER 120 H SER 120 -11.789 -19.461 -8.583 939 HA SER 120 HA SER 120 -10.199 -19.952 -10.927 940 HB2 SER 120 2HB SER 120 -9.108 -21.530 -8.705 941 HB3 SER 120 3HB SER 120 -8.271 -20.704 -10.020 942 HG SER 120 HG SER 120 -9.141 -19.659 -7.546 943 H MET 121 H MET 121 -11.192 -21.536 -11.969 944 HA MET 121 HA MET 121 -11.906 -24.001 -10.772 945 HB2 MET 121 2HB MET 121 -13.746 -22.589 -9.885 946 HB3 MET 121 3HB MET 121 -14.223 -22.215 -11.536 947 HG2 MET 121 2HG MET 121 -14.190 -24.935 -11.578 948 HG3 MET 121 3HG MET 121 -14.712 -24.605 -9.927 949 HE1 MET 121 3HE MET 121 -15.771 -24.380 -13.783 950 HE2 MET 121 1HE MET 121 -16.853 -22.991 -13.672 951 HE3 MET 121 2HE MET 121 -15.139 -22.805 -13.301 952 H LYS 122 H LYS 122 -11.503 -25.394 -12.346 953 HA LYS 122 HA LYS 122 -12.442 -24.788 -15.061 954 HB2 LYS 122 2HB LYS 122 -9.673 -25.666 -14.253 955 HB3 LYS 122 3HB LYS 122 -10.289 -25.889 -15.886 956 HG2 LYS 122 2HG LYS 122 -9.451 -23.874 -16.308 957 HG3 LYS 122 3HG LYS 122 -10.821 -23.241 -15.392 958 HD2 LYS 122 2HD LYS 122 -9.240 -22.262 -14.129 959 HD3 LYS 122 3HD LYS 122 -9.080 -23.859 -13.395 960 HE2 LYS 122 2HE LYS 122 -6.889 -23.223 -13.940 961 HE3 LYS 122 3HE LYS 122 -7.365 -24.343 -15.216 962 HZ1 LYS 122 3HZ LYS 122 -7.471 -21.383 -15.439 963 HZ2 LYS 122 1HZ LYS 122 -7.808 -22.497 -16.668 964 HZ3 LYS 122 2HZ LYS 122 -6.234 -22.354 -16.064 965 H GLU 123 H GLU 123 -12.692 -26.678 -16.424 966 HA GLU 123 HA GLU 123 -13.538 -28.752 -16.825 967 HB2 GLU 123 2HB GLU 123 -11.135 -29.258 -16.095 968 HB3 GLU 123 3HB GLU 123 -11.825 -29.729 -14.548 969 HG2 GLU 123 2HG GLU 123 -12.930 -31.558 -15.452 970 HG3 GLU 123 3HG GLU 123 -12.830 -30.929 -17.095 971 H ALA 124 H ALA 124 -15.569 -27.857 -15.930 972 HA ALA 124 HA ALA 124 -16.350 -29.274 -13.465 973 HB1 ALA 124 1HB ALA 124 -16.312 -26.871 -13.098 974 HB2 ALA 124 2HB ALA 124 -17.386 -26.628 -14.477 975 HB3 ALA 124 3HB ALA 124 -17.966 -27.480 -13.046 976 H GLY 125 H GLY 125 -16.559 -30.769 -15.631 977 HA2 GLY 125 2HA GLY 125 -19.110 -31.679 -15.778 978 HA3 GLY 125 3HA GLY 125 -19.078 -30.410 -16.993 979 H GLY 126 H GLY 126 -19.492 -31.988 -18.613 980 HA2 GLY 126 2HA GLY 126 -18.315 -32.896 -20.502 981 HA3 GLY 126 3HA GLY 126 -17.046 -33.422 -19.407 982 H LYS 127 H LYS 127 -20.111 -34.175 -20.817 983 HA LYS 127 HA LYS 127 -19.812 -36.940 -19.962 984 HB2 LYS 127 2HB LYS 127 -21.226 -35.903 -18.223 985 HB3 LYS 127 3HB LYS 127 -22.358 -35.386 -19.465 986 HG2 LYS 127 2HG LYS 127 -21.794 -38.244 -19.540 987 HG3 LYS 127 3HG LYS 127 -22.513 -37.705 -18.021 988 HD2 LYS 127 2HD LYS 127 -24.113 -36.397 -19.695 989 HD3 LYS 127 3HD LYS 127 -23.644 -37.719 -20.767 990 HE2 LYS 127 2HE LYS 127 -24.203 -39.090 -18.508 991 HE3 LYS 127 3HE LYS 127 -25.323 -37.738 -18.343 992 HZ1 LYS 127 3HZ LYS 127 -25.479 -39.994 -20.062 993 HZ2 LYS 127 1HZ LYS 127 -25.540 -38.561 -20.959 994 HZ3 LYS 127 2HZ LYS 127 -26.656 -38.829 -19.717 995 H GLU 128 H GLU 128 -19.948 -38.105 -21.754 996 HA GLU 128 HA GLU 128 -22.166 -37.946 -23.521 997 HB2 GLU 128 2HB GLU 128 -20.889 -37.323 -25.565 998 HB3 GLU 128 3HB GLU 128 -21.057 -36.007 -24.412 999 HG2 GLU 128 2HG GLU 128 -18.859 -35.813 -24.150 1000 HG3 GLU 128 3HG GLU 128 -18.637 -37.555 -23.991 1001 H GLU 129 H GLU 129 -20.767 -39.915 -21.959 1002 HA GLU 129 HA GLU 129 -20.038 -41.780 -24.116 1003 HB2 GLU 129 2HB GLU 129 -18.741 -41.626 -21.389 1004 HB3 GLU 129 3HB GLU 129 -18.375 -42.810 -22.636 1005 HG2 GLU 129 2HG GLU 129 -17.140 -41.361 -23.850 1006 HG3 GLU 129 3HG GLU 129 -18.129 -39.972 -23.406 1007 H GLY 130 H GLY 130 -22.594 -41.719 -23.391 1008 HA2 GLY 130 2HA GLY 130 -23.097 -43.564 -21.206 1009 HA3 GLY 130 3HA GLY 130 -24.306 -42.788 -22.219 1010 HA PRO 131 HA PRO 131 -23.555 -47.322 -23.407 1011 HB2 PRO 131 2HB PRO 131 -25.895 -48.337 -22.478 1012 HB3 PRO 131 3HB PRO 131 -24.425 -48.262 -21.500 1013 HG2 PRO 131 2HG PRO 131 -26.788 -46.423 -21.515 1014 HG3 PRO 131 3HG PRO 131 -25.883 -47.072 -20.134 1015 HD2 PRO 131 2HD PRO 131 -25.498 -44.564 -21.080 1016 HD3 PRO 131 3HD PRO 131 -24.191 -45.522 -20.354 1017 HA PRO 132 HA PRO 132 -26.065 -47.000 -27.003 1018 HB2 PRO 132 2HB PRO 132 -26.705 -49.587 -27.523 1019 HB3 PRO 132 3HB PRO 132 -25.080 -48.934 -27.759 1020 HG2 PRO 132 2HG PRO 132 -26.164 -50.535 -25.474 1021 HG3 PRO 132 3HG PRO 132 -24.605 -50.686 -26.306 1022 HD2 PRO 132 2HD PRO 132 -24.869 -49.426 -23.924 1023 HD3 PRO 132 3HD PRO 132 -23.669 -48.935 -25.136 1024 H GLN 133 H GLN 133 -28.000 -46.035 -26.811 1025 HA GLN 133 HA GLN 133 -30.076 -46.978 -25.108 1026 HB2 GLN 133 2HB GLN 133 -31.379 -45.155 -25.950 1027 HB3 GLN 133 3HB GLN 133 -29.726 -44.585 -25.760 1028 HG2 GLN 133 2HG GLN 133 -29.625 -45.367 -28.315 1029 HG3 GLN 133 3HG GLN 133 -31.337 -44.963 -28.201 1030 HE21 GLN 133 1HE2 GLN 133 -29.289 -43.645 -29.743 1031 HE22 GLN 133 2HE2 GLN 133 -29.226 -42.009 -29.191 1032 H ALA 134 H ALA 134 -32.113 -47.823 -25.682 1033 HA ALA 134 HA ALA 134 -33.456 -49.342 -26.723 1034 HB1 ALA 134 1HB ALA 134 -32.522 -47.963 -29.236 1035 HB2 ALA 134 2HB ALA 134 -34.017 -48.874 -29.013 1036 HB3 ALA 134 3HB ALA 134 -33.779 -47.348 -28.162 1037 H TYR 135 H TYR 135 -31.448 -50.738 -25.994 1038 HA TYR 135 HA TYR 135 -29.639 -51.792 -27.807 1039 HB2 TYR 135 2HB TYR 135 -29.557 -53.773 -26.314 1040 HB3 TYR 135 3HB TYR 135 -29.469 -52.252 -25.433 1041 HD1 TYR 135 HD2 TYR 135 -31.756 -55.015 -26.371 1042 HD2 TYR 135 HD1 TYR 135 -31.050 -51.727 -23.765 1043 HE1 TYR 135 HE2 TYR 135 -33.651 -55.724 -24.973 1044 HE2 TYR 135 HE1 TYR 135 -32.942 -52.427 -22.359 1045 HH TYR 135 HH TYR 135 -34.392 -55.449 -22.602 Start of MODEL 5 1 H21 MYR 1 1H2 MYR 1 4.980 10.860 5.217 2 H22 MYR 1 2H2 MYR 1 3.427 11.665 5.101 3 H31 MYR 1 1H3 MYR 1 3.226 11.087 7.737 4 H32 MYR 1 2H3 MYR 1 4.532 9.945 7.413 5 H41 MYR 1 1H4 MYR 1 1.973 9.965 5.691 6 H42 MYR 1 2H4 MYR 1 2.031 9.092 7.224 7 H51 MYR 1 1H5 MYR 1 3.035 7.325 6.172 8 H52 MYR 1 2H5 MYR 1 4.443 8.333 5.832 9 H61 MYR 1 1H6 MYR 1 3.945 8.031 3.609 10 H62 MYR 1 2H6 MYR 1 2.656 9.214 3.848 11 H71 MYR 1 1H7 MYR 1 0.984 7.444 4.265 12 H72 MYR 1 2H7 MYR 1 2.230 6.198 4.366 13 H81 MYR 1 1H8 MYR 1 2.763 7.251 1.827 14 H82 MYR 1 2H8 MYR 1 1.020 7.514 1.926 15 H91 MYR 1 1H9 MYR 1 0.581 5.127 2.324 16 H92 MYR 1 2H9 MYR 1 2.288 4.781 2.604 17 H101 MYR 1 1H10 MYR 1 2.375 5.934 0.047 18 H102 MYR 1 2H10 MYR 1 0.813 5.132 -0.015 19 H111 MYR 1 1H11 MYR 1 3.514 3.784 0.688 20 H112 MYR 1 2H11 MYR 1 2.715 3.728 -0.875 21 H121 MYR 1 1H12 MYR 1 1.063 2.768 1.488 22 H122 MYR 1 2H12 MYR 1 2.423 1.751 1.011 23 H131 MYR 1 1H13 MYR 1 1.283 2.308 -1.493 24 H132 MYR 1 2H13 MYR 1 -0.151 2.314 -0.463 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 3.770 13.875 5.182 29 HA2 GLY 2 2HA GLY 2 4.398 15.896 6.164 30 HA3 GLY 2 3HA GLY 2 5.365 15.001 7.328 31 H ASN 3 H ASN 3 6.263 17.336 6.085 32 HA ASN 3 HA ASN 3 8.086 16.512 3.971 33 HB2 ASN 3 2HB ASN 3 6.792 18.738 4.033 34 HB3 ASN 3 3HB ASN 3 7.977 19.244 5.234 35 HD21 ASN 3 1HD2 ASN 3 10.008 19.779 4.603 36 HD22 ASN 3 2HD2 ASN 3 10.513 19.849 2.953 37 H GLY 4 H GLY 4 9.290 15.036 5.356 38 HA2 GLY 4 2HA GLY 4 11.746 15.401 5.987 39 HA3 GLY 4 3HA GLY 4 11.073 16.404 7.264 40 H ALA 5 H ALA 5 9.953 13.276 6.018 41 HA ALA 5 HA ALA 5 10.965 11.756 8.190 42 HB1 ALA 5 1HB ALA 5 8.715 11.233 9.207 43 HB2 ALA 5 2HB ALA 5 9.366 12.834 9.561 44 HB3 ALA 5 3HB ALA 5 8.096 12.646 8.352 45 H SER 6 H SER 6 11.494 10.114 6.863 46 HA SER 6 HA SER 6 9.309 8.848 5.343 47 HB2 SER 6 2HB SER 6 12.165 8.556 4.487 48 HB3 SER 6 3HB SER 6 10.693 8.448 3.522 49 HG SER 6 HG SER 6 11.750 10.825 4.664 50 H ARG 7 H ARG 7 10.190 8.325 8.074 51 HA ARG 7 HA ARG 7 11.811 6.018 8.200 52 HB2 ARG 7 2HB ARG 7 9.778 7.208 10.075 53 HB3 ARG 7 3HB ARG 7 10.620 5.711 10.454 54 HG2 ARG 7 2HG ARG 7 12.535 6.766 10.953 55 HG3 ARG 7 3HG ARG 7 12.359 7.927 9.637 56 HD2 ARG 7 2HD ARG 7 10.327 8.386 11.601 57 HD3 ARG 7 3HD ARG 7 11.904 8.334 12.387 58 HE ARG 7 HE ARG 7 10.916 10.372 10.637 59 HH11 ARG 7 1HH1 ARG 7 13.788 8.779 11.794 60 HH12 ARG 7 2HH1 ARG 7 14.825 10.129 11.470 61 HH21 ARG 7 1HH2 ARG 7 12.271 12.156 10.206 62 HH22 ARG 7 2HH2 ARG 7 13.961 12.049 10.568 63 H ASP 8 H ASP 8 8.270 6.389 8.303 64 HA ASP 8 HA ASP 8 7.590 3.704 8.472 65 HB2 ASP 8 2HB ASP 8 6.017 5.643 8.691 66 HB3 ASP 8 3HB ASP 8 6.057 5.811 6.938 67 H TRP 9 H TRP 9 8.360 5.659 5.640 68 HA TRP 9 HA TRP 9 7.646 3.764 3.683 69 HB2 TRP 9 2HB TRP 9 8.003 6.097 3.104 70 HB3 TRP 9 3HB TRP 9 9.693 5.989 3.589 71 HD1 TRP 9 HD1 TRP 9 11.401 5.051 1.840 72 HE1 TRP 9 HE1 TRP 9 11.215 4.355 -0.630 73 HE3 TRP 9 HE3 TRP 9 6.308 4.970 1.401 74 HZ2 TRP 9 HZ2 TRP 9 9.179 3.840 -2.517 75 HZ3 TRP 9 HZ3 TRP 9 5.322 4.366 -0.771 76 HH2 TRP 9 HH2 TRP 9 6.729 3.813 -2.688 77 H LYS 10 H LYS 10 10.841 4.557 5.053 78 HA LYS 10 HA LYS 10 12.336 2.646 3.712 79 HB2 LYS 10 2HB LYS 10 12.646 4.262 6.140 80 HB3 LYS 10 3HB LYS 10 13.551 2.754 6.176 81 HG2 LYS 10 2HG LYS 10 15.010 3.437 4.610 82 HG3 LYS 10 3HG LYS 10 13.778 4.297 3.684 83 HD2 LYS 10 2HD LYS 10 13.803 5.985 5.631 84 HD3 LYS 10 3HD LYS 10 15.335 5.229 6.073 85 HE2 LYS 10 2HE LYS 10 14.883 6.141 3.264 86 HE3 LYS 10 3HE LYS 10 15.302 7.318 4.508 87 HZ1 LYS 10 3HZ LYS 10 17.407 6.650 4.490 88 HZ2 LYS 10 1HZ LYS 10 17.051 5.776 3.086 89 HZ3 LYS 10 2HZ LYS 10 16.988 5.015 4.595 90 H MET 11 H MET 11 10.351 2.328 6.598 91 HA MET 11 HA MET 11 11.218 -0.295 7.274 92 HB2 MET 11 2HB MET 11 8.982 1.496 8.097 93 HB3 MET 11 3HB MET 11 8.841 -0.219 8.462 94 HG2 MET 11 2HG MET 11 10.713 -0.196 9.856 95 HG3 MET 11 3HG MET 11 11.283 1.341 9.212 96 HE1 MET 11 3HE MET 11 10.933 1.891 12.747 97 HE2 MET 11 1HE MET 11 9.781 0.568 12.932 98 HE3 MET 11 2HE MET 11 11.217 0.353 11.931 99 H ALA 12 H ALA 12 8.281 0.920 5.663 100 HA ALA 12 HA ALA 12 7.055 -1.509 5.144 101 HB1 ALA 12 1HB ALA 12 5.916 -0.345 3.282 102 HB2 ALA 12 2HB ALA 12 5.907 0.578 4.785 103 HB3 ALA 12 3HB ALA 12 7.024 1.011 3.490 104 H ILE 13 H ILE 13 9.509 0.203 3.252 105 HA ILE 13 HA ILE 13 9.529 -1.742 1.145 106 HB ILE 13 HB ILE 13 11.545 0.410 1.798 107 HG12 ILE 13 2HG1 ILE 13 9.275 1.266 1.306 108 HG13 ILE 13 3HG1 ILE 13 10.438 1.712 0.062 109 HG21 ILE 13 1HG2 ILE 13 12.824 -0.518 0.240 110 HG22 ILE 13 2HG2 ILE 13 11.602 -1.744 -0.090 111 HG23 ILE 13 3HG2 ILE 13 11.555 -0.200 -0.942 112 HD11 ILE 13 3HD1 ILE 13 9.133 0.818 -1.476 113 HD12 ILE 13 1HD1 ILE 13 9.254 -0.753 -0.684 114 HD13 ILE 13 2HD1 ILE 13 7.971 0.369 -0.228 115 H LYS 14 H LYS 14 11.502 -1.080 3.995 116 HA LYS 14 HA LYS 14 13.643 -2.764 3.549 117 HB2 LYS 14 2HB LYS 14 13.649 -1.313 5.452 118 HB3 LYS 14 3HB LYS 14 12.208 -2.075 6.114 119 HG2 LYS 14 2HG LYS 14 13.355 -3.864 6.930 120 HG3 LYS 14 3HG LYS 14 14.601 -3.775 5.682 121 HD2 LYS 14 2HD LYS 14 15.926 -2.667 7.080 122 HD3 LYS 14 3HD LYS 14 14.718 -1.388 7.220 123 HE2 LYS 14 2HE LYS 14 14.346 -3.893 8.788 124 HE3 LYS 14 3HE LYS 14 15.549 -2.725 9.332 125 HZ1 LYS 14 3HZ LYS 14 12.680 -2.584 9.441 126 HZ2 LYS 14 1HZ LYS 14 13.392 -1.179 8.822 127 HZ3 LYS 14 2HZ LYS 14 13.838 -1.751 10.350 128 H ARG 15 H ARG 15 10.413 -3.554 4.725 129 HA ARG 15 HA ARG 15 11.088 -6.337 5.130 130 HB2 ARG 15 2HB ARG 15 8.583 -4.708 5.432 131 HB3 ARG 15 3HB ARG 15 8.518 -6.465 5.467 132 HG2 ARG 15 2HG ARG 15 9.513 -6.602 7.495 133 HG3 ARG 15 3HG ARG 15 10.508 -5.169 7.226 134 HD2 ARG 15 2HD ARG 15 8.001 -4.103 7.267 135 HD3 ARG 15 3HD ARG 15 7.843 -5.424 8.423 136 HE ARG 15 HE ARG 15 9.258 -2.984 8.803 137 HH11 ARG 15 1HH1 ARG 15 9.273 -6.371 9.610 138 HH12 ARG 15 2HH1 ARG 15 10.138 -6.147 11.094 139 HH21 ARG 15 1HH2 ARG 15 10.398 -2.677 10.754 140 HH22 ARG 15 2HH2 ARG 15 10.777 -4.045 11.745 141 H CYS 16 H CYS 16 9.289 -4.390 2.798 142 HA CYS 16 HA CYS 16 8.123 -6.412 1.297 143 HB2 CYS 16 2HB CYS 16 8.006 -3.776 1.127 144 HB3 CYS 16 3HB CYS 16 9.243 -4.020 -0.101 145 HG CYS 16 HG CYS 16 7.563 -5.851 -1.553 146 H SER 17 H SER 17 11.427 -5.386 1.464 147 HA SER 17 HA SER 17 12.421 -6.283 -0.972 148 HB2 SER 17 2HB SER 17 13.518 -5.201 1.303 149 HB3 SER 17 3HB SER 17 14.183 -6.834 1.313 150 HG SER 17 HG SER 17 15.557 -6.000 -0.049 151 H ASN 18 H ASN 18 11.518 -8.065 1.896 152 HA ASN 18 HA ASN 18 12.783 -10.510 1.213 153 HB2 ASN 18 2HB ASN 18 11.128 -9.516 3.330 154 HB3 ASN 18 3HB ASN 18 10.475 -11.052 2.770 155 HD21 ASN 18 1HD2 ASN 18 13.719 -9.691 3.262 156 HD22 ASN 18 2HD2 ASN 18 14.320 -11.022 4.186 157 H VAL 19 H VAL 19 9.827 -8.992 0.240 158 HA VAL 19 HA VAL 19 8.254 -11.117 -0.548 159 HB VAL 19 HB VAL 19 8.609 -8.491 -2.000 160 HG11 VAL 19 1HG1 VAL 19 6.371 -8.908 -2.896 161 HG12 VAL 19 2HG1 VAL 19 7.507 -10.163 -3.394 162 HG13 VAL 19 3HG1 VAL 19 6.347 -10.484 -2.104 163 HG21 VAL 19 3HG2 VAL 19 6.486 -9.228 0.002 164 HG22 VAL 19 1HG2 VAL 19 7.981 -8.402 0.444 165 HG23 VAL 19 2HG2 VAL 19 6.845 -7.636 -0.668 166 H ALA 20 H ALA 20 8.408 -12.666 -2.035 167 HA ALA 20 HA ALA 20 10.515 -12.421 -4.080 168 HB1 ALA 20 1HB ALA 20 10.819 -14.762 -4.017 169 HB2 ALA 20 2HB ALA 20 10.738 -14.238 -2.334 170 HB3 ALA 20 3HB ALA 20 9.340 -15.005 -3.088 171 H VAL 21 H VAL 21 10.078 -13.031 -6.201 172 HA VAL 21 HA VAL 21 7.553 -12.434 -7.215 173 HB VAL 21 HB VAL 21 9.614 -14.168 -8.580 174 HG11 VAL 21 1HG1 VAL 21 7.539 -12.306 -9.729 175 HG12 VAL 21 2HG1 VAL 21 8.653 -13.334 -10.633 176 HG13 VAL 21 3HG1 VAL 21 7.386 -14.060 -9.644 177 HG21 VAL 21 3HG2 VAL 21 10.997 -12.430 -8.567 178 HG22 VAL 21 1HG2 VAL 21 9.796 -11.499 -9.461 179 HG23 VAL 21 2HG2 VAL 21 9.813 -11.454 -7.698 180 H GLY 22 H GLY 22 8.863 -15.437 -6.044 181 HA2 GLY 22 2HA GLY 22 6.233 -16.670 -6.379 182 HA3 GLY 22 3HA GLY 22 7.603 -17.487 -7.117 183 H VAL 23 H VAL 23 6.259 -18.946 -5.374 184 HA VAL 23 HA VAL 23 6.938 -18.698 -2.660 185 HB VAL 23 HB VAL 23 6.317 -21.055 -2.439 186 HG11 VAL 23 1HG1 VAL 23 4.555 -19.375 -4.210 187 HG12 VAL 23 2HG1 VAL 23 4.027 -20.891 -3.476 188 HG13 VAL 23 3HG1 VAL 23 4.497 -19.532 -2.454 189 HG21 VAL 23 3HG2 VAL 23 6.989 -22.352 -4.154 190 HG22 VAL 23 1HG2 VAL 23 5.418 -21.934 -4.839 191 HG23 VAL 23 2HG2 VAL 23 6.859 -21.043 -5.329 192 H GLY 24 H GLY 24 8.626 -20.132 -5.379 193 HA2 GLY 24 2HA GLY 24 10.763 -21.038 -3.564 194 HA3 GLY 24 3HA GLY 24 10.512 -21.621 -5.203 195 H GLY 25 H GLY 25 12.118 -21.009 -6.483 196 HA2 GLY 25 2HA GLY 25 13.547 -19.607 -7.627 197 HA3 GLY 25 3HA GLY 25 12.761 -18.247 -6.838 198 H LYS 26 H LYS 26 15.651 -19.048 -7.359 199 HA LYS 26 HA LYS 26 16.778 -19.412 -4.738 200 HB2 LYS 26 2HB LYS 26 17.725 -19.405 -7.485 201 HB3 LYS 26 3HB LYS 26 18.813 -18.522 -6.421 202 HG2 LYS 26 2HG LYS 26 17.837 -21.287 -5.779 203 HG3 LYS 26 3HG LYS 26 19.278 -20.989 -6.754 204 HD2 LYS 26 2HD LYS 26 20.480 -20.201 -4.981 205 HD3 LYS 26 3HD LYS 26 19.054 -19.563 -4.159 206 HE2 LYS 26 2HE LYS 26 18.990 -22.456 -4.400 207 HE3 LYS 26 3HE LYS 26 20.419 -21.892 -3.536 208 HZ1 LYS 26 3HZ LYS 26 17.951 -22.234 -2.460 209 HZ2 LYS 26 1HZ LYS 26 18.015 -20.563 -2.713 210 HZ3 LYS 26 2HZ LYS 26 19.202 -21.323 -1.778 211 H SER 27 H SER 27 17.257 -16.811 -7.133 212 HA SER 27 HA SER 27 17.213 -14.879 -4.913 213 HB2 SER 27 2HB SER 27 19.130 -14.844 -7.257 214 HB3 SER 27 3HB SER 27 19.041 -13.633 -5.978 215 HG SER 27 HG SER 27 20.077 -16.216 -5.923 216 H LYS 28 H LYS 28 14.917 -15.167 -6.082 217 HA LYS 28 HA LYS 28 14.746 -13.118 -8.191 218 HB2 LYS 28 2HB LYS 28 13.053 -15.520 -7.566 219 HB3 LYS 28 3HB LYS 28 12.399 -14.180 -8.499 220 HG2 LYS 28 2HG LYS 28 14.942 -14.916 -9.570 221 HG3 LYS 28 3HG LYS 28 13.930 -16.354 -9.415 222 HD2 LYS 28 2HD LYS 28 12.254 -15.456 -10.792 223 HD3 LYS 28 3HD LYS 28 12.893 -13.817 -10.645 224 HE2 LYS 28 2HE LYS 28 13.471 -14.591 -12.813 225 HE3 LYS 28 3HE LYS 28 14.946 -14.623 -11.849 226 HZ1 LYS 28 3HZ LYS 28 14.139 -17.078 -11.428 227 HZ2 LYS 28 1HZ LYS 28 15.055 -16.669 -12.791 228 HZ3 LYS 28 2HZ LYS 28 13.378 -16.844 -12.920 229 H LYS 29 H LYS 29 15.052 -12.057 -5.765 230 HA LYS 29 HA LYS 29 12.415 -11.512 -4.636 231 HB2 LYS 29 2HB LYS 29 15.230 -11.081 -3.735 232 HB3 LYS 29 3HB LYS 29 13.967 -10.054 -3.070 233 HG2 LYS 29 2HG LYS 29 12.757 -12.293 -2.575 234 HG3 LYS 29 3HG LYS 29 14.363 -12.998 -2.771 235 HD2 LYS 29 2HD LYS 29 15.060 -11.074 -1.125 236 HD3 LYS 29 3HD LYS 29 13.351 -11.118 -0.687 237 HE2 LYS 29 2HE LYS 29 13.700 -13.656 -0.446 238 HE3 LYS 29 3HE LYS 29 15.421 -13.274 -0.429 239 HZ1 LYS 29 3HZ LYS 29 14.672 -11.583 1.389 240 HZ2 LYS 29 1HZ LYS 29 14.930 -13.207 1.786 241 HZ3 LYS 29 2HZ LYS 29 13.356 -12.633 1.553 242 H PHE 30 H PHE 30 11.697 -9.325 -4.272 243 HA PHE 30 HA PHE 30 12.326 -7.610 -6.533 244 HB2 PHE 30 2HB PHE 30 10.187 -7.503 -4.405 245 HB3 PHE 30 3HB PHE 30 10.401 -6.238 -5.611 246 HD1 PHE 30 HD2 PHE 30 10.916 -7.646 -8.057 247 HD2 PHE 30 HD1 PHE 30 8.262 -8.656 -4.887 248 HE1 PHE 30 HE2 PHE 30 9.520 -8.915 -9.636 249 HE2 PHE 30 HE1 PHE 30 6.862 -9.929 -6.460 250 HZ PHE 30 HZ PHE 30 7.489 -10.058 -8.838 251 H GLY 31 H GLY 31 11.982 -5.106 -5.749 252 HA2 GLY 31 2HA GLY 31 13.484 -4.522 -3.342 253 HA3 GLY 31 3HA GLY 31 14.334 -4.163 -4.837 254 H GLU 32 H GLU 32 13.904 -2.120 -3.143 255 HA GLU 32 HA GLU 32 11.541 -0.702 -3.269 256 HB2 GLU 32 2HB GLU 32 12.839 1.285 -2.784 257 HB3 GLU 32 3HB GLU 32 13.485 -0.075 -1.876 258 HG2 GLU 32 2HG GLU 32 15.188 -0.327 -3.731 259 HG3 GLU 32 3HG GLU 32 14.639 1.244 -4.311 260 H GLY 33 H GLY 33 14.116 -0.934 -5.656 261 HA2 GLY 33 2HA GLY 33 13.292 1.153 -7.351 262 HA3 GLY 33 3HA GLY 33 14.240 -0.243 -7.841 263 H ASN 34 H ASN 34 12.458 -2.300 -7.378 264 HA ASN 34 HA ASN 34 10.863 -2.192 -9.704 265 HB2 ASN 34 2HB ASN 34 10.965 -4.123 -7.389 266 HB3 ASN 34 3HB ASN 34 9.876 -4.347 -8.756 267 HD21 ASN 34 1HD2 ASN 34 10.612 -5.550 -10.341 268 HD22 ASN 34 2HD2 ASN 34 12.273 -5.850 -10.709 269 H PHE 35 H PHE 35 9.991 -2.130 -6.255 270 HA PHE 35 HA PHE 35 7.228 -1.927 -6.571 271 HB2 PHE 35 2HB PHE 35 8.822 -0.625 -4.360 272 HB3 PHE 35 3HB PHE 35 7.153 -1.181 -4.291 273 HD1 PHE 35 HD2 PHE 35 7.312 -3.836 -5.476 274 HD2 PHE 35 HD1 PHE 35 9.984 -1.874 -2.807 275 HE1 PHE 35 HE2 PHE 35 8.075 -6.021 -4.640 276 HE2 PHE 35 HE1 PHE 35 10.752 -4.056 -1.967 277 HZ PHE 35 HZ PHE 35 9.797 -6.133 -2.883 278 H ARG 36 H ARG 36 9.725 0.560 -6.567 279 HA ARG 36 HA ARG 36 8.022 2.801 -6.511 280 HB2 ARG 36 2HB ARG 36 10.830 2.382 -7.510 281 HB3 ARG 36 3HB ARG 36 10.031 3.944 -7.634 282 HG2 ARG 36 2HG ARG 36 9.995 4.255 -5.341 283 HG3 ARG 36 3HG ARG 36 10.181 2.532 -5.005 284 HD2 ARG 36 2HD ARG 36 12.286 3.333 -4.513 285 HD3 ARG 36 3HD ARG 36 12.479 2.830 -6.192 286 HE ARG 36 HE ARG 36 11.741 5.459 -6.332 287 HH11 ARG 36 1HH1 ARG 36 14.306 3.683 -4.787 288 HH12 ARG 36 2HH1 ARG 36 15.441 4.989 -4.877 289 HH21 ARG 36 1HH2 ARG 36 13.226 7.186 -6.455 290 HH22 ARG 36 2HH2 ARG 36 14.825 6.982 -5.825 291 H TRP 37 H TRP 37 9.430 0.982 -9.210 292 HA TRP 37 HA TRP 37 8.491 2.594 -11.292 293 HB2 TRP 37 2HB TRP 37 10.152 0.918 -11.740 294 HB3 TRP 37 3HB TRP 37 9.077 -0.369 -11.199 295 HD1 TRP 37 HD1 TRP 37 9.914 1.749 -14.221 296 HE1 TRP 37 HE1 TRP 37 8.558 0.915 -16.243 297 HE3 TRP 37 HE3 TRP 37 6.765 -1.477 -11.811 298 HZ2 TRP 37 HZ2 TRP 37 6.433 -0.874 -16.750 299 HZ3 TRP 37 HZ3 TRP 37 5.099 -2.710 -13.137 300 HH2 TRP 37 HH2 TRP 37 4.938 -2.413 -15.555 301 H ALA 38 H ALA 38 6.970 -0.111 -9.601 302 HA ALA 38 HA ALA 38 4.661 -0.210 -11.263 303 HB1 ALA 38 1HB ALA 38 3.721 -1.469 -9.208 304 HB2 ALA 38 2HB ALA 38 5.051 -2.186 -10.118 305 HB3 ALA 38 3HB ALA 38 5.370 -1.359 -8.593 306 H ILE 39 H ILE 39 5.105 0.977 -7.925 307 HA ILE 39 HA ILE 39 2.579 2.080 -7.588 308 HB ILE 39 HB ILE 39 5.180 3.082 -6.423 309 HG12 ILE 39 2HG1 ILE 39 3.177 1.268 -5.092 310 HG13 ILE 39 3HG1 ILE 39 4.490 0.626 -6.073 311 HG21 ILE 39 1HG2 ILE 39 3.988 4.691 -5.468 312 HG22 ILE 39 2HG2 ILE 39 2.520 4.094 -6.239 313 HG23 ILE 39 3HG2 ILE 39 3.006 3.466 -4.665 314 HD11 ILE 39 3HD1 ILE 39 6.064 1.904 -4.579 315 HD12 ILE 39 1HD1 ILE 39 4.682 2.197 -3.524 316 HD13 ILE 39 2HD1 ILE 39 5.218 0.546 -3.837 317 H ARG 40 H ARG 40 5.564 3.796 -8.530 318 HA ARG 40 HA ARG 40 4.479 6.293 -8.983 319 HB2 ARG 40 2HB ARG 40 6.754 4.892 -10.390 320 HB3 ARG 40 3HB ARG 40 6.370 6.592 -10.626 321 HG2 ARG 40 2HG ARG 40 6.612 5.906 -7.820 322 HG3 ARG 40 3HG ARG 40 8.077 5.540 -8.734 323 HD2 ARG 40 2HD ARG 40 8.365 7.758 -9.391 324 HD3 ARG 40 3HD ARG 40 6.687 8.175 -9.047 325 HE ARG 40 HE ARG 40 7.785 7.456 -6.629 326 HH11 ARG 40 1HH1 ARG 40 8.420 9.848 -9.078 327 HH12 ARG 40 2HH1 ARG 40 9.066 11.007 -7.964 328 HH21 ARG 40 1HH2 ARG 40 8.634 8.973 -5.152 329 HH22 ARG 40 2HH2 ARG 40 9.188 10.508 -5.731 330 H MET 41 H MET 41 4.839 3.624 -11.310 331 HA MET 41 HA MET 41 3.833 4.851 -13.568 332 HB2 MET 41 2HB MET 41 3.953 2.044 -12.597 333 HB3 MET 41 3HB MET 41 2.889 2.377 -13.958 334 HG2 MET 41 2HG MET 41 5.568 3.536 -14.193 335 HG3 MET 41 3HG MET 41 5.525 1.775 -14.149 336 HE1 MET 41 3HE MET 41 6.794 3.097 -16.233 337 HE2 MET 41 1HE MET 41 6.359 1.657 -17.154 338 HE3 MET 41 2HE MET 41 6.003 3.259 -17.802 339 H ALA 42 H ALA 42 2.021 3.093 -11.062 340 HA ALA 42 HA ALA 42 -0.527 3.405 -12.184 341 HB1 ALA 42 1HB ALA 42 0.327 3.072 -9.314 342 HB2 ALA 42 2HB ALA 42 -1.351 3.016 -9.856 343 HB3 ALA 42 3HB ALA 42 -0.197 1.815 -10.435 344 H ASN 43 H ASN 43 1.234 5.426 -9.856 345 HA ASN 43 HA ASN 43 -0.759 7.275 -9.292 346 HB2 ASN 43 2HB ASN 43 1.826 6.970 -8.524 347 HB3 ASN 43 3HB ASN 43 1.969 8.378 -9.573 348 HD21 ASN 43 1HD2 ASN 43 1.581 10.284 -8.706 349 HD22 ASN 43 2HD2 ASN 43 0.735 10.570 -7.227 350 H VAL 44 H VAL 44 1.383 7.035 -12.059 351 HA VAL 44 HA VAL 44 0.803 9.601 -13.143 352 HB VAL 44 HB VAL 44 1.812 7.124 -14.550 353 HG11 VAL 44 1HG1 VAL 44 1.425 9.950 -15.407 354 HG12 VAL 44 2HG1 VAL 44 2.806 9.049 -16.036 355 HG13 VAL 44 3HG1 VAL 44 1.167 8.454 -16.304 356 HG21 VAL 44 3HG2 VAL 44 3.861 9.007 -14.241 357 HG22 VAL 44 1HG2 VAL 44 3.053 8.915 -12.676 358 HG23 VAL 44 2HG2 VAL 44 3.700 7.454 -13.422 359 H SER 45 H SER 45 -0.172 6.362 -14.287 360 HA SER 45 HA SER 45 -2.060 7.226 -16.141 361 HB2 SER 45 2HB SER 45 -1.380 4.692 -14.824 362 HB3 SER 45 3HB SER 45 -3.072 4.809 -15.306 363 HG SER 45 HG SER 45 -2.200 5.495 -17.413 364 H THR 46 H THR 46 -2.267 6.924 -12.691 365 HA THR 46 HA THR 46 -5.109 7.700 -12.815 366 HB THR 46 HB THR 46 -5.531 6.587 -10.753 367 HG1 THR 46 HG1 THR 46 -3.986 6.133 -9.361 368 HG21 THR 46 3HG2 THR 46 -3.728 4.631 -12.139 369 HG22 THR 46 1HG2 THR 46 -5.206 5.203 -12.912 370 HG23 THR 46 2HG2 THR 46 -5.290 4.350 -11.370 371 H GLY 47 H GLY 47 -3.090 9.616 -13.012 372 HA2 GLY 47 2HA GLY 47 -3.839 11.438 -11.012 373 HA3 GLY 47 3HA GLY 47 -2.284 10.749 -10.570 374 H ARG 48 H ARG 48 -0.763 10.649 -12.640 375 HA ARG 48 HA ARG 48 0.527 11.829 -14.096 376 HB2 ARG 48 2HB ARG 48 -1.657 11.881 -15.364 377 HB3 ARG 48 3HB ARG 48 -1.939 13.472 -14.670 378 HG2 ARG 48 2HG ARG 48 -0.256 14.456 -15.901 379 HG3 ARG 48 3HG ARG 48 0.592 12.929 -16.155 380 HD2 ARG 48 2HD ARG 48 -1.513 12.255 -17.493 381 HD3 ARG 48 3HD ARG 48 -1.856 13.984 -17.523 382 HE ARG 48 HE ARG 48 0.803 13.306 -18.386 383 HH11 ARG 48 1HH1 ARG 48 -2.515 13.712 -19.358 384 HH12 ARG 48 2HH1 ARG 48 -2.127 14.015 -21.019 385 HH21 ARG 48 1HH2 ARG 48 1.326 13.705 -20.570 386 HH22 ARG 48 2HH2 ARG 48 0.058 14.010 -21.707 387 H GLU 49 H GLU 49 0.821 12.563 -11.514 388 HA GLU 49 HA GLU 49 1.935 15.136 -11.697 389 HB2 GLU 49 2HB GLU 49 -0.856 15.016 -10.858 390 HB3 GLU 49 3HB GLU 49 0.172 15.787 -9.659 391 HG2 GLU 49 2HG GLU 49 1.063 17.067 -11.803 392 HG3 GLU 49 3HG GLU 49 -0.550 16.668 -12.391 393 HA PRO 50 HA PRO 50 4.102 13.747 -8.147 394 HB2 PRO 50 2HB PRO 50 4.646 16.066 -6.845 395 HB3 PRO 50 3HB PRO 50 5.441 15.602 -8.354 396 HG2 PRO 50 2HG PRO 50 3.143 17.471 -7.921 397 HG3 PRO 50 3HG PRO 50 4.553 17.659 -8.979 398 HD2 PRO 50 2HD PRO 50 2.131 16.880 -9.905 399 HD3 PRO 50 3HD PRO 50 3.653 16.320 -10.626 400 H GLY 51 H GLY 51 1.746 16.282 -7.259 401 HA2 GLY 51 2HA GLY 51 1.372 15.066 -4.643 402 HA3 GLY 51 3HA GLY 51 0.640 16.558 -5.215 403 H ASP 52 H ASP 52 0.591 13.108 -6.127 404 HA ASP 52 HA ASP 52 -2.305 13.092 -5.833 405 HB2 ASP 52 2HB ASP 52 -1.560 13.727 -8.256 406 HB3 ASP 52 3HB ASP 52 -1.177 12.014 -8.395 407 H ILE 53 H ILE 53 -0.769 11.847 -4.100 408 HA ILE 53 HA ILE 53 -0.742 9.023 -4.946 409 HB ILE 53 HB ILE 53 0.849 8.730 -2.965 410 HG12 ILE 53 2HG1 ILE 53 1.544 11.611 -3.383 411 HG13 ILE 53 3HG1 ILE 53 0.258 11.198 -2.255 412 HG21 ILE 53 1HG2 ILE 53 2.799 9.638 -4.357 413 HG22 ILE 53 2HG2 ILE 53 1.748 8.433 -5.100 414 HG23 ILE 53 3HG2 ILE 53 1.566 10.137 -5.514 415 HD11 ILE 53 3HD1 ILE 53 2.532 9.540 -1.761 416 HD12 ILE 53 1HD1 ILE 53 3.019 11.235 -1.788 417 HD13 ILE 53 2HD1 ILE 53 1.741 10.702 -0.696 418 HA PRO 54 HA PRO 54 -3.740 8.046 -1.891 419 HB2 PRO 54 2HB PRO 54 -2.936 5.571 -1.119 420 HB3 PRO 54 3HB PRO 54 -3.682 5.892 -2.688 421 HG2 PRO 54 2HG PRO 54 -0.787 5.574 -1.998 422 HG3 PRO 54 3HG PRO 54 -1.686 4.921 -3.380 423 HD2 PRO 54 2HD PRO 54 -0.117 7.120 -3.570 424 HD3 PRO 54 3HD PRO 54 -1.586 6.909 -4.544 425 H GLU 55 H GLU 55 -3.709 6.751 0.405 426 HA GLU 55 HA GLU 55 -1.467 7.323 2.079 427 HB2 GLU 55 2HB GLU 55 -2.414 9.597 1.816 428 HB3 GLU 55 3HB GLU 55 -3.942 9.015 2.463 429 HG2 GLU 55 2HG GLU 55 -2.972 8.603 4.596 430 HG3 GLU 55 3HG GLU 55 -1.348 8.900 3.977 431 H THR 56 H THR 56 -4.923 6.648 1.863 432 HA THR 56 HA THR 56 -4.748 5.030 4.309 433 HB THR 56 HB THR 56 -7.119 5.143 4.486 434 HG1 THR 56 HG1 THR 56 -7.407 6.637 2.122 435 HG21 THR 56 3HG2 THR 56 -5.890 7.186 5.151 436 HG22 THR 56 1HG2 THR 56 -7.537 7.527 4.622 437 HG23 THR 56 2HG2 THR 56 -6.179 7.855 3.546 438 H LEU 57 H LEU 57 -5.462 2.886 4.345 439 HA LEU 57 HA LEU 57 -4.781 1.271 2.209 440 HB2 LEU 57 2HB LEU 57 -4.988 0.440 4.477 441 HB3 LEU 57 3HB LEU 57 -6.728 0.714 4.443 442 HG LEU 57 HG LEU 57 -7.000 -1.044 2.791 443 HD11 LEU 57 1HD1 LEU 57 -5.013 -2.489 2.263 444 HD12 LEU 57 2HD1 LEU 57 -3.999 -1.210 2.929 445 HD13 LEU 57 3HD1 LEU 57 -5.006 -0.891 1.517 446 HD21 LEU 57 3HD2 LEU 57 -5.280 -2.473 4.690 447 HD22 LEU 57 1HD2 LEU 57 -6.997 -2.669 4.339 448 HD23 LEU 57 2HD2 LEU 57 -6.460 -1.392 5.432 449 H ASP 58 H ASP 58 -7.938 2.597 3.070 450 HA ASP 58 HA ASP 58 -9.452 1.187 1.157 451 HB2 ASP 58 2HB ASP 58 -9.938 3.869 2.468 452 HB3 ASP 58 3HB ASP 58 -11.126 3.022 1.481 453 H GLN 59 H GLN 59 -7.728 4.264 1.021 454 HA GLN 59 HA GLN 59 -8.670 5.058 -1.523 455 HB2 GLN 59 2HB GLN 59 -6.483 5.876 0.303 456 HB3 GLN 59 3HB GLN 59 -6.286 6.302 -1.392 457 HG2 GLN 59 2HG GLN 59 -8.809 6.938 0.090 458 HG3 GLN 59 3HG GLN 59 -7.400 7.995 0.169 459 HE21 GLN 59 1HE2 GLN 59 -10.105 7.017 -1.646 460 HE22 GLN 59 2HE2 GLN 59 -9.836 8.018 -3.028 461 H LEU 60 H LEU 60 -5.508 3.689 -0.590 462 HA LEU 60 HA LEU 60 -4.490 3.339 -3.146 463 HB2 LEU 60 2HB LEU 60 -3.103 3.112 -1.197 464 HB3 LEU 60 3HB LEU 60 -4.034 1.720 -0.647 465 HG LEU 60 HG LEU 60 -3.153 0.868 -3.086 466 HD11 LEU 60 1HD1 LEU 60 -1.640 2.458 -3.700 467 HD12 LEU 60 2HD1 LEU 60 -0.594 1.419 -2.732 468 HD13 LEU 60 3HD1 LEU 60 -1.256 2.899 -2.036 469 HD21 LEU 60 3HD2 LEU 60 -3.069 -0.520 -1.178 470 HD22 LEU 60 1HD2 LEU 60 -1.974 0.576 -0.334 471 HD23 LEU 60 2HD2 LEU 60 -1.401 -0.347 -1.724 472 H ARG 61 H ARG 61 -6.728 1.355 -1.327 473 HA ARG 61 HA ARG 61 -6.596 -0.965 -2.924 474 HB2 ARG 61 2HB ARG 61 -7.625 -0.894 -0.677 475 HB3 ARG 61 3HB ARG 61 -8.934 0.088 -1.322 476 HG2 ARG 61 2HG ARG 61 -9.411 -1.823 -2.908 477 HG3 ARG 61 3HG ARG 61 -8.299 -2.782 -1.929 478 HD2 ARG 61 2HD ARG 61 -9.850 -3.115 -0.369 479 HD3 ARG 61 3HD ARG 61 -10.190 -1.388 -0.262 480 HE ARG 61 HE ARG 61 -11.394 -2.415 -2.580 481 HH11 ARG 61 1HH1 ARG 61 -11.690 -2.568 0.885 482 HH12 ARG 61 2HH1 ARG 61 -13.395 -2.875 0.857 483 HH21 ARG 61 1HH2 ARG 61 -13.639 -2.818 -2.630 484 HH22 ARG 61 2HH2 ARG 61 -14.502 -3.018 -1.143 485 H LEU 62 H LEU 62 -8.848 1.792 -2.993 486 HA LEU 62 HA LEU 62 -10.314 0.889 -5.234 487 HB2 LEU 62 2HB LEU 62 -11.348 2.485 -3.851 488 HB3 LEU 62 3HB LEU 62 -9.964 3.573 -3.937 489 HG LEU 62 HG LEU 62 -10.512 4.030 -6.302 490 HD11 LEU 62 1HD1 LEU 62 -11.762 2.518 -7.355 491 HD12 LEU 62 2HD1 LEU 62 -13.145 3.265 -6.555 492 HD13 LEU 62 3HD1 LEU 62 -12.374 1.847 -5.843 493 HD21 LEU 62 3HD2 LEU 62 -12.981 4.536 -4.692 494 HD22 LEU 62 1HD2 LEU 62 -12.149 5.596 -5.830 495 HD23 LEU 62 2HD2 LEU 62 -11.450 5.287 -4.240 496 H VAL 63 H VAL 63 -7.266 2.455 -4.915 497 HA VAL 63 HA VAL 63 -7.139 3.654 -7.489 498 HB VAL 63 HB VAL 63 -4.890 2.773 -5.674 499 HG11 VAL 63 1HG1 VAL 63 -3.769 4.718 -7.049 500 HG12 VAL 63 2HG1 VAL 63 -3.790 3.063 -7.662 501 HG13 VAL 63 3HG1 VAL 63 -4.958 4.242 -8.262 502 HG21 VAL 63 3HG2 VAL 63 -5.456 5.625 -5.938 503 HG22 VAL 63 1HG2 VAL 63 -6.771 4.708 -5.201 504 HG23 VAL 63 2HG2 VAL 63 -5.156 4.658 -4.494 505 H ILE 64 H ILE 64 -5.457 0.766 -6.229 506 HA ILE 64 HA ILE 64 -4.474 -0.158 -8.652 507 HB ILE 64 HB ILE 64 -3.699 -1.104 -6.573 508 HG12 ILE 64 2HG1 ILE 64 -5.130 -3.228 -8.184 509 HG13 ILE 64 3HG1 ILE 64 -3.590 -2.498 -8.625 510 HG21 ILE 64 1HG2 ILE 64 -6.415 -2.375 -6.274 511 HG22 ILE 64 2HG2 ILE 64 -5.052 -2.506 -5.163 512 HG23 ILE 64 3HG2 ILE 64 -5.866 -0.957 -5.380 513 HD11 ILE 64 3HD1 ILE 64 -3.987 -4.778 -7.104 514 HD12 ILE 64 1HD1 ILE 64 -2.477 -3.891 -7.314 515 HD13 ILE 64 2HD1 ILE 64 -3.523 -3.539 -5.938 516 H CYS 65 H CYS 65 -7.606 -0.737 -7.129 517 HA CYS 65 HA CYS 65 -8.542 -2.708 -8.889 518 HB2 CYS 65 2HB CYS 65 -9.642 -2.195 -6.756 519 HB3 CYS 65 3HB CYS 65 -10.114 -0.615 -7.371 520 HG CYS 65 HG CYS 65 -12.352 -2.317 -7.303 521 H ASP 66 H ASP 66 -8.904 0.824 -8.977 522 HA ASP 66 HA ASP 66 -10.471 0.949 -11.303 523 HB2 ASP 66 2HB ASP 66 -10.032 2.815 -9.640 524 HB3 ASP 66 3HB ASP 66 -8.477 3.044 -10.434 525 H LEU 67 H LEU 67 -6.951 1.310 -10.892 526 HA LEU 67 HA LEU 67 -6.331 1.649 -13.602 527 HB2 LEU 67 2HB LEU 67 -4.663 2.211 -12.059 528 HB3 LEU 67 3HB LEU 67 -4.773 0.653 -11.242 529 HG LEU 67 HG LEU 67 -3.860 0.645 -14.065 530 HD11 LEU 67 1HD1 LEU 67 -1.578 1.197 -13.435 531 HD12 LEU 67 2HD1 LEU 67 -2.102 1.549 -11.789 532 HD13 LEU 67 3HD1 LEU 67 -2.657 2.557 -13.125 533 HD21 LEU 67 3HD2 LEU 67 -3.392 -1.440 -13.471 534 HD22 LEU 67 1HD2 LEU 67 -3.902 -1.105 -11.816 535 HD23 LEU 67 2HD2 LEU 67 -2.226 -0.834 -12.294 536 H GLN 68 H GLN 68 -6.276 -1.299 -11.606 537 HA GLN 68 HA GLN 68 -5.454 -3.097 -13.550 538 HB2 GLN 68 2HB GLN 68 -5.697 -3.596 -11.122 539 HB3 GLN 68 3HB GLN 68 -7.441 -3.645 -11.340 540 HG2 GLN 68 2HG GLN 68 -6.382 -5.372 -13.271 541 HG3 GLN 68 3HG GLN 68 -5.490 -5.695 -11.786 542 HE21 GLN 68 1HE2 GLN 68 -7.688 -7.091 -13.385 543 HE22 GLN 68 2HE2 GLN 68 -8.846 -7.532 -12.180 544 H GLU 69 H GLU 69 -8.682 -1.858 -12.854 545 HA GLU 69 HA GLU 69 -10.139 -3.576 -14.524 546 HB2 GLU 69 2HB GLU 69 -10.888 -1.741 -12.774 547 HB3 GLU 69 3HB GLU 69 -10.974 -0.726 -14.207 548 HG2 GLU 69 2HG GLU 69 -13.080 -1.491 -14.288 549 HG3 GLU 69 3HG GLU 69 -12.326 -2.868 -15.090 550 H ARG 70 H ARG 70 -8.873 -0.309 -15.176 551 HA ARG 70 HA ARG 70 -9.674 -0.234 -17.878 552 HB2 ARG 70 2HB ARG 70 -9.032 1.747 -16.481 553 HB3 ARG 70 3HB ARG 70 -7.354 1.243 -16.629 554 HG2 ARG 70 2HG ARG 70 -7.215 1.858 -18.825 555 HG3 ARG 70 3HG ARG 70 -8.940 1.619 -19.114 556 HD2 ARG 70 2HD ARG 70 -9.418 3.741 -18.606 557 HD3 ARG 70 3HD ARG 70 -8.413 3.703 -17.158 558 HE ARG 70 HE ARG 70 -6.856 3.855 -19.545 559 HH11 ARG 70 1HH1 ARG 70 -8.751 5.730 -17.305 560 HH12 ARG 70 2HH1 ARG 70 -7.918 7.212 -17.639 561 HH21 ARG 70 1HH2 ARG 70 -5.752 5.800 -19.992 562 HH22 ARG 70 2HH2 ARG 70 -6.213 7.251 -19.168 563 H ARG 71 H ARG 71 -6.493 -0.908 -16.420 564 HA ARG 71 HA ARG 71 -5.090 -1.423 -18.760 565 HB2 ARG 71 2HB ARG 71 -4.739 -2.665 -16.026 566 HB3 ARG 71 3HB ARG 71 -3.565 -2.772 -17.331 567 HG2 ARG 71 2HG ARG 71 -4.500 -0.105 -16.360 568 HG3 ARG 71 3HG ARG 71 -3.254 -0.996 -15.483 569 HD2 ARG 71 2HD ARG 71 -1.736 -0.245 -16.918 570 HD3 ARG 71 3HD ARG 71 -2.571 -1.093 -18.219 571 HE ARG 71 HE ARG 71 -3.842 1.374 -17.678 572 HH11 ARG 71 1HH1 ARG 71 -0.987 0.030 -19.148 573 HH12 ARG 71 2HH1 ARG 71 -0.781 1.345 -20.258 574 HH21 ARG 71 1HH2 ARG 71 -3.582 3.110 -19.134 575 HH22 ARG 71 2HH2 ARG 71 -2.258 3.097 -20.248 576 H GLU 72 H GLU 72 -6.984 -3.640 -16.742 577 HA GLU 72 HA GLU 72 -6.400 -6.010 -18.097 578 HB2 GLU 72 2HB GLU 72 -7.539 -5.962 -15.932 579 HB3 GLU 72 3HB GLU 72 -8.949 -5.222 -16.677 580 HG2 GLU 72 2HG GLU 72 -9.128 -7.274 -18.119 581 HG3 GLU 72 3HG GLU 72 -7.892 -8.002 -17.094 582 H LYS 73 H LYS 73 -9.080 -3.726 -18.587 583 HA LYS 73 HA LYS 73 -10.387 -5.057 -20.646 584 HB2 LYS 73 2HB LYS 73 -10.859 -2.774 -19.323 585 HB3 LYS 73 3HB LYS 73 -10.222 -2.095 -20.815 586 HG2 LYS 73 2HG LYS 73 -12.320 -2.220 -21.551 587 HG3 LYS 73 3HG LYS 73 -12.003 -3.946 -21.745 588 HD2 LYS 73 2HD LYS 73 -13.963 -3.936 -20.511 589 HD3 LYS 73 3HD LYS 73 -12.731 -4.099 -19.257 590 HE2 LYS 73 2HE LYS 73 -13.281 -2.143 -18.334 591 HE3 LYS 73 3HE LYS 73 -13.294 -1.324 -19.894 592 HZ1 LYS 73 3HZ LYS 73 -15.534 -3.081 -19.512 593 HZ2 LYS 73 1HZ LYS 73 -15.500 -1.469 -20.023 594 HZ3 LYS 73 2HZ LYS 73 -15.472 -1.833 -18.372 595 H PHE 74 H PHE 74 -7.606 -2.894 -20.758 596 HA PHE 74 HA PHE 74 -7.492 -2.799 -23.615 597 HB2 PHE 74 2HB PHE 74 -6.411 -1.267 -21.666 598 HB3 PHE 74 3HB PHE 74 -5.023 -2.271 -22.071 599 HD1 PHE 74 HD1 PHE 74 -3.979 -2.132 -24.252 600 HD2 PHE 74 HD2 PHE 74 -7.310 0.318 -23.244 601 HE1 PHE 74 HE1 PHE 74 -3.507 -0.697 -26.194 602 HE2 PHE 74 HE2 PHE 74 -6.844 1.756 -25.185 603 HZ PHE 74 HZ PHE 74 -4.941 1.249 -26.664 604 H GLY 75 H GLY 75 -6.279 -4.928 -21.162 605 HA2 GLY 75 2HA GLY 75 -5.822 -7.185 -22.359 606 HA3 GLY 75 3HA GLY 75 -4.522 -6.265 -23.103 607 H SER 76 H SER 76 -3.871 -8.502 -21.739 608 HA SER 76 HA SER 76 -2.965 -7.615 -19.092 609 HB2 SER 76 2HB SER 76 -3.981 -10.081 -20.062 610 HB3 SER 76 3HB SER 76 -2.295 -10.352 -19.621 611 HG SER 76 HG SER 76 -2.728 -9.675 -17.562 612 H SER 77 H SER 77 -0.783 -7.917 -18.448 613 HA SER 77 HA SER 77 1.228 -8.718 -20.319 614 HB2 SER 77 2HB SER 77 2.044 -6.731 -21.064 615 HB3 SER 77 3HB SER 77 0.402 -6.172 -20.749 616 HG SER 77 HG SER 77 1.929 -4.801 -19.774 617 H LYS 78 H LYS 78 3.299 -8.868 -19.381 618 HA LYS 78 HA LYS 78 3.413 -9.574 -16.715 619 HB2 LYS 78 2HB LYS 78 5.436 -8.895 -18.785 620 HB3 LYS 78 3HB LYS 78 5.984 -8.933 -17.114 621 HG2 LYS 78 2HG LYS 78 6.385 -11.073 -18.078 622 HG3 LYS 78 3HG LYS 78 5.055 -11.234 -16.929 623 HD2 LYS 78 2HD LYS 78 3.447 -11.166 -18.754 624 HD3 LYS 78 3HD LYS 78 4.754 -10.935 -19.918 625 HE2 LYS 78 2HE LYS 78 4.675 -13.316 -18.092 626 HE3 LYS 78 3HE LYS 78 3.797 -13.299 -19.621 627 HZ1 LYS 78 3HZ LYS 78 6.264 -14.167 -19.442 628 HZ2 LYS 78 1HZ LYS 78 6.614 -12.528 -19.676 629 HZ3 LYS 78 2HZ LYS 78 5.701 -13.371 -20.824 630 H GLU 79 H GLU 79 3.923 -6.432 -18.198 631 HA GLU 79 HA GLU 79 5.017 -5.140 -15.933 632 HB2 GLU 79 2HB GLU 79 3.957 -4.345 -18.557 633 HB3 GLU 79 3HB GLU 79 3.756 -3.132 -17.300 634 HG2 GLU 79 2HG GLU 79 5.795 -2.542 -18.124 635 HG3 GLU 79 3HG GLU 79 6.281 -3.639 -16.833 636 H ILE 80 H ILE 80 1.702 -5.398 -17.168 637 HA ILE 80 HA ILE 80 0.517 -3.790 -15.164 638 HB ILE 80 HB ILE 80 -0.752 -5.973 -16.822 639 HG12 ILE 80 2HG1 ILE 80 -0.857 -3.000 -17.317 640 HG13 ILE 80 3HG1 ILE 80 0.390 -4.021 -18.025 641 HG21 ILE 80 1HG2 ILE 80 -2.200 -5.535 -15.015 642 HG22 ILE 80 2HG2 ILE 80 -1.911 -3.798 -15.103 643 HG23 ILE 80 3HG2 ILE 80 -2.837 -4.602 -16.370 644 HD11 ILE 80 3HD1 ILE 80 -1.174 -3.917 -19.703 645 HD12 ILE 80 1HD1 ILE 80 -1.614 -5.418 -18.889 646 HD13 ILE 80 2HD1 ILE 80 -2.535 -3.946 -18.582 647 H ASP 81 H ASP 81 0.461 -7.336 -15.575 648 HA ASP 81 HA ASP 81 -0.761 -7.999 -13.191 649 HB2 ASP 81 2HB ASP 81 0.673 -9.373 -15.246 650 HB3 ASP 81 3HB ASP 81 1.240 -9.959 -13.685 651 H MET 82 H MET 82 2.585 -7.146 -13.801 652 HA MET 82 HA MET 82 3.589 -7.945 -11.265 653 HB2 MET 82 2HB MET 82 5.072 -7.654 -13.176 654 HB3 MET 82 3HB MET 82 4.662 -5.946 -13.263 655 HG2 MET 82 2HG MET 82 5.882 -5.420 -11.375 656 HG3 MET 82 3HG MET 82 5.843 -7.073 -10.766 657 HE1 MET 82 3HE MET 82 6.653 -8.939 -12.021 658 HE2 MET 82 1HE MET 82 7.624 -8.877 -13.492 659 HE3 MET 82 2HE MET 82 8.414 -8.940 -11.916 660 H ALA 83 H ALA 83 2.601 -4.797 -12.593 661 HA ALA 83 HA ALA 83 3.162 -3.189 -10.416 662 HB1 ALA 83 1HB ALA 83 1.006 -1.931 -11.303 663 HB2 ALA 83 2HB ALA 83 2.519 -1.942 -12.210 664 HB3 ALA 83 3HB ALA 83 1.217 -3.046 -12.653 665 H ILE 84 H ILE 84 0.328 -5.212 -11.011 666 HA ILE 84 HA ILE 84 -1.158 -4.323 -8.763 667 HB ILE 84 HB ILE 84 -1.372 -6.982 -10.178 668 HG12 ILE 84 2HG1 ILE 84 -1.578 -5.163 -11.783 669 HG13 ILE 84 3HG1 ILE 84 -3.156 -5.891 -11.504 670 HG21 ILE 84 1HG2 ILE 84 -3.129 -7.432 -8.887 671 HG22 ILE 84 2HG2 ILE 84 -2.606 -6.095 -7.864 672 HG23 ILE 84 3HG2 ILE 84 -3.808 -5.822 -9.125 673 HD11 ILE 84 3HD1 ILE 84 -3.787 -4.060 -10.070 674 HD12 ILE 84 1HD1 ILE 84 -2.179 -3.353 -10.219 675 HD13 ILE 84 2HD1 ILE 84 -3.237 -3.442 -11.628 676 H VAL 85 H VAL 85 0.861 -7.203 -9.311 677 HA VAL 85 HA VAL 85 0.548 -8.374 -6.799 678 HB VAL 85 HB VAL 85 2.978 -8.461 -8.592 679 HG11 VAL 85 1HG1 VAL 85 2.139 -10.231 -6.300 680 HG12 VAL 85 2HG1 VAL 85 3.439 -10.607 -7.432 681 HG13 VAL 85 3HG1 VAL 85 3.565 -9.198 -6.379 682 HG21 VAL 85 3HG2 VAL 85 0.397 -9.396 -9.062 683 HG22 VAL 85 1HG2 VAL 85 1.865 -9.852 -9.927 684 HG23 VAL 85 2HG2 VAL 85 1.310 -10.819 -8.561 685 H THR 86 H THR 86 3.038 -6.105 -7.936 686 HA THR 86 HA THR 86 4.536 -5.970 -5.584 687 HB THR 86 HB THR 86 5.296 -3.738 -6.401 688 HG1 THR 86 HG1 THR 86 3.764 -2.778 -7.541 689 HG21 THR 86 3HG2 THR 86 5.503 -6.279 -7.760 690 HG22 THR 86 1HG2 THR 86 6.736 -5.047 -7.493 691 HG23 THR 86 2HG2 THR 86 5.670 -4.939 -8.894 692 H LEU 87 H LEU 87 1.791 -3.984 -6.650 693 HA LEU 87 HA LEU 87 1.751 -2.204 -4.496 694 HB2 LEU 87 2HB LEU 87 -0.353 -3.201 -6.381 695 HB3 LEU 87 3HB LEU 87 -0.765 -2.096 -5.071 696 HG LEU 87 HG LEU 87 1.183 -1.535 -7.308 697 HD11 LEU 87 1HD1 LEU 87 -1.549 -0.374 -6.792 698 HD12 LEU 87 2HD1 LEU 87 -1.194 -1.614 -7.994 699 HD13 LEU 87 3HD1 LEU 87 -0.477 -0.010 -8.144 700 HD21 LEU 87 3HD2 LEU 87 0.854 0.839 -6.328 701 HD22 LEU 87 1HD2 LEU 87 1.975 -0.270 -5.538 702 HD23 LEU 87 2HD2 LEU 87 0.365 -0.015 -4.864 703 H LYS 88 H LYS 88 0.465 -5.447 -4.835 704 HA LYS 88 HA LYS 88 -1.127 -5.419 -2.480 705 HB2 LYS 88 2HB LYS 88 -0.398 -7.315 -4.540 706 HB3 LYS 88 3HB LYS 88 -0.342 -8.069 -2.952 707 HG2 LYS 88 2HG LYS 88 -2.522 -8.428 -3.316 708 HG3 LYS 88 3HG LYS 88 -2.696 -6.752 -2.792 709 HD2 LYS 88 2HD LYS 88 -2.169 -6.371 -5.404 710 HD3 LYS 88 3HD LYS 88 -2.970 -7.943 -5.481 711 HE2 LYS 88 2HE LYS 88 -4.667 -6.688 -3.847 712 HE3 LYS 88 3HE LYS 88 -4.045 -5.288 -4.719 713 HZ1 LYS 88 3HZ LYS 88 -5.873 -7.290 -5.594 714 HZ2 LYS 88 1HZ LYS 88 -4.566 -7.151 -6.659 715 HZ3 LYS 88 2HZ LYS 88 -5.506 -5.794 -6.292 716 H VAL 89 H VAL 89 1.960 -7.093 -3.132 717 HA VAL 89 HA VAL 89 2.522 -7.888 -0.546 718 HB VAL 89 HB VAL 89 4.937 -7.841 -1.228 719 HG11 VAL 89 1HG1 VAL 89 4.000 -9.880 -1.682 720 HG12 VAL 89 2HG1 VAL 89 2.784 -9.204 -2.768 721 HG13 VAL 89 3HG1 VAL 89 4.453 -9.379 -3.311 722 HG21 VAL 89 3HG2 VAL 89 5.007 -5.947 -2.669 723 HG22 VAL 89 1HG2 VAL 89 5.354 -7.365 -3.659 724 HG23 VAL 89 2HG2 VAL 89 3.757 -6.618 -3.716 725 H PHE 90 H PHE 90 3.227 -4.805 -2.121 726 HA PHE 90 HA PHE 90 4.715 -3.733 0.061 727 HB2 PHE 90 2HB PHE 90 5.100 -2.808 -2.112 728 HB3 PHE 90 3HB PHE 90 3.390 -2.450 -2.329 729 HD1 PHE 90 HD2 PHE 90 5.641 -1.782 0.557 730 HD2 PHE 90 HD1 PHE 90 3.237 -0.157 -2.557 731 HE1 PHE 90 HE2 PHE 90 6.004 0.477 1.460 732 HE2 PHE 90 HE1 PHE 90 3.597 2.105 -1.659 733 HZ PHE 90 HZ PHE 90 4.981 2.425 0.353 734 H ALA 91 H ALA 91 1.336 -3.759 -0.847 735 HA ALA 91 HA ALA 91 0.449 -1.726 0.906 736 HB1 ALA 91 1HB ALA 91 -1.793 -2.832 0.617 737 HB2 ALA 91 2HB ALA 91 -0.981 -2.359 -0.876 738 HB3 ALA 91 3HB ALA 91 -0.979 -4.048 -0.368 739 H VAL 92 H VAL 92 0.638 -5.255 1.248 740 HA VAL 92 HA VAL 92 -0.362 -5.197 3.949 741 HB VAL 92 HB VAL 92 1.009 -7.491 2.545 742 HG11 VAL 92 1HG1 VAL 92 -1.105 -8.155 4.393 743 HG12 VAL 92 2HG1 VAL 92 0.577 -8.690 4.369 744 HG13 VAL 92 3HG1 VAL 92 0.141 -7.184 5.177 745 HG21 VAL 92 3HG2 VAL 92 -1.698 -6.350 2.232 746 HG22 VAL 92 1HG2 VAL 92 -0.713 -7.272 1.095 747 HG23 VAL 92 2HG2 VAL 92 -1.600 -8.106 2.371 748 H ALA 93 H ALA 93 2.752 -6.217 2.529 749 HA ALA 93 HA ALA 93 4.143 -6.432 4.943 750 HB1 ALA 93 1HB ALA 93 5.665 -5.568 2.557 751 HB2 ALA 93 2HB ALA 93 5.964 -6.898 3.677 752 HB3 ALA 93 3HB ALA 93 4.739 -7.063 2.419 753 H GLY 94 H GLY 94 3.183 -3.654 3.155 754 HA2 GLY 94 2HA GLY 94 5.125 -1.932 4.510 755 HA3 GLY 94 3HA GLY 94 4.032 -1.448 3.222 756 H LEU 95 H LEU 95 1.660 -1.500 3.831 757 HA LEU 95 HA LEU 95 1.214 0.233 5.983 758 HB2 LEU 95 2HB LEU 95 -0.879 -1.559 4.786 759 HB3 LEU 95 3HB LEU 95 -1.093 0.035 5.507 760 HG LEU 95 HG LEU 95 0.244 -0.569 2.869 761 HD11 LEU 95 1HD1 LEU 95 -1.941 -0.709 2.292 762 HD12 LEU 95 2HD1 LEU 95 -1.790 1.048 2.265 763 HD13 LEU 95 3HD1 LEU 95 -2.485 0.245 3.673 764 HD21 LEU 95 3HD2 LEU 95 -0.349 2.166 3.147 765 HD22 LEU 95 1HD2 LEU 95 1.239 1.404 3.057 766 HD23 LEU 95 2HD2 LEU 95 0.481 1.679 4.626 767 H LEU 96 H LEU 96 0.553 -3.248 5.678 768 HA LEU 96 HA LEU 96 -0.250 -3.441 8.446 769 HB2 LEU 96 2HB LEU 96 -0.726 -4.921 6.151 770 HB3 LEU 96 3HB LEU 96 0.317 -5.958 7.122 771 HG LEU 96 HG LEU 96 -1.456 -5.318 9.001 772 HD11 LEU 96 1HD1 LEU 96 -3.722 -5.327 7.977 773 HD12 LEU 96 2HD1 LEU 96 -2.964 -5.069 6.406 774 HD13 LEU 96 3HD1 LEU 96 -2.804 -3.852 7.672 775 HD21 LEU 96 3HD2 LEU 96 -1.900 -7.411 6.874 776 HD22 LEU 96 1HD2 LEU 96 -2.598 -7.413 8.494 777 HD23 LEU 96 2HD2 LEU 96 -0.854 -7.576 8.286 778 H ASN 97 H ASN 97 2.660 -3.086 7.045 779 HA ASN 97 HA ASN 97 4.816 -3.579 7.593 780 HB2 ASN 97 2HB ASN 97 3.507 -2.771 9.876 781 HB3 ASN 97 3HB ASN 97 4.256 -4.281 10.384 782 HD21 ASN 97 1HD2 ASN 97 6.202 -4.083 11.196 783 HD22 ASN 97 2HD2 ASN 97 7.343 -2.838 10.827 784 H MET 98 H MET 98 3.115 -5.790 6.715 785 HA MET 98 HA MET 98 3.760 -8.112 8.240 786 HB2 MET 98 2HB MET 98 2.247 -7.482 5.853 787 HB3 MET 98 3HB MET 98 3.209 -8.936 5.624 788 HG2 MET 98 2HG MET 98 1.692 -8.742 8.148 789 HG3 MET 98 3HG MET 98 0.754 -8.944 6.670 790 HE1 MET 98 3HE MET 98 3.616 -11.527 8.836 791 HE2 MET 98 1HE MET 98 2.668 -10.123 9.327 792 HE3 MET 98 2HE MET 98 1.941 -11.730 9.351 793 H THR 99 H THR 99 4.908 -10.000 7.100 794 HA THR 99 HA THR 99 7.317 -9.023 5.716 795 HB THR 99 HB THR 99 8.701 -10.585 6.964 796 HG1 THR 99 HG1 THR 99 6.209 -11.362 8.033 797 HG21 THR 99 3HG2 THR 99 7.075 -9.105 9.014 798 HG22 THR 99 1HG2 THR 99 8.114 -8.260 7.867 799 HG23 THR 99 2HG2 THR 99 8.810 -9.418 9.001 800 H VAL 100 H VAL 100 5.245 -9.955 4.252 801 HA VAL 100 HA VAL 100 5.373 -12.775 3.791 802 HB VAL 100 HB VAL 100 4.044 -12.252 1.735 803 HG11 VAL 100 1HG1 VAL 100 3.099 -11.153 4.377 804 HG12 VAL 100 2HG1 VAL 100 2.045 -11.432 2.989 805 HG13 VAL 100 3HG1 VAL 100 2.877 -12.787 3.753 806 HG21 VAL 100 3HG2 VAL 100 3.310 -9.581 2.375 807 HG22 VAL 100 1HG2 VAL 100 5.064 -9.650 2.213 808 HG23 VAL 100 2HG2 VAL 100 4.034 -10.198 0.890 809 H SER 101 H SER 101 6.904 -13.829 2.729 810 HA SER 101 HA SER 101 8.708 -12.336 0.970 811 HB2 SER 101 2HB SER 101 8.929 -14.879 2.528 812 HB3 SER 101 3HB SER 101 9.937 -14.674 1.095 813 HG SER 101 HG SER 101 10.262 -13.626 3.536 814 H THR 102 H THR 102 5.907 -13.498 0.402 815 HA THR 102 HA THR 102 6.614 -14.547 -2.227 816 HB THR 102 HB THR 102 5.220 -16.470 -2.112 817 HG1 THR 102 HG1 THR 102 3.758 -16.799 -0.543 818 HG21 THR 102 3HG2 THR 102 6.229 -17.775 -0.273 819 HG22 THR 102 1HG2 THR 102 6.844 -16.279 0.427 820 HG23 THR 102 2HG2 THR 102 7.422 -16.818 -1.149 821 H ALA 103 H ALA 103 5.427 -13.591 -3.743 822 HA ALA 103 HA ALA 103 3.530 -11.632 -3.242 823 HB1 ALA 103 1HB ALA 103 2.861 -12.100 -5.701 824 HB2 ALA 103 2HB ALA 103 4.489 -11.522 -5.345 825 HB3 ALA 103 3HB ALA 103 4.214 -13.233 -5.674 826 H ALA 104 H ALA 104 3.155 -15.075 -3.467 827 HA ALA 104 HA ALA 104 0.353 -15.125 -3.939 828 HB1 ALA 104 1HB ALA 104 2.460 -17.045 -3.451 829 HB2 ALA 104 2HB ALA 104 0.977 -17.473 -2.596 830 HB3 ALA 104 3HB ALA 104 0.950 -17.230 -4.343 831 H ALA 105 H ALA 105 2.335 -15.281 -1.005 832 HA ALA 105 HA ALA 105 0.193 -15.673 0.798 833 HB1 ALA 105 1HB ALA 105 2.974 -14.592 1.190 834 HB2 ALA 105 2HB ALA 105 1.842 -14.866 2.514 835 HB3 ALA 105 3HB ALA 105 2.386 -16.221 1.525 836 H ALA 106 H ALA 106 1.752 -12.786 -0.490 837 HA ALA 106 HA ALA 106 0.547 -10.902 1.216 838 HB1 ALA 106 1HB ALA 106 0.915 -9.541 -1.135 839 HB2 ALA 106 2HB ALA 106 2.131 -9.765 0.123 840 HB3 ALA 106 3HB ALA 106 2.084 -10.856 -1.263 841 H GLU 107 H GLU 107 -0.351 -11.875 -2.099 842 HA GLU 107 HA GLU 107 -2.677 -10.351 -2.291 843 HB2 GLU 107 2HB GLU 107 -1.757 -11.342 -4.263 844 HB3 GLU 107 3HB GLU 107 -1.906 -12.961 -3.593 845 HG2 GLU 107 2HG GLU 107 -4.357 -11.311 -3.951 846 HG3 GLU 107 3HG GLU 107 -3.615 -12.073 -5.357 847 H ASN 108 H ASN 108 -2.236 -13.688 -1.165 848 HA ASN 108 HA ASN 108 -4.899 -14.358 -0.749 849 HB2 ASN 108 2HB ASN 108 -2.301 -15.364 0.101 850 HB3 ASN 108 3HB ASN 108 -3.537 -15.601 1.333 851 HD21 ASN 108 1HD2 ASN 108 -5.558 -16.624 0.604 852 HD22 ASN 108 2HD2 ASN 108 -5.459 -17.856 -0.604 853 H MET 109 H MET 109 -2.618 -12.751 1.443 854 HA MET 109 HA MET 109 -4.346 -12.585 3.658 855 HB2 MET 109 2HB MET 109 -1.717 -11.878 3.110 856 HB3 MET 109 3HB MET 109 -2.504 -10.340 3.438 857 HG2 MET 109 2HG MET 109 -3.397 -12.113 5.419 858 HG3 MET 109 3HG MET 109 -1.662 -12.376 5.261 859 HE1 MET 109 3HE MET 109 -3.993 -8.747 6.510 860 HE2 MET 109 1HE MET 109 -3.302 -8.427 4.919 861 HE3 MET 109 2HE MET 109 -4.337 -9.834 5.164 862 H TYR 110 H TYR 110 -3.803 -10.436 0.913 863 HA TYR 110 HA TYR 110 -5.253 -8.222 1.790 864 HB2 TYR 110 2HB TYR 110 -3.829 -8.756 -0.429 865 HB3 TYR 110 3HB TYR 110 -5.453 -8.925 -1.086 866 HD1 TYR 110 HD1 TYR 110 -3.151 -6.585 0.623 867 HD2 TYR 110 HD2 TYR 110 -6.798 -7.023 -1.524 868 HE1 TYR 110 HE1 TYR 110 -3.308 -4.140 0.402 869 HE2 TYR 110 HE2 TYR 110 -6.964 -4.579 -1.752 870 HH TYR 110 HH TYR 110 -6.154 -2.576 -0.724 871 H SER 111 H SER 111 -6.337 -11.093 0.014 872 HA SER 111 HA SER 111 -9.066 -10.212 -0.100 873 HB2 SER 111 2HB SER 111 -9.528 -12.386 -1.087 874 HB3 SER 111 3HB SER 111 -8.064 -11.717 -1.809 875 HG SER 111 HG SER 111 -7.944 -13.975 -1.156 876 H GLN 112 H GLN 112 -7.215 -12.489 1.870 877 HA GLN 112 HA GLN 112 -9.373 -13.579 3.303 878 HB2 GLN 112 2HB GLN 112 -6.432 -13.327 3.842 879 HB3 GLN 112 3HB GLN 112 -7.507 -13.964 5.079 880 HG2 GLN 112 2HG GLN 112 -8.270 -15.676 3.451 881 HG3 GLN 112 3HG GLN 112 -7.048 -15.085 2.327 882 HE21 GLN 112 1HE2 GLN 112 -4.859 -14.733 3.737 883 HE22 GLN 112 2HE2 GLN 112 -4.347 -16.188 4.514 884 H MET 113 H MET 113 -7.662 -10.573 3.607 885 HA MET 113 HA MET 113 -8.531 -9.989 6.271 886 HB2 MET 113 2HB MET 113 -6.509 -9.014 4.996 887 HB3 MET 113 3HB MET 113 -7.677 -7.927 4.255 888 HG2 MET 113 2HG MET 113 -7.950 -8.023 7.137 889 HG3 MET 113 3HG MET 113 -6.334 -7.536 6.632 890 HE1 MET 113 3HE MET 113 -7.453 -4.880 8.044 891 HE2 MET 113 1HE MET 113 -9.145 -4.647 7.601 892 HE3 MET 113 2HE MET 113 -8.611 -6.193 8.262 893 H GLY 114 H GLY 114 -9.859 -9.601 3.091 894 HA2 GLY 114 2HA GLY 114 -12.280 -9.362 2.941 895 HA3 GLY 114 3HA GLY 114 -12.189 -8.245 4.295 896 H LEU 115 H LEU 115 -9.740 -7.988 1.897 897 HA LEU 115 HA LEU 115 -10.822 -5.403 1.091 898 HB2 LEU 115 2HB LEU 115 -8.168 -6.628 0.369 899 HB3 LEU 115 3HB LEU 115 -8.646 -4.940 0.200 900 HG LEU 115 HG LEU 115 -8.116 -6.432 2.766 901 HD11 LEU 115 1HD1 LEU 115 -6.709 -4.150 1.390 902 HD12 LEU 115 2HD1 LEU 115 -6.098 -5.787 1.624 903 HD13 LEU 115 3HD1 LEU 115 -6.341 -4.730 3.015 904 HD21 LEU 115 3HD2 LEU 115 -9.934 -4.978 3.222 905 HD22 LEU 115 1HD2 LEU 115 -9.215 -3.672 2.279 906 HD23 LEU 115 2HD2 LEU 115 -8.480 -4.166 3.804 907 H ASP 116 H ASP 116 -10.293 -8.591 -0.154 908 HA ASP 116 HA ASP 116 -10.785 -9.584 -2.141 909 HB2 ASP 116 2HB ASP 116 -12.926 -8.007 -1.537 910 HB3 ASP 116 3HB ASP 116 -12.494 -7.397 -3.131 911 H THR 117 H THR 117 -11.217 -8.760 -4.673 912 HA THR 117 HA THR 117 -10.197 -7.991 -6.558 913 HB THR 117 HB THR 117 -8.785 -5.855 -4.997 914 HG1 THR 117 HG1 THR 117 -10.713 -4.662 -4.976 915 HG21 THR 117 3HG2 THR 117 -9.912 -4.697 -7.176 916 HG22 THR 117 1HG2 THR 117 -9.647 -6.336 -7.770 917 HG23 THR 117 2HG2 THR 117 -8.292 -5.392 -7.150 918 H ARG 118 H ARG 118 -8.725 -9.405 -7.258 919 HA ARG 118 HA ARG 118 -5.963 -9.075 -6.400 920 HB2 ARG 118 2HB ARG 118 -5.797 -11.650 -6.275 921 HB3 ARG 118 3HB ARG 118 -6.467 -10.786 -4.897 922 HG2 ARG 118 2HG ARG 118 -8.367 -11.731 -6.962 923 HG3 ARG 118 3HG ARG 118 -7.613 -12.944 -5.925 924 HD2 ARG 118 2HD ARG 118 -8.351 -10.961 -4.158 925 HD3 ARG 118 3HD ARG 118 -9.679 -10.984 -5.318 926 HE ARG 118 HE ARG 118 -9.027 -13.010 -3.389 927 HH11 ARG 118 1HH1 ARG 118 -10.581 -12.356 -6.434 928 HH12 ARG 118 2HH1 ARG 118 -11.642 -13.722 -6.335 929 HH21 ARG 118 1HH2 ARG 118 -10.417 -14.813 -3.247 930 HH22 ARG 118 2HH2 ARG 118 -11.548 -15.119 -4.521 931 HA PRO 119 HA PRO 119 -5.050 -9.825 -10.625 932 HB2 PRO 119 2HB PRO 119 -2.638 -11.060 -10.465 933 HB3 PRO 119 3HB PRO 119 -2.860 -9.339 -10.127 934 HG2 PRO 119 2HG PRO 119 -2.649 -11.633 -8.215 935 HG3 PRO 119 3HG PRO 119 -1.905 -10.026 -8.121 936 HD2 PRO 119 2HD PRO 119 -4.130 -10.685 -6.725 937 HD3 PRO 119 3HD PRO 119 -3.832 -9.042 -7.327 938 H SER 120 H SER 120 -4.340 -11.583 -12.186 939 HA SER 120 HA SER 120 -4.506 -14.310 -11.503 940 HB2 SER 120 2HB SER 120 -6.855 -13.852 -11.054 941 HB3 SER 120 3HB SER 120 -7.040 -13.101 -12.639 942 HG SER 120 HG SER 120 -7.759 -15.175 -12.844 943 H MET 121 H MET 121 -2.994 -14.881 -12.937 944 HA MET 121 HA MET 121 -3.627 -14.852 -15.735 945 HB2 MET 121 2HB MET 121 -2.576 -12.552 -15.134 946 HB3 MET 121 3HB MET 121 -1.068 -13.451 -15.024 947 HG2 MET 121 2HG MET 121 -1.399 -14.224 -17.342 948 HG3 MET 121 3HG MET 121 -2.849 -13.228 -17.438 949 HE1 MET 121 3HE MET 121 -0.564 -12.954 -19.583 950 HE2 MET 121 1HE MET 121 0.773 -11.873 -19.190 951 HE3 MET 121 2HE MET 121 0.666 -13.456 -18.421 952 H LYS 122 H LYS 122 -3.041 -16.790 -13.662 953 HA LYS 122 HA LYS 122 -1.186 -18.410 -15.115 954 HB2 LYS 122 2HB LYS 122 0.351 -18.758 -13.142 955 HB3 LYS 122 3HB LYS 122 0.503 -17.204 -13.953 956 HG2 LYS 122 2HG LYS 122 -0.292 -16.039 -12.177 957 HG3 LYS 122 3HG LYS 122 -1.352 -17.349 -11.650 958 HD2 LYS 122 2HD LYS 122 0.292 -17.276 -9.998 959 HD3 LYS 122 3HD LYS 122 0.827 -18.586 -11.054 960 HE2 LYS 122 2HE LYS 122 2.324 -16.985 -12.206 961 HE3 LYS 122 3HE LYS 122 1.839 -15.744 -11.052 962 HZ1 LYS 122 3HZ LYS 122 3.886 -16.684 -10.327 963 HZ2 LYS 122 1HZ LYS 122 3.292 -18.262 -10.460 964 HZ3 LYS 122 2HZ LYS 122 2.682 -17.227 -9.271 965 H GLU 123 H GLU 123 -3.514 -19.276 -14.953 966 HA GLU 123 HA GLU 123 -4.456 -20.415 -12.558 967 HB2 GLU 123 2HB GLU 123 -5.612 -20.026 -14.897 968 HB3 GLU 123 3HB GLU 123 -5.074 -21.673 -15.198 969 HG2 GLU 123 2HG GLU 123 -6.310 -22.468 -13.284 970 HG3 GLU 123 3HG GLU 123 -6.779 -20.820 -12.869 971 H ALA 124 H ALA 124 -3.539 -21.966 -11.404 972 HA ALA 124 HA ALA 124 -2.735 -24.444 -12.591 973 HB1 ALA 124 1HB ALA 124 -0.673 -23.576 -13.107 974 HB2 ALA 124 2HB ALA 124 -0.671 -22.472 -11.732 975 HB3 ALA 124 3HB ALA 124 -0.376 -24.193 -11.482 976 H GLY 125 H GLY 125 -1.679 -25.887 -10.831 977 HA2 GLY 125 2HA GLY 125 -1.982 -25.327 -8.104 978 HA3 GLY 125 3HA GLY 125 -3.478 -26.055 -8.670 979 H GLY 126 H GLY 126 -1.585 -27.112 -6.739 980 HA2 GLY 126 2HA GLY 126 -1.596 -29.786 -7.351 981 HA3 GLY 126 3HA GLY 126 -0.072 -29.195 -7.997 982 H LYS 127 H LYS 127 -1.913 -28.533 -5.016 983 HA LYS 127 HA LYS 127 0.563 -29.034 -3.504 984 HB2 LYS 127 2HB LYS 127 -0.871 -26.769 -3.483 985 HB3 LYS 127 3HB LYS 127 -1.733 -27.647 -2.227 986 HG2 LYS 127 2HG LYS 127 1.152 -27.782 -1.909 987 HG3 LYS 127 3HG LYS 127 0.532 -26.129 -1.887 988 HD2 LYS 127 2HD LYS 127 -1.280 -27.347 -0.300 989 HD3 LYS 127 3HD LYS 127 0.146 -28.330 0.039 990 HE2 LYS 127 2HE LYS 127 -0.004 -25.323 0.236 991 HE3 LYS 127 3HE LYS 127 -0.072 -26.443 1.596 992 HZ1 LYS 127 3HZ LYS 127 2.156 -25.400 1.096 993 HZ2 LYS 127 1HZ LYS 127 2.217 -26.384 -0.278 994 HZ3 LYS 127 2HZ LYS 127 2.142 -27.083 1.260 995 H GLU 128 H GLU 128 0.565 -31.059 -2.756 996 HA GLU 128 HA GLU 128 -1.315 -31.905 -0.824 997 HB2 GLU 128 2HB GLU 128 -2.382 -33.738 -1.974 998 HB3 GLU 128 3HB GLU 128 -2.690 -32.252 -2.863 999 HG2 GLU 128 2HG GLU 128 -0.583 -32.989 -4.226 1000 HG3 GLU 128 3HG GLU 128 -0.994 -34.583 -3.596 1001 H GLU 129 H GLU 129 -0.508 -33.549 0.396 1002 HA GLU 129 HA GLU 129 2.043 -34.708 -0.511 1003 HB2 GLU 129 2HB GLU 129 1.100 -34.393 2.341 1004 HB3 GLU 129 3HB GLU 129 2.702 -34.875 1.799 1005 HG2 GLU 129 2HG GLU 129 1.414 -32.174 1.627 1006 HG3 GLU 129 3HG GLU 129 2.893 -32.635 2.467 1007 H GLY 130 H GLY 130 2.508 -36.904 0.049 1008 HA2 GLY 130 2HA GLY 130 0.986 -38.738 1.360 1009 HA3 GLY 130 3HA GLY 130 0.196 -38.604 -0.204 1010 HA PRO 131 HA PRO 131 4.647 -40.291 -1.085 1011 HB2 PRO 131 2HB PRO 131 6.112 -41.026 1.079 1012 HB3 PRO 131 3HB PRO 131 6.169 -39.401 0.388 1013 HG2 PRO 131 2HG PRO 131 4.647 -40.395 2.766 1014 HG3 PRO 131 3HG PRO 131 5.565 -38.890 2.575 1015 HD2 PRO 131 2HD PRO 131 2.867 -38.986 2.369 1016 HD3 PRO 131 3HD PRO 131 3.856 -37.844 1.437 1017 HA PRO 132 HA PRO 132 3.574 -44.544 -0.786 1018 HB2 PRO 132 2HB PRO 132 5.959 -45.792 -1.141 1019 HB3 PRO 132 3HB PRO 132 5.107 -44.959 -2.446 1020 HG2 PRO 132 2HG PRO 132 7.388 -44.003 -0.761 1021 HG3 PRO 132 3HG PRO 132 7.142 -43.836 -2.509 1022 HD2 PRO 132 2HD PRO 132 6.639 -41.824 -0.768 1023 HD3 PRO 132 3HD PRO 132 5.708 -42.047 -2.263 1024 H GLN 133 H GLN 133 6.208 -43.454 1.275 1025 HA GLN 133 HA GLN 133 6.908 -44.077 3.348 1026 HB2 GLN 133 2HB GLN 133 3.993 -44.673 3.353 1027 HB3 GLN 133 3HB GLN 133 4.953 -45.304 4.685 1028 HG2 GLN 133 2HG GLN 133 5.827 -42.919 4.947 1029 HG3 GLN 133 3HG GLN 133 4.487 -42.452 3.901 1030 HE21 GLN 133 1HE2 GLN 133 5.018 -44.563 6.709 1031 HE22 GLN 133 2HE2 GLN 133 3.631 -44.025 7.588 1032 H ALA 134 H ALA 134 8.227 -45.637 1.988 1033 HA ALA 134 HA ALA 134 8.311 -48.142 3.290 1034 HB1 ALA 134 1HB ALA 134 7.996 -49.282 0.847 1035 HB2 ALA 134 2HB ALA 134 6.741 -49.200 2.083 1036 HB3 ALA 134 3HB ALA 134 6.783 -48.002 0.789 1037 H TYR 135 H TYR 135 10.462 -48.050 3.539 1038 HA TYR 135 HA TYR 135 12.686 -48.034 3.065 1039 HB2 TYR 135 2HB TYR 135 11.556 -49.782 1.303 1040 HB3 TYR 135 3HB TYR 135 12.368 -48.672 0.205 1041 HD1 TYR 135 HD1 TYR 135 13.051 -50.585 3.344 1042 HD2 TYR 135 HD2 TYR 135 14.568 -49.106 -0.346 1043 HE1 TYR 135 HE1 TYR 135 15.181 -51.742 3.763 1044 HE2 TYR 135 HE2 TYR 135 16.702 -50.259 0.063 1045 HH TYR 135 HH TYR 135 17.314 -51.972 3.093 Start of MODEL 6 1 H21 MYR 1 1H2 MYR 1 9.812 9.128 -4.278 2 H22 MYR 1 2H2 MYR 1 9.650 7.386 -4.388 3 H31 MYR 1 1H3 MYR 1 8.304 9.303 -6.426 4 H32 MYR 1 2H3 MYR 1 7.521 8.854 -4.910 5 H41 MYR 1 1H4 MYR 1 8.568 6.695 -6.847 6 H42 MYR 1 2H4 MYR 1 6.987 7.441 -7.093 7 H51 MYR 1 1H5 MYR 1 7.732 6.243 -4.355 8 H52 MYR 1 2H5 MYR 1 7.172 5.199 -5.663 9 H61 MYR 1 1H6 MYR 1 5.371 7.518 -5.489 10 H62 MYR 1 2H6 MYR 1 5.579 6.850 -3.868 11 H71 MYR 1 1H7 MYR 1 5.194 4.715 -5.937 12 H72 MYR 1 2H7 MYR 1 3.847 5.855 -5.892 13 H81 MYR 1 1H8 MYR 1 4.426 5.337 -3.129 14 H82 MYR 1 2H8 MYR 1 4.618 3.767 -3.914 15 H91 MYR 1 1H9 MYR 1 2.357 3.565 -4.396 16 H92 MYR 1 2H9 MYR 1 2.183 5.259 -4.854 17 H101 MYR 1 1H10 MYR 1 1.420 5.869 -2.784 18 H102 MYR 1 2H10 MYR 1 2.720 5.045 -1.937 19 H111 MYR 1 1H11 MYR 1 0.198 3.633 -3.056 20 H112 MYR 1 2H11 MYR 1 0.339 4.254 -1.419 21 H121 MYR 1 1H12 MYR 1 2.654 2.667 -1.581 22 H122 MYR 1 2H12 MYR 1 1.532 1.757 -2.593 23 H131 MYR 1 1H13 MYR 1 -0.150 2.315 -0.457 24 H132 MYR 1 2H13 MYR 1 1.399 2.320 0.388 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 11.015 10.296 -5.924 29 HA2 GLY 2 2HA GLY 2 13.400 9.590 -6.676 30 HA3 GLY 2 3HA GLY 2 12.496 8.602 -7.814 31 H ASN 3 H ASN 3 10.697 9.975 -8.973 32 HA ASN 3 HA ASN 3 11.688 12.649 -9.622 33 HB2 ASN 3 2HB ASN 3 12.557 10.727 -11.203 34 HB3 ASN 3 3HB ASN 3 10.943 10.853 -11.897 35 HD21 ASN 3 1HD2 ASN 3 13.567 12.992 -10.827 36 HD22 ASN 3 2HD2 ASN 3 13.478 14.058 -12.183 37 H GLY 4 H GLY 4 10.109 13.677 -11.304 38 HA2 GLY 4 2HA GLY 4 7.480 13.508 -10.116 39 HA3 GLY 4 3HA GLY 4 8.001 14.650 -11.346 40 H ALA 5 H ALA 5 7.495 11.133 -11.025 41 HA ALA 5 HA ALA 5 5.855 11.220 -13.452 42 HB1 ALA 5 1HB ALA 5 8.362 9.651 -13.069 43 HB2 ALA 5 2HB ALA 5 7.058 8.973 -14.043 44 HB3 ALA 5 3HB ALA 5 7.781 10.518 -14.491 45 H SER 6 H SER 6 4.281 9.614 -13.591 46 HA SER 6 HA SER 6 3.707 8.280 -11.048 47 HB2 SER 6 2HB SER 6 1.807 8.408 -13.375 48 HB3 SER 6 3HB SER 6 1.443 8.275 -11.655 49 HG SER 6 HG SER 6 1.296 10.359 -11.655 50 H ARG 7 H ARG 7 5.709 7.280 -12.936 51 HA ARG 7 HA ARG 7 4.695 5.080 -14.392 52 HB2 ARG 7 2HB ARG 7 7.350 6.088 -13.592 53 HB3 ARG 7 3HB ARG 7 7.263 4.353 -13.870 54 HG2 ARG 7 2HG ARG 7 6.863 4.587 -16.102 55 HG3 ARG 7 3HG ARG 7 6.074 6.154 -15.909 56 HD2 ARG 7 2HD ARG 7 8.138 7.273 -15.663 57 HD3 ARG 7 3HD ARG 7 9.015 5.761 -15.430 58 HE ARG 7 HE ARG 7 7.791 5.764 -17.967 59 HH11 ARG 7 1HH1 ARG 7 10.399 7.267 -16.218 60 HH12 ARG 7 2HH1 ARG 7 11.362 7.543 -17.632 61 HH21 ARG 7 1HH2 ARG 7 9.050 6.122 -19.836 62 HH22 ARG 7 2HH2 ARG 7 10.593 6.892 -19.689 63 H ASP 8 H ASP 8 6.237 5.295 -11.195 64 HA ASP 8 HA ASP 8 6.174 2.583 -10.553 65 HB2 ASP 8 2HB ASP 8 6.497 5.109 -9.094 66 HB3 ASP 8 3HB ASP 8 5.810 3.810 -8.123 67 H TRP 9 H TRP 9 3.719 5.088 -10.142 68 HA TRP 9 HA TRP 9 1.894 3.549 -8.645 69 HB2 TRP 9 2HB TRP 9 1.651 5.943 -8.720 70 HB3 TRP 9 3HB TRP 9 1.473 5.920 -10.472 71 HD1 TRP 9 HD1 TRP 9 -0.925 5.597 -11.427 72 HE1 TRP 9 HE1 TRP 9 -3.253 5.292 -10.372 73 HE3 TRP 9 HE3 TRP 9 0.478 4.816 -6.573 74 HZ2 TRP 9 HZ2 TRP 9 -4.350 4.787 -7.820 75 HZ3 TRP 9 HZ3 TRP 9 -1.272 4.430 -4.887 76 HH2 TRP 9 HH2 TRP 9 -3.635 4.417 -5.500 77 H LYS 10 H LYS 10 1.992 4.272 -12.133 78 HA LYS 10 HA LYS 10 -0.208 2.744 -12.894 79 HB2 LYS 10 2HB LYS 10 1.741 4.262 -14.187 80 HB3 LYS 10 3HB LYS 10 1.926 2.649 -14.864 81 HG2 LYS 10 2HG LYS 10 -0.072 2.711 -15.920 82 HG3 LYS 10 3HG LYS 10 -0.831 3.692 -14.664 83 HD2 LYS 10 2HD LYS 10 0.063 5.681 -15.519 84 HD3 LYS 10 3HD LYS 10 1.273 4.828 -16.480 85 HE2 LYS 10 2HE LYS 10 -1.274 3.913 -17.307 86 HE3 LYS 10 3HE LYS 10 -1.346 5.672 -17.230 87 HZ1 LYS 10 3HZ LYS 10 -0.041 5.861 -19.008 88 HZ2 LYS 10 1HZ LYS 10 -0.334 4.218 -19.285 89 HZ3 LYS 10 2HZ LYS 10 1.058 4.700 -18.455 90 H MET 11 H MET 11 3.157 1.809 -12.404 91 HA MET 11 HA MET 11 2.862 -0.837 -13.409 92 HB2 MET 11 2HB MET 11 4.934 0.508 -11.688 93 HB3 MET 11 3HB MET 11 5.025 -1.205 -12.074 94 HG2 MET 11 2HG MET 11 4.592 0.160 -14.499 95 HG3 MET 11 3HG MET 11 5.846 1.037 -13.626 96 HE1 MET 11 3HE MET 11 6.025 -1.123 -16.537 97 HE2 MET 11 1HE MET 11 6.196 -2.771 -15.931 98 HE3 MET 11 2HE MET 11 4.732 -1.852 -15.584 99 H ALA 12 H ALA 12 2.962 0.513 -10.119 100 HA ALA 12 HA ALA 12 2.716 -1.812 -8.655 101 HB1 ALA 12 1HB ALA 12 1.434 0.844 -8.022 102 HB2 ALA 12 2HB ALA 12 1.782 -0.450 -6.874 103 HB3 ALA 12 3HB ALA 12 3.105 0.402 -7.670 104 H ILE 13 H ILE 13 0.208 0.039 -10.299 105 HA ILE 13 HA ILE 13 -1.910 -1.650 -9.283 106 HB ILE 13 HB ILE 13 -1.995 0.509 -11.394 107 HG12 ILE 13 2HG1 ILE 13 -1.360 1.319 -9.143 108 HG13 ILE 13 3HG1 ILE 13 -2.937 1.919 -9.645 109 HG21 ILE 13 1HG2 ILE 13 -4.516 0.263 -10.331 110 HG22 ILE 13 2HG2 ILE 13 -3.983 -0.385 -11.881 111 HG23 ILE 13 3HG2 ILE 13 -3.971 -1.410 -10.446 112 HD11 ILE 13 3HD1 ILE 13 -3.243 -0.540 -8.213 113 HD12 ILE 13 1HD1 ILE 13 -2.279 0.598 -7.272 114 HD13 ILE 13 2HD1 ILE 13 -3.882 1.061 -7.842 115 H LYS 14 H LYS 14 -0.066 -1.257 -12.247 116 HA LYS 14 HA LYS 14 -1.603 -2.803 -13.980 117 HB2 LYS 14 2HB LYS 14 0.287 -1.446 -14.732 118 HB3 LYS 14 3HB LYS 14 1.404 -2.502 -13.878 119 HG2 LYS 14 2HG LYS 14 0.641 -4.372 -15.339 120 HG3 LYS 14 3HG LYS 14 -0.293 -3.194 -16.264 121 HD2 LYS 14 2HD LYS 14 1.983 -1.929 -16.419 122 HD3 LYS 14 3HD LYS 14 2.673 -3.507 -16.032 123 HE2 LYS 14 2HE LYS 14 2.648 -3.475 -18.361 124 HE3 LYS 14 3HE LYS 14 1.199 -4.390 -17.944 125 HZ1 LYS 14 3HZ LYS 14 1.324 -1.536 -18.753 126 HZ2 LYS 14 1HZ LYS 14 -0.079 -2.312 -18.211 127 HZ3 LYS 14 2HZ LYS 14 0.667 -2.816 -19.643 128 H ARG 15 H ARG 15 0.561 -3.747 -11.417 129 HA ARG 15 HA ARG 15 0.431 -6.555 -12.217 130 HB2 ARG 15 2HB ARG 15 1.931 -5.247 -9.939 131 HB3 ARG 15 3HB ARG 15 2.060 -6.934 -10.420 132 HG2 ARG 15 2HG ARG 15 2.578 -4.984 -12.555 133 HG3 ARG 15 3HG ARG 15 3.740 -4.983 -11.227 134 HD2 ARG 15 2HD ARG 15 4.620 -6.938 -11.859 135 HD3 ARG 15 3HD ARG 15 3.033 -7.664 -12.112 136 HE ARG 15 HE ARG 15 3.278 -7.269 -14.342 137 HH11 ARG 15 1HH1 ARG 15 5.420 -5.148 -12.601 138 HH12 ARG 15 2HH1 ARG 15 6.165 -4.514 -14.031 139 HH21 ARG 15 1HH2 ARG 15 4.250 -6.441 -16.232 140 HH22 ARG 15 2HH2 ARG 15 5.498 -5.249 -16.096 141 H CYS 16 H CYS 16 -0.208 -4.577 -9.321 142 HA CYS 16 HA CYS 16 -1.392 -6.548 -7.763 143 HB2 CYS 16 2HB CYS 16 -0.731 -4.164 -7.105 144 HB3 CYS 16 3HB CYS 16 -2.291 -3.670 -7.750 145 HG CYS 16 HG CYS 16 -2.972 -3.746 -5.198 146 H SER 17 H SER 17 -2.643 -4.807 -10.481 147 HA SER 17 HA SER 17 -5.378 -4.978 -10.097 148 HB2 SER 17 2HB SER 17 -3.592 -4.829 -12.459 149 HB3 SER 17 3HB SER 17 -5.237 -5.389 -12.761 150 HG SER 17 HG SER 17 -4.322 -2.893 -11.971 151 H ASN 18 H ASN 18 -3.092 -7.476 -10.888 152 HA ASN 18 HA ASN 18 -5.224 -9.390 -11.462 153 HB2 ASN 18 2HB ASN 18 -2.215 -9.696 -11.566 154 HB3 ASN 18 3HB ASN 18 -3.376 -10.935 -12.033 155 HD21 ASN 18 1HD2 ASN 18 -4.012 -10.991 -14.071 156 HD22 ASN 18 2HD2 ASN 18 -3.775 -9.737 -15.236 157 H VAL 19 H VAL 19 -5.085 -8.353 -8.823 158 HA VAL 19 HA VAL 19 -3.883 -10.452 -7.199 159 HB VAL 19 HB VAL 19 -3.679 -8.103 -6.473 160 HG11 VAL 19 1HG1 VAL 19 -5.582 -6.867 -5.666 161 HG12 VAL 19 2HG1 VAL 19 -5.883 -7.358 -7.334 162 HG13 VAL 19 3HG1 VAL 19 -6.656 -8.224 -6.006 163 HG21 VAL 19 3HG2 VAL 19 -3.635 -9.977 -4.852 164 HG22 VAL 19 1HG2 VAL 19 -4.220 -8.467 -4.153 165 HG23 VAL 19 2HG2 VAL 19 -5.362 -9.741 -4.580 166 H ALA 20 H ALA 20 -4.984 -11.997 -6.107 167 HA ALA 20 HA ALA 20 -7.909 -12.061 -6.473 168 HB1 ALA 20 1HB ALA 20 -7.856 -14.376 -6.760 169 HB2 ALA 20 2HB ALA 20 -6.464 -13.803 -7.681 170 HB3 ALA 20 3HB ALA 20 -6.233 -14.517 -6.085 171 H VAL 21 H VAL 21 -9.193 -12.784 -4.760 172 HA VAL 21 HA VAL 21 -8.359 -12.053 -2.182 173 HB VAL 21 HB VAL 21 -10.670 -13.881 -2.837 174 HG11 VAL 21 1HG1 VAL 21 -10.762 -11.877 -0.659 175 HG12 VAL 21 2HG1 VAL 21 -11.464 -13.494 -0.746 176 HG13 VAL 21 3HG1 VAL 21 -9.745 -13.294 -0.405 177 HG21 VAL 21 3HG2 VAL 21 -10.223 -11.157 -3.609 178 HG22 VAL 21 1HG2 VAL 21 -11.599 -12.204 -3.958 179 HG23 VAL 21 2HG2 VAL 21 -11.574 -11.244 -2.479 180 H GLY 22 H GLY 22 -8.647 -15.222 -3.738 181 HA2 GLY 22 2HA GLY 22 -7.335 -16.413 -1.375 182 HA3 GLY 22 3HA GLY 22 -8.398 -17.291 -2.466 183 H VAL 23 H VAL 23 -6.458 -18.761 -2.374 184 HA VAL 23 HA VAL 23 -4.054 -18.003 -3.690 185 HB VAL 23 HB VAL 23 -4.127 -19.876 -2.106 186 HG11 VAL 23 1HG1 VAL 23 -5.360 -21.780 -2.374 187 HG12 VAL 23 2HG1 VAL 23 -6.429 -20.622 -3.168 188 HG13 VAL 23 3HG1 VAL 23 -5.375 -21.657 -4.133 189 HG21 VAL 23 3HG2 VAL 23 -2.687 -19.721 -4.427 190 HG22 VAL 23 1HG2 VAL 23 -2.392 -20.867 -3.120 191 HG23 VAL 23 2HG2 VAL 23 -3.360 -21.349 -4.514 192 H GLY 24 H GLY 24 -7.090 -19.398 -4.751 193 HA2 GLY 24 2HA GLY 24 -7.051 -18.590 -7.339 194 HA3 GLY 24 3HA GLY 24 -6.103 -20.069 -7.379 195 H GLY 25 H GLY 25 -7.658 -21.059 -8.730 196 HA2 GLY 25 2HA GLY 25 -9.337 -22.638 -8.952 197 HA3 GLY 25 3HA GLY 25 -9.740 -22.397 -7.258 198 H LYS 26 H LYS 26 -11.532 -21.291 -6.771 199 HA LYS 26 HA LYS 26 -12.842 -19.793 -8.946 200 HB2 LYS 26 2HB LYS 26 -13.864 -22.030 -8.007 201 HB3 LYS 26 3HB LYS 26 -14.404 -20.993 -6.693 202 HG2 LYS 26 2HG LYS 26 -16.210 -20.729 -7.997 203 HG3 LYS 26 3HG LYS 26 -15.201 -19.531 -8.810 204 HD2 LYS 26 2HD LYS 26 -14.437 -21.795 -10.088 205 HD3 LYS 26 3HD LYS 26 -16.123 -22.172 -9.727 206 HE2 LYS 26 2HE LYS 26 -16.550 -21.052 -11.625 207 HE3 LYS 26 3HE LYS 26 -16.327 -19.615 -10.628 208 HZ1 LYS 26 3HZ LYS 26 -14.074 -19.443 -11.346 209 HZ2 LYS 26 1HZ LYS 26 -15.041 -19.597 -12.725 210 HZ3 LYS 26 2HZ LYS 26 -14.150 -20.921 -12.165 211 H SER 27 H SER 27 -11.315 -18.143 -7.825 212 HA SER 27 HA SER 27 -12.812 -16.837 -5.647 213 HB2 SER 27 2HB SER 27 -10.793 -16.035 -4.717 214 HB3 SER 27 3HB SER 27 -10.452 -17.713 -5.140 215 HG SER 27 HG SER 27 -8.787 -16.316 -5.835 216 H LYS 28 H LYS 28 -12.360 -14.412 -5.573 217 HA LYS 28 HA LYS 28 -12.724 -13.360 -8.284 218 HB2 LYS 28 2HB LYS 28 -14.104 -12.914 -5.908 219 HB3 LYS 28 3HB LYS 28 -13.139 -11.459 -6.122 220 HG2 LYS 28 2HG LYS 28 -14.133 -10.996 -8.218 221 HG3 LYS 28 3HG LYS 28 -14.886 -12.591 -8.289 222 HD2 LYS 28 2HD LYS 28 -16.584 -11.028 -7.691 223 HD3 LYS 28 3HD LYS 28 -16.195 -11.959 -6.243 224 HE2 LYS 28 2HE LYS 28 -14.485 -9.675 -6.376 225 HE3 LYS 28 3HE LYS 28 -16.156 -9.154 -6.587 226 HZ1 LYS 28 3HZ LYS 28 -16.279 -9.255 -4.382 227 HZ2 LYS 28 1HZ LYS 28 -14.834 -10.123 -4.239 228 HZ3 LYS 28 2HZ LYS 28 -16.285 -10.939 -4.540 229 H LYS 29 H LYS 29 -12.015 -10.851 -8.251 230 HA LYS 29 HA LYS 29 -9.320 -10.634 -7.120 231 HB2 LYS 29 2HB LYS 29 -9.999 -10.133 -10.024 232 HB3 LYS 29 3HB LYS 29 -8.447 -9.793 -9.270 233 HG2 LYS 29 2HG LYS 29 -8.047 -12.120 -8.890 234 HG3 LYS 29 3HG LYS 29 -9.678 -12.535 -9.424 235 HD2 LYS 29 2HD LYS 29 -8.586 -12.962 -11.367 236 HD3 LYS 29 3HD LYS 29 -8.840 -11.231 -11.602 237 HE2 LYS 29 2HE LYS 29 -6.564 -11.675 -12.115 238 HE3 LYS 29 3HE LYS 29 -6.589 -10.862 -10.551 239 HZ1 LYS 29 3HZ LYS 29 -6.755 -13.642 -10.156 240 HZ2 LYS 29 1HZ LYS 29 -5.539 -12.576 -9.659 241 HZ3 LYS 29 2HZ LYS 29 -5.445 -13.318 -11.176 242 H PHE 30 H PHE 30 -8.445 -8.374 -7.386 243 HA PHE 30 HA PHE 30 -10.642 -6.450 -7.021 244 HB2 PHE 30 2HB PHE 30 -7.808 -6.132 -6.032 245 HB3 PHE 30 3HB PHE 30 -9.227 -5.206 -5.554 246 HD1 PHE 30 HD1 PHE 30 -11.202 -7.281 -5.032 247 HD2 PHE 30 HD2 PHE 30 -7.045 -7.176 -4.120 248 HE1 PHE 30 HE1 PHE 30 -11.578 -8.826 -3.154 249 HE2 PHE 30 HE2 PHE 30 -7.415 -8.721 -2.241 250 HZ PHE 30 HZ PHE 30 -9.684 -9.549 -1.757 251 H GLY 31 H GLY 31 -9.850 -4.105 -7.473 252 HA2 GLY 31 2HA GLY 31 -8.137 -4.028 -9.860 253 HA3 GLY 31 3HA GLY 31 -9.768 -3.381 -9.963 254 H GLU 32 H GLU 32 -8.359 -1.476 -10.621 255 HA GLU 32 HA GLU 32 -6.759 -0.079 -8.824 256 HB2 GLU 32 2HB GLU 32 -8.565 1.207 -10.871 257 HB3 GLU 32 3HB GLU 32 -7.050 1.833 -10.236 258 HG2 GLU 32 2HG GLU 32 -6.025 0.929 -11.971 259 HG3 GLU 32 3HG GLU 32 -6.417 -0.659 -11.315 260 H GLY 33 H GLY 33 -10.257 0.182 -9.397 261 HA2 GLY 33 2HA GLY 33 -10.745 2.269 -7.575 262 HA3 GLY 33 3HA GLY 33 -11.936 1.103 -8.133 263 H ASN 34 H ASN 34 -10.556 -1.217 -7.120 264 HA ASN 34 HA ASN 34 -11.656 -1.317 -4.533 265 HB2 ASN 34 2HB ASN 34 -11.110 -3.248 -6.164 266 HB3 ASN 34 3HB ASN 34 -9.491 -3.182 -5.475 267 HD21 ASN 34 1HD2 ASN 34 -12.243 -4.821 -5.316 268 HD22 ASN 34 2HD2 ASN 34 -12.235 -5.311 -3.659 269 H PHE 35 H PHE 35 -8.304 -0.981 -5.645 270 HA PHE 35 HA PHE 35 -7.093 -1.005 -3.112 271 HB2 PHE 35 2HB PHE 35 -6.082 0.529 -5.508 272 HB3 PHE 35 3HB PHE 35 -5.136 -0.163 -4.194 273 HD1 PHE 35 HD2 PHE 35 -6.221 -2.858 -3.976 274 HD2 PHE 35 HD1 PHE 35 -5.375 -0.525 -7.434 275 HE1 PHE 35 HE2 PHE 35 -5.911 -4.918 -5.286 276 HE2 PHE 35 HE1 PHE 35 -5.064 -2.581 -8.750 277 HZ PHE 35 HZ PHE 35 -5.331 -4.781 -7.675 278 H ARG 36 H ARG 36 -7.985 1.759 -5.179 279 HA ARG 36 HA ARG 36 -7.250 3.796 -3.442 280 HB2 ARG 36 2HB ARG 36 -9.639 3.877 -5.289 281 HB3 ARG 36 3HB ARG 36 -8.681 5.240 -4.724 282 HG2 ARG 36 2HG ARG 36 -6.883 3.488 -5.979 283 HG3 ARG 36 3HG ARG 36 -8.301 3.588 -7.026 284 HD2 ARG 36 2HD ARG 36 -6.839 5.973 -5.902 285 HD3 ARG 36 3HD ARG 36 -6.555 5.299 -7.507 286 HE ARG 36 HE ARG 36 -9.279 5.817 -7.290 287 HH11 ARG 36 1HH1 ARG 36 -6.280 7.585 -7.304 288 HH12 ARG 36 2HH1 ARG 36 -6.977 9.019 -7.982 289 HH21 ARG 36 1HH2 ARG 36 -10.209 7.699 -8.182 290 HH22 ARG 36 2HH2 ARG 36 -9.212 9.083 -8.480 291 H TRP 37 H TRP 37 -10.267 1.967 -3.626 292 HA TRP 37 HA TRP 37 -11.766 3.466 -1.801 293 HB2 TRP 37 2HB TRP 37 -12.853 1.819 -3.174 294 HB3 TRP 37 3HB TRP 37 -11.868 0.526 -2.494 295 HD1 TRP 37 HD1 TRP 37 -14.898 2.715 -1.705 296 HE1 TRP 37 HE1 TRP 37 -16.147 1.703 0.304 297 HE3 TRP 37 HE3 TRP 37 -11.528 -0.899 -0.392 298 HZ2 TRP 37 HZ2 TRP 37 -15.756 -0.355 2.196 299 HZ3 TRP 37 HZ3 TRP 37 -12.041 -2.346 1.530 300 HH2 TRP 37 HH2 TRP 37 -14.112 -2.078 2.797 301 H ALA 38 H ALA 38 -9.770 0.568 -1.251 302 HA ALA 38 HA ALA 38 -10.162 0.508 1.551 303 HB1 ALA 38 1HB ALA 38 -9.463 -1.477 0.389 304 HB2 ALA 38 2HB ALA 38 -7.982 -0.687 -0.154 305 HB3 ALA 38 3HB ALA 38 -8.220 -1.034 1.559 306 H ILE 39 H ILE 39 -7.348 1.557 -0.377 307 HA ILE 39 HA ILE 39 -5.746 2.475 1.671 308 HB ILE 39 HB ILE 39 -6.029 3.697 -1.077 309 HG12 ILE 39 2HG1 ILE 39 -3.947 1.713 -0.182 310 HG13 ILE 39 3HG1 ILE 39 -5.491 1.188 -0.844 311 HG21 ILE 39 1HG2 ILE 39 -4.685 5.262 -0.194 312 HG22 ILE 39 2HG2 ILE 39 -4.262 4.259 1.192 313 HG23 ILE 39 3HG2 ILE 39 -3.432 4.030 -0.347 314 HD11 ILE 39 3HD1 ILE 39 -3.896 1.171 -2.599 315 HD12 ILE 39 1HD1 ILE 39 -4.980 2.533 -2.881 316 HD13 ILE 39 2HD1 ILE 39 -3.369 2.810 -2.218 317 H ARG 40 H ARG 40 -8.261 4.252 -0.097 318 HA ARG 40 HA ARG 40 -7.912 6.738 1.125 319 HB2 ARG 40 2HB ARG 40 -9.322 6.301 -0.881 320 HB3 ARG 40 3HB ARG 40 -10.515 5.540 0.163 321 HG2 ARG 40 2HG ARG 40 -9.690 8.275 0.900 322 HG3 ARG 40 3HG ARG 40 -10.628 8.105 -0.585 323 HD2 ARG 40 2HD ARG 40 -11.907 6.471 1.279 324 HD3 ARG 40 3HD ARG 40 -11.484 7.934 2.167 325 HE ARG 40 HE ARG 40 -12.599 8.775 -0.213 326 HH11 ARG 40 1HH1 ARG 40 -13.588 6.884 2.537 327 HH12 ARG 40 2HH1 ARG 40 -15.258 7.326 2.405 328 HH21 ARG 40 1HH2 ARG 40 -14.794 9.364 -0.398 329 HH22 ARG 40 2HH2 ARG 40 -15.943 8.736 0.734 330 H MET 41 H MET 41 -10.095 4.069 2.010 331 HA MET 41 HA MET 41 -11.358 5.218 4.179 332 HB2 MET 41 2HB MET 41 -11.860 2.979 3.159 333 HB3 MET 41 3HB MET 41 -10.475 2.333 4.029 334 HG2 MET 41 2HG MET 41 -11.968 1.831 5.607 335 HG3 MET 41 3HG MET 41 -11.842 3.535 6.037 336 HE1 MET 41 3HE MET 41 -13.642 5.366 4.375 337 HE2 MET 41 1HE MET 41 -15.121 5.055 5.284 338 HE3 MET 41 2HE MET 41 -13.566 5.084 6.115 339 H ALA 42 H ALA 42 -8.206 3.626 4.042 340 HA ALA 42 HA ALA 42 -7.727 3.773 6.852 341 HB1 ALA 42 1HB ALA 42 -5.495 3.592 4.885 342 HB2 ALA 42 2HB ALA 42 -5.709 2.763 6.427 343 HB3 ALA 42 3HB ALA 42 -6.639 2.255 5.016 344 H ASN 43 H ASN 43 -6.752 5.732 4.065 345 HA ASN 43 HA ASN 43 -5.002 7.473 5.344 346 HB2 ASN 43 2HB ASN 43 -6.221 7.280 2.804 347 HB3 ASN 43 3HB ASN 43 -6.557 8.905 3.393 348 HD21 ASN 43 1HD2 ASN 43 -5.158 10.262 2.553 349 HD22 ASN 43 2HD2 ASN 43 -3.457 10.004 2.392 350 H VAL 44 H VAL 44 -8.478 7.338 5.389 351 HA VAL 44 HA VAL 44 -8.798 9.972 6.528 352 HB VAL 44 HB VAL 44 -10.808 7.728 6.294 353 HG11 VAL 44 1HG1 VAL 44 -12.467 9.555 6.547 354 HG12 VAL 44 2HG1 VAL 44 -11.476 9.306 7.985 355 HG13 VAL 44 3HG1 VAL 44 -11.142 10.662 6.906 356 HG21 VAL 44 3HG2 VAL 44 -9.727 9.599 4.350 357 HG22 VAL 44 1HG2 VAL 44 -10.720 8.162 4.106 358 HG23 VAL 44 2HG2 VAL 44 -11.482 9.706 4.488 359 H SER 45 H SER 45 -9.606 6.704 7.719 360 HA SER 45 HA SER 45 -10.086 7.373 10.357 361 HB2 SER 45 2HB SER 45 -9.374 4.899 8.908 362 HB3 SER 45 3HB SER 45 -9.022 4.885 10.636 363 HG SER 45 HG SER 45 -11.471 5.022 9.313 364 H THR 46 H THR 46 -7.023 6.691 8.758 365 HA THR 46 HA THR 46 -5.617 7.380 11.255 366 HB THR 46 HB THR 46 -3.736 6.114 10.527 367 HG1 THR 46 HG1 THR 46 -4.982 5.374 8.111 368 HG21 THR 46 3HG2 THR 46 -5.923 4.308 9.602 369 HG22 THR 46 1HG2 THR 46 -5.965 4.919 11.256 370 HG23 THR 46 2HG2 THR 46 -4.581 3.980 10.698 371 H GLY 47 H GLY 47 -6.616 9.471 9.771 372 HA2 GLY 47 2HA GLY 47 -4.311 11.037 9.336 373 HA3 GLY 47 3HA GLY 47 -4.946 10.513 7.783 374 H ARG 48 H ARG 48 -7.442 10.824 7.640 375 HA ARG 48 HA ARG 48 -9.188 12.275 7.493 376 HB2 ARG 48 2HB ARG 48 -8.787 12.075 10.105 377 HB3 ARG 48 3HB ARG 48 -8.310 13.758 9.928 378 HG2 ARG 48 2HG ARG 48 -10.457 14.356 9.083 379 HG3 ARG 48 3HG ARG 48 -10.943 12.663 8.974 380 HD2 ARG 48 2HD ARG 48 -11.066 12.435 11.307 381 HD3 ARG 48 3HD ARG 48 -10.145 13.913 11.583 382 HE ARG 48 HE ARG 48 -12.614 14.384 10.214 383 HH11 ARG 48 1HH1 ARG 48 -11.155 13.901 13.338 384 HH12 ARG 48 2HH1 ARG 48 -12.397 14.753 14.195 385 HH21 ARG 48 1HH2 ARG 48 -14.255 15.508 11.331 386 HH22 ARG 48 2HH2 ARG 48 -14.160 15.666 13.052 387 H GLU 49 H GLU 49 -7.085 12.916 5.927 388 HA GLU 49 HA GLU 49 -7.461 15.696 5.490 389 HB2 GLU 49 2HB GLU 49 -5.144 14.855 7.075 390 HB3 GLU 49 3HB GLU 49 -4.721 15.832 5.676 391 HG2 GLU 49 2HG GLU 49 -5.414 17.688 6.663 392 HG3 GLU 49 3HG GLU 49 -6.966 16.964 7.080 393 HA PRO 50 HA PRO 50 -6.232 14.595 1.427 394 HB2 PRO 50 2HB PRO 50 -5.076 16.879 0.523 395 HB3 PRO 50 3HB PRO 50 -6.818 16.719 0.775 396 HG2 PRO 50 2HG PRO 50 -4.756 17.973 2.546 397 HG3 PRO 50 3HG PRO 50 -6.380 18.554 2.134 398 HD2 PRO 50 2HD PRO 50 -5.829 17.307 4.473 399 HD3 PRO 50 3HD PRO 50 -7.402 17.165 3.662 400 H GLY 51 H GLY 51 -3.654 16.417 3.097 401 HA2 GLY 51 2HA GLY 51 -1.609 15.036 1.569 402 HA3 GLY 51 3HA GLY 51 -1.347 16.284 2.777 403 H ASP 52 H ASP 52 -2.586 12.946 2.586 404 HA ASP 52 HA ASP 52 -0.868 12.272 4.868 405 HB2 ASP 52 2HB ASP 52 -3.507 12.646 5.265 406 HB3 ASP 52 3HB ASP 52 -3.521 10.952 4.784 407 H ILE 53 H ILE 53 -0.273 11.775 2.207 408 HA ILE 53 HA ILE 53 -0.700 8.866 1.993 409 HB ILE 53 HB ILE 53 -0.103 10.784 -0.262 410 HG12 ILE 53 2HG1 ILE 53 -2.689 9.348 0.369 411 HG13 ILE 53 3HG1 ILE 53 -2.382 11.041 0.740 412 HG21 ILE 53 1HG2 ILE 53 -1.178 8.352 -1.186 413 HG22 ILE 53 2HG2 ILE 53 0.455 8.974 -1.417 414 HG23 ILE 53 3HG2 ILE 53 0.093 7.941 -0.034 415 HD11 ILE 53 3HD1 ILE 53 -2.744 11.689 -1.365 416 HD12 ILE 53 1HD1 ILE 53 -1.887 10.307 -2.047 417 HD13 ILE 53 2HD1 ILE 53 -3.562 10.135 -1.522 418 HA PRO 54 HA PRO 54 3.798 9.489 2.829 419 HB2 PRO 54 2HB PRO 54 4.026 7.299 4.417 420 HB3 PRO 54 3HB PRO 54 3.505 8.875 5.024 421 HG2 PRO 54 2HG PRO 54 1.853 6.494 4.275 422 HG3 PRO 54 3HG PRO 54 1.692 7.573 5.673 423 HD2 PRO 54 2HD PRO 54 0.124 7.792 3.477 424 HD3 PRO 54 3HD PRO 54 0.598 9.195 4.456 425 H GLU 55 H GLU 55 5.274 8.701 1.465 426 HA GLU 55 HA GLU 55 4.646 6.277 -0.042 427 HB2 GLU 55 2HB GLU 55 6.831 8.321 -0.482 428 HB3 GLU 55 3HB GLU 55 6.430 6.992 -1.561 429 HG2 GLU 55 2HG GLU 55 5.152 8.457 -2.633 430 HG3 GLU 55 3HG GLU 55 4.029 8.280 -1.286 431 H THR 56 H THR 56 5.299 5.695 2.537 432 HA THR 56 HA THR 56 7.892 4.361 2.205 433 HB THR 56 HB THR 56 8.630 4.883 4.408 434 HG1 THR 56 HG1 THR 56 7.330 5.669 5.943 435 HG21 THR 56 3HG2 THR 56 7.490 7.454 3.317 436 HG22 THR 56 1HG2 THR 56 8.915 6.654 2.655 437 HG23 THR 56 2HG2 THR 56 8.932 7.257 4.313 438 H LEU 57 H LEU 57 7.834 2.260 2.702 439 HA LEU 57 HA LEU 57 5.482 0.896 3.251 440 HB2 LEU 57 2HB LEU 57 7.765 0.054 2.381 441 HB3 LEU 57 3HB LEU 57 8.153 -0.172 4.085 442 HG LEU 57 HG LEU 57 5.630 -1.394 3.157 443 HD11 LEU 57 1HD1 LEU 57 6.632 -3.220 2.037 444 HD12 LEU 57 2HD1 LEU 57 8.258 -2.665 2.434 445 HD13 LEU 57 3HD1 LEU 57 7.274 -1.761 1.283 446 HD21 LEU 57 3HD2 LEU 57 6.848 -3.297 4.500 447 HD22 LEU 57 1HD2 LEU 57 6.085 -1.943 5.333 448 HD23 LEU 57 2HD2 LEU 57 7.831 -1.954 5.083 449 H ASP 58 H ASP 58 7.720 2.427 5.410 450 HA ASP 58 HA ASP 58 7.008 1.070 7.788 451 HB2 ASP 58 2HB ASP 58 8.770 3.160 7.046 452 HB3 ASP 58 3HB ASP 58 7.748 3.786 8.337 453 H GLN 59 H GLN 59 6.036 4.291 6.600 454 HA GLN 59 HA GLN 59 4.135 4.806 8.580 455 HB2 GLN 59 2HB GLN 59 4.666 5.851 5.843 456 HB3 GLN 59 3HB GLN 59 3.111 6.230 6.573 457 HG2 GLN 59 2HG GLN 59 4.050 7.879 7.699 458 HG3 GLN 59 3HG GLN 59 5.092 6.720 8.523 459 HE21 GLN 59 1HE2 GLN 59 7.158 7.170 8.376 460 HE22 GLN 59 2HE2 GLN 59 7.943 7.967 7.060 461 H LEU 60 H LEU 60 3.783 3.266 5.410 462 HA LEU 60 HA LEU 60 0.978 2.961 5.515 463 HB2 LEU 60 2HB LEU 60 2.184 2.804 3.430 464 HB3 LEU 60 3HB LEU 60 3.078 1.403 4.017 465 HG LEU 60 HG LEU 60 0.519 0.513 4.221 466 HD11 LEU 60 1HD1 LEU 60 -0.218 1.187 1.737 467 HD12 LEU 60 2HD1 LEU 60 0.576 2.685 2.222 468 HD13 LEU 60 3HD1 LEU 60 -0.765 2.049 3.175 469 HD21 LEU 60 3HD2 LEU 60 2.143 -0.855 3.254 470 HD22 LEU 60 1HD2 LEU 60 2.544 0.335 2.016 471 HD23 LEU 60 2HD2 LEU 60 1.015 -0.541 1.935 472 H ARG 61 H ARG 61 3.629 0.730 6.310 473 HA ARG 61 HA ARG 61 2.146 -1.505 6.982 474 HB2 ARG 61 2HB ARG 61 4.569 -1.563 6.838 475 HB3 ARG 61 3HB ARG 61 4.706 -0.491 8.226 476 HG2 ARG 61 2HG ARG 61 3.167 -2.924 8.743 477 HG3 ARG 61 3HG ARG 61 4.856 -3.205 8.316 478 HD2 ARG 61 2HD ARG 61 5.220 -1.231 10.054 479 HD3 ARG 61 3HD ARG 61 3.688 -1.840 10.679 480 HE ARG 61 HE ARG 61 5.279 -4.055 10.367 481 HH11 ARG 61 1HH1 ARG 61 5.468 -1.060 12.131 482 HH12 ARG 61 2HH1 ARG 61 6.416 -1.727 13.419 483 HH21 ARG 61 1HH2 ARG 61 6.527 -4.945 12.056 484 HH22 ARG 61 2HH2 ARG 61 7.019 -3.936 13.375 485 H LEU 62 H LEU 62 2.927 1.323 8.950 486 HA LEU 62 HA LEU 62 1.830 0.326 11.366 487 HB2 LEU 62 2HB LEU 62 3.127 2.687 10.469 488 HB3 LEU 62 3HB LEU 62 1.635 3.162 11.278 489 HG LEU 62 HG LEU 62 3.443 3.217 12.858 490 HD11 LEU 62 1HD1 LEU 62 2.292 2.259 14.536 491 HD12 LEU 62 2HD1 LEU 62 2.213 0.691 13.732 492 HD13 LEU 62 3HD1 LEU 62 1.087 1.971 13.280 493 HD21 LEU 62 3HD2 LEU 62 4.491 1.121 11.403 494 HD22 LEU 62 1HD2 LEU 62 4.030 0.372 12.931 495 HD23 LEU 62 2HD2 LEU 62 5.125 1.755 12.922 496 H VAL 63 H VAL 63 0.535 2.419 8.811 497 HA VAL 63 HA VAL 63 -1.910 3.071 9.929 498 HB VAL 63 HB VAL 63 -1.341 2.484 7.020 499 HG11 VAL 63 1HG1 VAL 63 -3.268 4.415 7.083 500 HG12 VAL 63 2HG1 VAL 63 -3.565 2.694 6.827 501 HG13 VAL 63 3HG1 VAL 63 -3.735 3.389 8.439 502 HG21 VAL 63 3HG2 VAL 63 -0.240 4.416 6.918 503 HG22 VAL 63 1HG2 VAL 63 -1.551 5.267 7.735 504 HG23 VAL 63 2HG2 VAL 63 -0.291 4.472 8.680 505 H ILE 64 H ILE 64 -0.953 0.134 8.225 506 HA ILE 64 HA ILE 64 -3.542 -1.010 8.085 507 HB ILE 64 HB ILE 64 -0.859 -2.396 8.069 508 HG12 ILE 64 2HG1 ILE 64 -2.603 -1.562 5.743 509 HG13 ILE 64 3HG1 ILE 64 -1.192 -0.664 6.293 510 HG21 ILE 64 1HG2 ILE 64 -3.540 -3.413 8.076 511 HG22 ILE 64 2HG2 ILE 64 -2.746 -3.814 6.554 512 HG23 ILE 64 3HG2 ILE 64 -2.012 -4.293 8.084 513 HD11 ILE 64 3HD1 ILE 64 0.037 -2.929 5.937 514 HD12 ILE 64 1HD1 ILE 64 -1.343 -3.291 4.900 515 HD13 ILE 64 2HD1 ILE 64 -0.328 -1.889 4.560 516 H CYS 65 H CYS 65 -0.787 -1.776 10.221 517 HA CYS 65 HA CYS 65 -2.113 -3.571 11.879 518 HB2 CYS 65 2HB CYS 65 0.428 -2.672 11.732 519 HB3 CYS 65 3HB CYS 65 -0.110 -1.806 13.166 520 HG CYS 65 HG CYS 65 -1.083 -4.370 14.263 521 H ASP 66 H ASP 66 -1.982 -0.061 11.977 522 HA ASP 66 HA ASP 66 -3.223 0.214 14.524 523 HB2 ASP 66 2HB ASP 66 -1.861 1.925 12.992 524 HB3 ASP 66 3HB ASP 66 -3.490 2.373 12.493 525 H LEU 67 H LEU 67 -4.491 0.958 11.271 526 HA LEU 67 HA LEU 67 -7.137 1.329 11.976 527 HB2 LEU 67 2HB LEU 67 -6.491 1.936 9.803 528 HB3 LEU 67 3HB LEU 67 -5.852 0.331 9.455 529 HG LEU 67 HG LEU 67 -8.738 0.415 10.000 530 HD11 LEU 67 1HD1 LEU 67 -8.236 2.559 8.727 531 HD12 LEU 67 2HD1 LEU 67 -9.417 1.461 8.014 532 HD13 LEU 67 3HD1 LEU 67 -7.773 1.519 7.380 533 HD21 LEU 67 3HD2 LEU 67 -7.855 -1.632 9.274 534 HD22 LEU 67 1HD2 LEU 67 -6.895 -0.868 8.007 535 HD23 LEU 67 2HD2 LEU 67 -8.650 -0.957 7.851 536 H GLN 68 H GLN 68 -5.436 -1.673 11.230 537 HA GLN 68 HA GLN 68 -7.749 -3.328 11.302 538 HB2 GLN 68 2HB GLN 68 -5.747 -4.048 10.130 539 HB3 GLN 68 3HB GLN 68 -4.820 -4.002 11.625 540 HG2 GLN 68 2HG GLN 68 -6.158 -5.811 12.535 541 HG3 GLN 68 3HG GLN 68 -7.139 -5.839 11.070 542 HE21 GLN 68 1HE2 GLN 68 -6.058 -8.143 11.750 543 HE22 GLN 68 2HE2 GLN 68 -4.713 -8.546 10.743 544 H GLU 69 H GLU 69 -5.362 -2.332 13.691 545 HA GLU 69 HA GLU 69 -6.073 -4.106 15.743 546 HB2 GLU 69 2HB GLU 69 -4.613 -1.538 15.556 547 HB3 GLU 69 3HB GLU 69 -5.256 -1.945 17.141 548 HG2 GLU 69 2HG GLU 69 -3.996 -3.941 17.244 549 HG3 GLU 69 3HG GLU 69 -3.559 -3.835 15.540 550 H ARG 70 H ARG 70 -7.146 -0.763 15.142 551 HA ARG 70 HA ARG 70 -9.012 -0.730 17.281 552 HB2 ARG 70 2HB ARG 70 -8.626 0.999 14.846 553 HB3 ARG 70 3HB ARG 70 -9.946 1.273 15.976 554 HG2 ARG 70 2HG ARG 70 -7.178 1.073 17.045 555 HG3 ARG 70 3HG ARG 70 -7.664 2.547 16.204 556 HD2 ARG 70 2HD ARG 70 -9.701 2.545 17.741 557 HD3 ARG 70 3HD ARG 70 -8.838 1.336 18.690 558 HE ARG 70 HE ARG 70 -7.430 2.980 19.458 559 HH11 ARG 70 1HH1 ARG 70 -9.292 4.196 16.780 560 HH12 ARG 70 2HH1 ARG 70 -8.787 5.837 17.005 561 HH21 ARG 70 1HH2 ARG 70 -6.758 5.138 19.765 562 HH22 ARG 70 2HH2 ARG 70 -7.345 6.372 18.703 563 H ARG 71 H ARG 71 -9.386 -1.159 13.770 564 HA ARG 71 HA ARG 71 -12.154 -1.424 13.694 565 HB2 ARG 71 2HB ARG 71 -9.958 -2.521 11.957 566 HB3 ARG 71 3HB ARG 71 -11.646 -2.887 11.626 567 HG2 ARG 71 2HG ARG 71 -10.518 -0.103 11.821 568 HG3 ARG 71 3HG ARG 71 -10.748 -0.990 10.313 569 HD2 ARG 71 2HD ARG 71 -12.929 -0.526 10.267 570 HD3 ARG 71 3HD ARG 71 -13.137 -0.992 11.955 571 HE ARG 71 HE ARG 71 -11.872 1.545 11.720 572 HH11 ARG 71 1HH1 ARG 71 -14.957 -0.055 11.527 573 HH12 ARG 71 2HH1 ARG 71 -15.864 1.358 11.954 574 HH21 ARG 71 1HH2 ARG 71 -13.054 3.413 12.283 575 HH22 ARG 71 2HH2 ARG 71 -14.780 3.331 12.383 576 H GLU 72 H GLU 72 -9.665 -3.924 14.113 577 HA GLU 72 HA GLU 72 -11.362 -6.141 14.190 578 HB2 GLU 72 2HB GLU 72 -9.000 -6.471 13.978 579 HB3 GLU 72 3HB GLU 72 -8.689 -5.644 15.498 580 HG2 GLU 72 2HG GLU 72 -9.601 -7.428 16.759 581 HG3 GLU 72 3HG GLU 72 -10.258 -8.199 15.316 582 H LYS 73 H LYS 73 -10.102 -4.165 16.867 583 HA LYS 73 HA LYS 73 -11.258 -5.503 18.991 584 HB2 LYS 73 2HB LYS 73 -9.927 -3.049 18.592 585 HB3 LYS 73 3HB LYS 73 -11.424 -2.662 19.431 586 HG2 LYS 73 2HG LYS 73 -10.587 -4.786 20.873 587 HG3 LYS 73 3HG LYS 73 -9.040 -4.096 20.374 588 HD2 LYS 73 2HD LYS 73 -9.405 -2.915 22.302 589 HD3 LYS 73 3HD LYS 73 -10.185 -1.846 21.134 590 HE2 LYS 73 2HE LYS 73 -11.784 -3.997 22.446 591 HE3 LYS 73 3HE LYS 73 -11.408 -2.531 23.350 592 HZ1 LYS 73 3HZ LYS 73 -12.368 -1.263 21.457 593 HZ2 LYS 73 1HZ LYS 73 -13.490 -2.221 22.284 594 HZ3 LYS 73 2HZ LYS 73 -12.888 -2.727 20.787 595 H PHE 74 H PHE 74 -12.682 -3.087 16.848 596 HA PHE 74 HA PHE 74 -15.154 -2.954 18.296 597 HB2 PHE 74 2HB PHE 74 -13.912 -1.491 16.211 598 HB3 PHE 74 3HB PHE 74 -15.447 -2.079 15.581 599 HD1 PHE 74 HD2 PHE 74 -17.550 -1.589 16.910 600 HD2 PHE 74 HD1 PHE 74 -13.829 0.342 17.647 601 HE1 PHE 74 HE2 PHE 74 -18.727 0.221 18.088 602 HE2 PHE 74 HE1 PHE 74 -15.001 2.156 18.827 603 HZ PHE 74 HZ PHE 74 -17.453 2.098 19.048 604 H GLY 75 H GLY 75 -13.853 -4.915 15.750 605 HA2 GLY 75 2HA GLY 75 -15.448 -7.048 15.858 606 HA3 GLY 75 3HA GLY 75 -16.466 -5.929 14.963 607 H SER 76 H SER 76 -16.251 -7.766 13.383 608 HA SER 76 HA SER 76 -13.979 -7.207 11.608 609 HB2 SER 76 2HB SER 76 -14.636 -9.910 11.199 610 HB3 SER 76 3HB SER 76 -13.165 -9.270 11.932 611 HG SER 76 HG SER 76 -13.937 -10.479 13.525 612 H SER 77 H SER 77 -14.517 -6.906 9.530 613 HA SER 77 HA SER 77 -17.065 -7.922 8.527 614 HB2 SER 77 2HB SER 77 -18.015 -5.891 8.041 615 HB3 SER 77 3HB SER 77 -17.094 -5.423 9.471 616 HG SER 77 HG SER 77 -16.740 -3.981 7.741 617 H LYS 78 H LYS 78 -17.150 -8.175 6.291 618 HA LYS 78 HA LYS 78 -14.826 -8.871 4.975 619 HB2 LYS 78 2HB LYS 78 -17.598 -8.225 4.084 620 HB3 LYS 78 3HB LYS 78 -16.348 -8.374 2.857 621 HG2 LYS 78 2HG LYS 78 -16.424 -10.547 4.833 622 HG3 LYS 78 3HG LYS 78 -17.835 -10.428 3.780 623 HD2 LYS 78 2HD LYS 78 -15.294 -10.130 2.368 624 HD3 LYS 78 3HD LYS 78 -15.481 -11.695 3.161 625 HE2 LYS 78 2HE LYS 78 -17.908 -11.469 2.044 626 HE3 LYS 78 3HE LYS 78 -16.971 -10.517 0.893 627 HZ1 LYS 78 3HZ LYS 78 -16.735 -12.586 0.007 628 HZ2 LYS 78 1HZ LYS 78 -16.817 -13.377 1.501 629 HZ3 LYS 78 2HZ LYS 78 -15.395 -12.588 1.039 630 H GLU 79 H GLU 79 -16.469 -5.762 5.071 631 HA GLU 79 HA GLU 79 -15.039 -4.481 3.024 632 HB2 GLU 79 2HB GLU 79 -16.632 -3.585 5.376 633 HB3 GLU 79 3HB GLU 79 -15.592 -2.402 4.595 634 HG2 GLU 79 2HG GLU 79 -16.705 -2.868 2.453 635 HG3 GLU 79 3HG GLU 79 -17.779 -3.997 3.279 636 H ILE 80 H ILE 80 -14.479 -4.495 6.541 637 HA ILE 80 HA ILE 80 -12.100 -2.975 6.443 638 HB ILE 80 HB ILE 80 -12.935 -4.964 8.557 639 HG12 ILE 80 2HG1 ILE 80 -13.410 -1.979 8.473 640 HG13 ILE 80 3HG1 ILE 80 -14.626 -3.181 8.056 641 HG21 ILE 80 1HG2 ILE 80 -11.087 -4.418 9.657 642 HG22 ILE 80 2HG2 ILE 80 -10.556 -3.510 8.242 643 HG23 ILE 80 3HG2 ILE 80 -11.465 -2.701 9.518 644 HD11 ILE 80 3HD1 ILE 80 -13.333 -3.495 10.684 645 HD12 ILE 80 1HD1 ILE 80 -14.389 -2.097 10.486 646 HD13 ILE 80 2HD1 ILE 80 -15.015 -3.723 10.206 647 H ASP 81 H ASP 81 -12.668 -6.477 6.636 648 HA ASP 81 HA ASP 81 -9.996 -7.287 6.758 649 HB2 ASP 81 2HB ASP 81 -12.388 -8.699 5.560 650 HB3 ASP 81 3HB ASP 81 -10.831 -9.463 5.868 651 H MET 82 H MET 82 -12.120 -6.914 3.926 652 HA MET 82 HA MET 82 -10.241 -7.655 1.988 653 HB2 MET 82 2HB MET 82 -12.726 -5.976 1.929 654 HB3 MET 82 3HB MET 82 -11.719 -6.113 0.494 655 HG2 MET 82 2HG MET 82 -11.934 -8.666 0.909 656 HG3 MET 82 3HG MET 82 -13.326 -8.205 1.884 657 HE1 MET 82 3HE MET 82 -15.955 -7.047 -0.503 658 HE2 MET 82 1HE MET 82 -15.729 -8.327 0.689 659 HE3 MET 82 2HE MET 82 -15.194 -6.685 1.047 660 H ALA 83 H ALA 83 -10.822 -4.601 3.608 661 HA ALA 83 HA ALA 83 -9.344 -2.920 1.916 662 HB1 ALA 83 1HB ALA 83 -10.911 -2.378 3.928 663 HB2 ALA 83 2HB ALA 83 -9.416 -2.451 4.863 664 HB3 ALA 83 3HB ALA 83 -9.571 -1.299 3.537 665 H ILE 84 H ILE 84 -8.353 -4.553 4.927 666 HA ILE 84 HA ILE 84 -5.679 -3.724 4.887 667 HB ILE 84 HB ILE 84 -6.815 -6.273 6.045 668 HG12 ILE 84 2HG1 ILE 84 -6.203 -3.717 7.520 669 HG13 ILE 84 3HG1 ILE 84 -7.779 -4.010 6.792 670 HG21 ILE 84 1HG2 ILE 84 -4.126 -5.249 5.888 671 HG22 ILE 84 2HG2 ILE 84 -4.647 -5.396 7.566 672 HG23 ILE 84 3HG2 ILE 84 -4.703 -6.799 6.499 673 HD11 ILE 84 3HD1 ILE 84 -7.739 -4.553 9.173 674 HD12 ILE 84 1HD1 ILE 84 -8.080 -5.970 8.180 675 HD13 ILE 84 2HD1 ILE 84 -6.474 -5.746 8.874 676 H VAL 85 H VAL 85 -7.285 -6.464 3.371 677 HA VAL 85 HA VAL 85 -5.021 -7.915 2.588 678 HB VAL 85 HB VAL 85 -7.682 -7.700 1.173 679 HG11 VAL 85 1HG1 VAL 85 -6.546 -8.797 -0.435 680 HG12 VAL 85 2HG1 VAL 85 -5.256 -9.289 0.664 681 HG13 VAL 85 3HG1 VAL 85 -6.776 -10.184 0.630 682 HG21 VAL 85 3HG2 VAL 85 -7.169 -10.126 2.673 683 HG22 VAL 85 1HG2 VAL 85 -7.126 -8.693 3.700 684 HG23 VAL 85 2HG2 VAL 85 -8.556 -9.038 2.728 685 H THR 86 H THR 86 -6.899 -5.489 0.779 686 HA THR 86 HA THR 86 -5.368 -5.494 -1.551 687 HB THR 86 HB THR 86 -6.296 -3.283 -2.021 688 HG1 THR 86 HG1 THR 86 -6.450 -2.078 -0.269 689 HG21 THR 86 3HG2 THR 86 -8.068 -4.514 -2.606 690 HG22 THR 86 1HG2 THR 86 -8.774 -4.074 -1.052 691 HG23 THR 86 2HG2 THR 86 -7.874 -5.581 -1.216 692 H LEU 87 H LEU 87 -5.037 -3.518 1.379 693 HA LEU 87 HA LEU 87 -2.928 -1.901 0.505 694 HB2 LEU 87 2HB LEU 87 -4.151 -2.622 3.069 695 HB3 LEU 87 3HB LEU 87 -2.457 -2.151 3.179 696 HG LEU 87 HG LEU 87 -4.685 -0.476 2.024 697 HD11 LEU 87 1HD1 LEU 87 -3.114 0.229 4.455 698 HD12 LEU 87 2HD1 LEU 87 -4.450 -0.913 4.593 699 HD13 LEU 87 3HD1 LEU 87 -4.742 0.715 3.982 700 HD21 LEU 87 3HD2 LEU 87 -2.793 0.191 0.856 701 HD22 LEU 87 1HD2 LEU 87 -1.723 -0.090 2.229 702 HD23 LEU 87 2HD2 LEU 87 -2.817 1.294 2.233 703 H LYS 88 H LYS 88 -2.966 -5.141 1.837 704 HA LYS 88 HA LYS 88 -0.170 -5.330 2.318 705 HB2 LYS 88 2HB LYS 88 -2.441 -6.942 2.746 706 HB3 LYS 88 3HB LYS 88 -1.360 -7.888 1.731 707 HG2 LYS 88 2HG LYS 88 -0.187 -8.424 3.525 708 HG3 LYS 88 3HG LYS 88 0.230 -6.723 3.744 709 HD2 LYS 88 2HD LYS 88 -1.574 -6.360 5.209 710 HD3 LYS 88 3HD LYS 88 -2.368 -7.864 4.736 711 HE2 LYS 88 2HE LYS 88 -0.583 -9.147 5.791 712 HE3 LYS 88 3HE LYS 88 0.245 -7.655 6.231 713 HZ1 LYS 88 3HZ LYS 88 -1.891 -8.985 7.560 714 HZ2 LYS 88 1HZ LYS 88 -2.298 -7.378 7.220 715 HZ3 LYS 88 2HZ LYS 88 -0.903 -7.727 8.112 716 H VAL 89 H VAL 89 -2.165 -6.887 -0.201 717 HA VAL 89 HA VAL 89 -0.058 -7.805 -1.773 718 HB VAL 89 HB VAL 89 -2.754 -6.928 -2.813 719 HG11 VAL 89 1HG1 VAL 89 -0.504 -7.958 -4.116 720 HG12 VAL 89 2HG1 VAL 89 -1.638 -9.304 -3.988 721 HG13 VAL 89 3HG1 VAL 89 -2.137 -7.799 -4.761 722 HG21 VAL 89 3HG2 VAL 89 -3.595 -8.432 -1.384 723 HG22 VAL 89 1HG2 VAL 89 -2.885 -9.643 -2.452 724 HG23 VAL 89 2HG2 VAL 89 -2.007 -9.108 -1.020 725 H PHE 90 H PHE 90 -1.779 -4.717 -1.850 726 HA PHE 90 HA PHE 90 -0.491 -3.719 -4.171 727 HB2 PHE 90 2HB PHE 90 -2.567 -2.726 -3.504 728 HB3 PHE 90 3HB PHE 90 -1.936 -2.339 -1.907 729 HD1 PHE 90 HD2 PHE 90 -0.548 -1.793 -5.322 730 HD2 PHE 90 HD1 PHE 90 -1.906 -0.051 -1.684 731 HE1 PHE 90 HE2 PHE 90 0.132 0.427 -6.136 732 HE2 PHE 90 HE1 PHE 90 -1.229 2.173 -2.492 733 HZ PHE 90 HZ PHE 90 -0.207 2.413 -4.720 734 H ALA 91 H ALA 91 0.322 -3.747 -0.779 735 HA ALA 91 HA ALA 91 2.316 -1.744 -0.825 736 HB1 ALA 91 1HB ALA 91 1.860 -4.081 1.016 737 HB2 ALA 91 2HB ALA 91 3.122 -2.875 1.271 738 HB3 ALA 91 3HB ALA 91 1.426 -2.392 1.279 739 H VAL 92 H VAL 92 2.516 -5.286 -1.096 740 HA VAL 92 HA VAL 92 5.353 -5.225 -1.585 741 HB VAL 92 HB VAL 92 3.465 -7.543 -2.004 742 HG11 VAL 92 1HG1 VAL 92 6.127 -8.164 -1.080 743 HG12 VAL 92 2HG1 VAL 92 5.267 -8.748 -2.506 744 HG13 VAL 92 3HG1 VAL 92 6.175 -7.237 -2.580 745 HG21 VAL 92 3HG2 VAL 92 4.683 -8.041 0.369 746 HG22 VAL 92 1HG2 VAL 92 4.475 -6.292 0.455 747 HG23 VAL 92 2HG2 VAL 92 3.075 -7.335 0.203 748 H ALA 93 H ALA 93 2.556 -6.277 -3.539 749 HA ALA 93 HA ALA 93 3.935 -6.593 -5.945 750 HB1 ALA 93 1HB ALA 93 1.566 -7.333 -5.339 751 HB2 ALA 93 2HB ALA 93 1.070 -5.708 -5.814 752 HB3 ALA 93 3HB ALA 93 1.847 -6.772 -6.987 753 H GLY 94 H GLY 94 2.881 -3.732 -4.321 754 HA2 GLY 94 2HA GLY 94 3.165 -2.093 -6.726 755 HA3 GLY 94 3HA GLY 94 2.592 -1.545 -5.158 756 H LEU 95 H LEU 95 4.287 -1.581 -3.390 757 HA LEU 95 HA LEU 95 6.414 0.088 -4.103 758 HB2 LEU 95 2HB LEU 95 6.365 -1.656 -1.656 759 HB3 LEU 95 3HB LEU 95 7.147 -0.089 -1.858 760 HG LEU 95 HG LEU 95 4.175 -0.592 -1.714 761 HD11 LEU 95 1HD1 LEU 95 6.239 0.108 0.266 762 HD12 LEU 95 2HD1 LEU 95 4.683 -0.694 0.477 763 HD13 LEU 95 3HD1 LEU 95 4.756 1.061 0.327 764 HD21 LEU 95 3HD2 LEU 95 3.918 1.381 -2.695 765 HD22 LEU 95 1HD2 LEU 95 5.666 1.591 -2.809 766 HD23 LEU 95 2HD2 LEU 95 4.807 2.127 -1.366 767 H LEU 96 H LEU 96 6.427 -3.373 -3.275 768 HA LEU 96 HA LEU 96 9.219 -3.630 -3.966 769 HB2 LEU 96 2HB LEU 96 7.252 -5.167 -2.551 770 HB3 LEU 96 3HB LEU 96 8.045 -6.176 -3.759 771 HG LEU 96 HG LEU 96 9.743 -4.543 -1.936 772 HD11 LEU 96 1HD1 LEU 96 9.709 -6.545 -0.370 773 HD12 LEU 96 2HD1 LEU 96 8.195 -6.995 -1.154 774 HD13 LEU 96 3HD1 LEU 96 8.324 -5.455 -0.304 775 HD21 LEU 96 3HD2 LEU 96 11.371 -6.036 -2.486 776 HD22 LEU 96 1HD2 LEU 96 10.374 -6.167 -3.935 777 HD23 LEU 96 2HD2 LEU 96 10.240 -7.379 -2.660 778 H ASN 97 H ASN 97 6.544 -3.298 -5.788 779 HA ASN 97 HA ASN 97 5.929 -3.846 -7.912 780 HB2 ASN 97 2HB ASN 97 8.428 -2.916 -8.040 781 HB3 ASN 97 3HB ASN 97 8.733 -4.547 -8.628 782 HD21 ASN 97 1HD2 ASN 97 8.110 -5.104 -10.645 783 HD22 ASN 97 2HD2 ASN 97 7.364 -4.018 -11.762 784 H MET 98 H MET 98 6.002 -6.001 -5.937 785 HA MET 98 HA MET 98 6.985 -8.373 -7.161 786 HB2 MET 98 2HB MET 98 5.553 -7.651 -4.733 787 HB3 MET 98 3HB MET 98 4.965 -9.158 -5.422 788 HG2 MET 98 2HG MET 98 7.852 -9.055 -5.403 789 HG3 MET 98 3HG MET 98 7.178 -8.816 -3.792 790 HE1 MET 98 3HE MET 98 8.778 -11.449 -5.700 791 HE2 MET 98 1HE MET 98 8.987 -11.091 -3.985 792 HE3 MET 98 2HE MET 98 8.380 -12.669 -4.489 793 H THR 99 H THR 99 5.517 -10.233 -7.706 794 HA THR 99 HA THR 99 3.203 -9.261 -9.254 795 HB THR 99 HB THR 99 4.734 -11.757 -9.945 796 HG1 THR 99 HG1 THR 99 5.941 -9.563 -9.930 797 HG21 THR 99 3HG2 THR 99 2.416 -11.191 -10.876 798 HG22 THR 99 1HG2 THR 99 3.679 -11.590 -12.039 799 HG23 THR 99 2HG2 THR 99 3.225 -9.907 -11.772 800 H VAL 100 H VAL 100 2.715 -9.878 -6.668 801 HA VAL 100 HA VAL 100 1.919 -12.645 -6.406 802 HB VAL 100 HB VAL 100 0.974 -11.911 -4.217 803 HG11 VAL 100 1HG1 VAL 100 3.831 -11.462 -4.964 804 HG12 VAL 100 2HG1 VAL 100 3.294 -11.137 -3.315 805 HG13 VAL 100 3HG1 VAL 100 3.111 -12.752 -4.001 806 HG21 VAL 100 3HG2 VAL 100 0.556 -9.765 -3.823 807 HG22 VAL 100 1HG2 VAL 100 2.269 -9.388 -4.005 808 HG23 VAL 100 2HG2 VAL 100 1.203 -9.348 -5.410 809 H SER 101 H SER 101 0.046 -13.449 -7.066 810 HA SER 101 HA SER 101 -2.153 -11.591 -7.662 811 HB2 SER 101 2HB SER 101 -1.341 -14.245 -8.807 812 HB3 SER 101 3HB SER 101 -3.011 -13.697 -8.951 813 HG SER 101 HG SER 101 -0.789 -12.127 -9.742 814 H THR 102 H THR 102 -1.315 -13.045 -5.071 815 HA THR 102 HA THR 102 -4.036 -13.794 -4.330 816 HB THR 102 HB THR 102 -3.461 -15.879 -3.341 817 HG1 THR 102 HG1 THR 102 -1.396 -16.542 -3.035 818 HG21 THR 102 3HG2 THR 102 -1.991 -15.874 -5.972 819 HG22 THR 102 1HG2 THR 102 -3.749 -15.808 -5.850 820 HG23 THR 102 2HG2 THR 102 -2.873 -17.206 -5.225 821 H ALA 103 H ALA 103 -4.573 -12.990 -2.400 822 HA ALA 103 HA ALA 103 -2.994 -11.239 -0.967 823 HB1 ALA 103 1HB ALA 103 -5.297 -12.889 0.067 824 HB2 ALA 103 2HB ALA 103 -4.639 -11.444 0.836 825 HB3 ALA 103 3HB ALA 103 -5.416 -11.327 -0.743 826 H ALA 104 H ALA 104 -3.186 -14.714 -0.744 827 HA ALA 104 HA ALA 104 -1.941 -15.011 1.784 828 HB1 ALA 104 1HB ALA 104 -1.351 -17.257 0.155 829 HB2 ALA 104 2HB ALA 104 -2.559 -17.111 1.433 830 HB3 ALA 104 3HB ALA 104 -2.985 -16.715 -0.232 831 H ALA 105 H ALA 105 -0.688 -15.005 -1.534 832 HA ALA 105 HA ALA 105 1.991 -15.591 -0.868 833 HB1 ALA 105 1HB ALA 105 2.536 -14.944 -3.104 834 HB2 ALA 105 2HB ALA 105 0.986 -15.785 -3.143 835 HB3 ALA 105 3HB ALA 105 1.037 -14.026 -3.259 836 H ALA 106 H ALA 106 0.205 -12.565 -1.140 837 HA ALA 106 HA ALA 106 2.389 -10.802 -0.998 838 HB1 ALA 106 1HB ALA 106 -0.424 -10.342 -0.013 839 HB2 ALA 106 2HB ALA 106 0.770 -9.102 -0.396 840 HB3 ALA 106 3HB ALA 106 0.123 -10.127 -1.676 841 H GLU 107 H GLU 107 0.195 -11.919 1.585 842 HA GLU 107 HA GLU 107 1.563 -10.648 3.689 843 HB2 GLU 107 2HB GLU 107 -0.694 -11.381 4.028 844 HB3 GLU 107 3HB GLU 107 -0.269 -13.046 3.655 845 HG2 GLU 107 2HG GLU 107 0.397 -13.466 5.738 846 HG3 GLU 107 3HG GLU 107 1.263 -11.936 5.870 847 H ASN 108 H ASN 108 1.828 -13.905 2.332 848 HA ASN 108 HA ASN 108 3.558 -15.035 4.184 849 HB2 ASN 108 2HB ASN 108 2.533 -16.381 2.456 850 HB3 ASN 108 3HB ASN 108 3.379 -15.483 1.198 851 HD21 ASN 108 1HD2 ASN 108 4.301 -17.375 0.398 852 HD22 ASN 108 2HD2 ASN 108 5.600 -18.172 1.212 853 H MET 109 H MET 109 4.284 -13.030 1.361 854 HA MET 109 HA MET 109 7.128 -13.195 1.762 855 HB2 MET 109 2HB MET 109 5.524 -12.549 -0.375 856 HB3 MET 109 3HB MET 109 6.143 -10.978 0.117 857 HG2 MET 109 2HG MET 109 7.880 -13.369 -0.432 858 HG3 MET 109 3HG MET 109 7.488 -12.136 -1.627 859 HE1 MET 109 3HE MET 109 7.630 -9.720 -1.098 860 HE2 MET 109 1HE MET 109 7.901 -9.275 0.588 861 HE3 MET 109 2HE MET 109 9.177 -9.029 -0.605 862 H TYR 110 H TYR 110 4.572 -10.866 2.450 863 HA TYR 110 HA TYR 110 6.133 -8.691 3.215 864 HB2 TYR 110 2HB TYR 110 3.542 -8.945 2.955 865 HB3 TYR 110 3HB TYR 110 3.592 -9.343 4.669 866 HD1 TYR 110 HD2 TYR 110 5.240 -6.782 2.489 867 HD2 TYR 110 HD1 TYR 110 2.989 -7.577 6.011 868 HE1 TYR 110 HE2 TYR 110 5.266 -4.385 3.040 869 HE2 TYR 110 HE1 TYR 110 3.008 -5.182 6.571 870 HH TYR 110 HH TYR 110 3.433 -2.857 4.687 871 H SER 111 H SER 111 5.163 -11.554 5.015 872 HA SER 111 HA SER 111 6.359 -10.574 7.470 873 HB2 SER 111 2HB SER 111 4.258 -11.992 7.394 874 HB3 SER 111 3HB SER 111 5.287 -13.349 6.935 875 HG SER 111 HG SER 111 4.795 -13.014 9.267 876 H GLN 112 H GLN 112 7.010 -13.012 4.998 877 HA GLN 112 HA GLN 112 9.180 -14.287 6.181 878 HB2 GLN 112 2HB GLN 112 8.069 -15.083 4.134 879 HB3 GLN 112 3HB GLN 112 8.740 -13.723 3.244 880 HG2 GLN 112 2HG GLN 112 11.024 -14.613 3.939 881 HG3 GLN 112 3HG GLN 112 10.173 -16.085 4.404 882 HE21 GLN 112 1HE2 GLN 112 11.871 -14.677 2.000 883 HE22 GLN 112 2HE2 GLN 112 11.266 -15.563 0.646 884 H MET 113 H MET 113 8.968 -11.188 4.604 885 HA MET 113 HA MET 113 11.829 -10.859 4.393 886 HB2 MET 113 2HB MET 113 9.834 -9.788 2.983 887 HB3 MET 113 3HB MET 113 9.985 -8.530 4.203 888 HG2 MET 113 2HG MET 113 12.548 -9.339 3.102 889 HG3 MET 113 3HG MET 113 11.436 -8.729 1.879 890 HE1 MET 113 3HE MET 113 13.929 -5.751 2.778 891 HE2 MET 113 1HE MET 113 14.345 -7.450 3.004 892 HE3 MET 113 2HE MET 113 13.483 -6.939 1.553 893 H GLY 114 H GLY 114 9.323 -10.132 6.683 894 HA2 GLY 114 2HA GLY 114 9.968 -9.801 8.995 895 HA3 GLY 114 3HA GLY 114 11.360 -8.895 8.422 896 H LEU 115 H LEU 115 8.347 -8.341 6.852 897 HA LEU 115 HA LEU 115 8.265 -5.660 8.019 898 HB2 LEU 115 2HB LEU 115 6.632 -6.693 5.715 899 HB3 LEU 115 3HB LEU 115 6.944 -5.015 6.155 900 HG LEU 115 HG LEU 115 9.138 -6.862 5.253 901 HD11 LEU 115 1HD1 LEU 115 8.874 -5.908 3.013 902 HD12 LEU 115 2HD1 LEU 115 7.410 -5.080 3.542 903 HD13 LEU 115 3HD1 LEU 115 7.459 -6.843 3.498 904 HD21 LEU 115 3HD2 LEU 115 10.105 -4.621 4.570 905 HD22 LEU 115 1HD2 LEU 115 9.992 -4.931 6.303 906 HD23 LEU 115 2HD2 LEU 115 8.810 -3.884 5.516 907 H ASP 116 H ASP 116 6.488 -8.636 7.898 908 HA ASP 116 HA ASP 116 4.136 -7.424 9.132 909 HB2 ASP 116 2HB ASP 116 4.338 -9.419 7.305 910 HB3 ASP 116 3HB ASP 116 4.246 -10.358 8.792 911 H THR 117 H THR 117 3.154 -9.099 10.864 912 HA THR 117 HA THR 117 5.136 -9.140 13.007 913 HB THR 117 HB THR 117 2.480 -10.011 13.787 914 HG1 THR 117 HG1 THR 117 1.294 -8.399 13.020 915 HG21 THR 117 3HG2 THR 117 2.779 -8.470 15.526 916 HG22 THR 117 1HG2 THR 117 3.854 -7.455 14.564 917 HG23 THR 117 2HG2 THR 117 4.415 -9.018 15.160 918 H ARG 118 H ARG 118 5.020 -10.996 14.570 919 HA ARG 118 HA ARG 118 5.765 -13.371 13.383 920 HB2 ARG 118 2HB ARG 118 5.194 -14.399 15.662 921 HB3 ARG 118 3HB ARG 118 6.374 -13.095 15.632 922 HG2 ARG 118 2HG ARG 118 5.131 -11.825 16.961 923 HG3 ARG 118 3HG ARG 118 3.687 -12.088 15.981 924 HD2 ARG 118 2HD ARG 118 3.873 -14.488 17.168 925 HD3 ARG 118 3HD ARG 118 4.620 -13.486 18.411 926 HE ARG 118 HE ARG 118 2.316 -12.172 17.743 927 HH11 ARG 118 1HH1 ARG 118 3.110 -15.364 18.883 928 HH12 ARG 118 2HH1 ARG 118 1.612 -15.578 19.726 929 HH21 ARG 118 1HH2 ARG 118 0.340 -12.441 18.850 930 HH22 ARG 118 2HH2 ARG 118 0.037 -13.914 19.707 931 HA PRO 119 HA PRO 119 2.137 -15.495 12.128 932 HB2 PRO 119 2HB PRO 119 2.780 -18.070 12.697 933 HB3 PRO 119 3HB PRO 119 3.513 -17.169 11.365 934 HG2 PRO 119 2HG PRO 119 4.591 -17.711 14.104 935 HG3 PRO 119 3HG PRO 119 5.424 -17.780 12.540 936 HD2 PRO 119 2HD PRO 119 5.656 -15.671 14.222 937 HD3 PRO 119 3HD PRO 119 5.723 -15.496 12.456 938 H SER 120 H SER 120 0.302 -16.714 12.852 939 HA SER 120 HA SER 120 -0.004 -17.725 15.458 940 HB2 SER 120 2HB SER 120 -1.587 -15.914 16.296 941 HB3 SER 120 3HB SER 120 0.127 -15.503 16.303 942 HG SER 120 HG SER 120 -0.700 -13.797 15.309 943 H MET 121 H MET 121 -0.879 -19.280 13.924 944 HA MET 121 HA MET 121 -2.604 -20.399 12.954 945 HB2 MET 121 2HB MET 121 -3.777 -18.780 15.032 946 HB3 MET 121 3HB MET 121 -4.898 -18.946 13.688 947 HG2 MET 121 2HG MET 121 -4.625 -21.394 13.808 948 HG3 MET 121 3HG MET 121 -3.586 -21.182 15.215 949 HE1 MET 121 3HE MET 121 -5.791 -21.259 18.057 950 HE2 MET 121 1HE MET 121 -4.208 -21.426 17.298 951 HE3 MET 121 2HE MET 121 -4.844 -19.823 17.666 952 H LYS 122 H LYS 122 -2.102 -19.878 10.831 953 HA LYS 122 HA LYS 122 -3.026 -17.442 9.620 954 HB2 LYS 122 2HB LYS 122 -1.309 -19.660 8.896 955 HB3 LYS 122 3HB LYS 122 -2.405 -19.256 7.581 956 HG2 LYS 122 2HG LYS 122 -1.638 -16.820 8.024 957 HG3 LYS 122 3HG LYS 122 -0.278 -17.587 8.848 958 HD2 LYS 122 2HD LYS 122 0.199 -18.874 6.796 959 HD3 LYS 122 3HD LYS 122 -1.117 -18.025 5.982 960 HE2 LYS 122 2HE LYS 122 1.115 -17.074 5.490 961 HE3 LYS 122 3HE LYS 122 0.016 -15.918 6.242 962 HZ1 LYS 122 3HZ LYS 122 1.967 -17.479 7.825 963 HZ2 LYS 122 1HZ LYS 122 1.138 -16.073 8.272 964 HZ3 LYS 122 2HZ LYS 122 2.372 -15.997 7.118 965 H GLU 123 H GLU 123 -3.829 -20.884 9.119 966 HA GLU 123 HA GLU 123 -5.679 -21.898 8.258 967 HB2 GLU 123 2HB GLU 123 -6.964 -19.566 9.684 968 HB3 GLU 123 3HB GLU 123 -7.869 -20.912 9.005 969 HG2 GLU 123 2HG GLU 123 -5.730 -21.195 11.101 970 HG3 GLU 123 3HG GLU 123 -7.456 -21.087 11.443 971 H ALA 124 H ALA 124 -4.551 -20.886 6.209 972 HA ALA 124 HA ALA 124 -6.683 -20.029 4.499 973 HB1 ALA 124 1HB ALA 124 -6.282 -17.847 5.201 974 HB2 ALA 124 2HB ALA 124 -4.537 -18.089 5.280 975 HB3 ALA 124 3HB ALA 124 -5.342 -17.980 3.715 976 H GLY 125 H GLY 125 -6.262 -21.717 3.149 977 HA2 GLY 125 2HA GLY 125 -3.893 -21.473 1.481 978 HA3 GLY 125 3HA GLY 125 -4.019 -22.966 2.399 979 H GLY 126 H GLY 126 -4.417 -24.449 0.852 980 HA2 GLY 126 2HA GLY 126 -6.761 -25.202 -0.093 981 HA3 GLY 126 3HA GLY 126 -6.425 -23.875 -1.195 982 H LYS 127 H LYS 127 -6.584 -26.955 -1.364 983 HA LYS 127 HA LYS 127 -3.949 -27.499 -2.514 984 HB2 LYS 127 2HB LYS 127 -6.249 -29.208 -1.642 985 HB3 LYS 127 3HB LYS 127 -5.084 -29.846 -2.794 986 HG2 LYS 127 2HG LYS 127 -4.270 -28.678 -0.150 987 HG3 LYS 127 3HG LYS 127 -4.679 -30.382 -0.361 988 HD2 LYS 127 2HD LYS 127 -2.941 -30.161 -2.355 989 HD3 LYS 127 3HD LYS 127 -2.330 -28.848 -1.344 990 HE2 LYS 127 2HE LYS 127 -2.734 -31.711 -0.482 991 HE3 LYS 127 3HE LYS 127 -1.188 -30.956 -0.863 992 HZ1 LYS 127 3HZ LYS 127 -1.523 -29.426 0.977 993 HZ2 LYS 127 1HZ LYS 127 -1.575 -31.028 1.519 994 HZ3 LYS 127 2HZ LYS 127 -3.008 -30.148 1.341 995 H GLU 128 H GLU 128 -3.667 -28.180 -4.650 996 HA GLU 128 HA GLU 128 -3.998 -28.088 -6.900 997 HB2 GLU 128 2HB GLU 128 -6.749 -28.926 -5.987 998 HB3 GLU 128 3HB GLU 128 -6.294 -28.828 -7.683 999 HG2 GLU 128 2HG GLU 128 -4.562 -30.492 -7.337 1000 HG3 GLU 128 3HG GLU 128 -4.956 -30.565 -5.621 1001 H GLU 129 H GLU 129 -5.780 -27.178 -8.609 1002 HA GLU 129 HA GLU 129 -6.968 -24.697 -7.717 1003 HB2 GLU 129 2HB GLU 129 -4.398 -24.427 -8.316 1004 HB3 GLU 129 3HB GLU 129 -5.025 -24.389 -9.958 1005 HG2 GLU 129 2HG GLU 129 -6.492 -22.523 -9.340 1006 HG3 GLU 129 3HG GLU 129 -5.815 -22.547 -7.713 1007 H GLY 130 H GLY 130 -8.174 -26.952 -8.754 1008 HA2 GLY 130 2HA GLY 130 -9.813 -27.469 -10.284 1009 HA3 GLY 130 3HA GLY 130 -9.627 -25.848 -10.936 1010 HA PRO 131 HA PRO 131 -8.003 -29.112 -13.924 1011 HB2 PRO 131 2HB PRO 131 -9.786 -28.632 -15.914 1012 HB3 PRO 131 3HB PRO 131 -10.076 -29.808 -14.627 1013 HG2 PRO 131 2HG PRO 131 -11.077 -26.999 -14.886 1014 HG3 PRO 131 3HG PRO 131 -11.948 -28.454 -14.368 1015 HD2 PRO 131 2HD PRO 131 -10.988 -26.628 -12.614 1016 HD3 PRO 131 3HD PRO 131 -11.091 -28.358 -12.230 1017 HA PRO 132 HA PRO 132 -5.763 -26.197 -16.336 1018 HB2 PRO 132 2HB PRO 132 -5.491 -27.471 -18.718 1019 HB3 PRO 132 3HB PRO 132 -4.623 -27.965 -17.260 1020 HG2 PRO 132 2HG PRO 132 -7.113 -29.111 -18.464 1021 HG3 PRO 132 3HG PRO 132 -5.711 -29.954 -17.779 1022 HD2 PRO 132 2HD PRO 132 -8.021 -29.616 -16.407 1023 HD3 PRO 132 3HD PRO 132 -6.435 -29.660 -15.610 1024 H GLN 133 H GLN 133 -8.470 -27.618 -18.166 1025 HA GLN 133 HA GLN 133 -8.741 -25.195 -19.745 1026 HB2 GLN 133 2HB GLN 133 -9.643 -27.969 -19.949 1027 HB3 GLN 133 3HB GLN 133 -10.886 -26.805 -20.388 1028 HG2 GLN 133 2HG GLN 133 -9.971 -26.729 -22.400 1029 HG3 GLN 133 3HG GLN 133 -8.606 -25.887 -21.668 1030 HE21 GLN 133 1HE2 GLN 133 -8.844 -27.834 -23.926 1031 HE22 GLN 133 2HE2 GLN 133 -7.693 -29.070 -23.562 1032 H ALA 134 H ALA 134 -10.224 -23.644 -19.440 1033 HA ALA 134 HA ALA 134 -11.912 -23.824 -17.075 1034 HB1 ALA 134 1HB ALA 134 -11.497 -21.471 -18.914 1035 HB2 ALA 134 2HB ALA 134 -12.222 -21.453 -17.305 1036 HB3 ALA 134 3HB ALA 134 -10.508 -21.820 -17.496 1037 H TYR 135 H TYR 135 -14.103 -23.869 -17.077 1038 HA TYR 135 HA TYR 135 -15.606 -23.388 -19.503 1039 HB2 TYR 135 2HB TYR 135 -15.026 -26.100 -18.504 1040 HB3 TYR 135 3HB TYR 135 -16.722 -25.788 -18.853 1041 HD1 TYR 135 HD2 TYR 135 -17.191 -24.668 -21.188 1042 HD2 TYR 135 HD1 TYR 135 -13.643 -26.809 -20.220 1043 HE1 TYR 135 HE2 TYR 135 -16.771 -25.045 -23.582 1044 HE2 TYR 135 HE1 TYR 135 -13.213 -27.190 -22.611 1045 HH TYR 135 HH TYR 135 -15.563 -26.360 -25.055 Start of MODEL 7 1 H21 MYR 1 1H2 MYR 1 5.804 9.749 -5.015 2 H22 MYR 1 2H2 MYR 1 5.376 10.788 -6.360 3 H31 MYR 1 1H3 MYR 1 3.919 12.138 -4.535 4 H32 MYR 1 2H3 MYR 1 4.132 10.700 -3.535 5 H41 MYR 1 1H4 MYR 1 3.224 10.204 -6.395 6 H42 MYR 1 2H4 MYR 1 2.061 11.021 -5.349 7 H51 MYR 1 1H5 MYR 1 1.546 8.718 -5.004 8 H52 MYR 1 2H5 MYR 1 2.533 9.109 -3.594 9 H61 MYR 1 1H6 MYR 1 4.331 8.288 -5.764 10 H62 MYR 1 2H6 MYR 1 3.030 7.100 -5.652 11 H71 MYR 1 1H7 MYR 1 4.718 8.055 -3.240 12 H72 MYR 1 2H7 MYR 1 5.058 6.592 -4.167 13 H81 MYR 1 1H8 MYR 1 2.269 7.008 -2.939 14 H82 MYR 1 2H8 MYR 1 3.601 6.453 -1.921 15 H91 MYR 1 1H9 MYR 1 3.488 4.926 -4.478 16 H92 MYR 1 2H9 MYR 1 1.949 4.845 -3.621 17 H101 MYR 1 1H10 MYR 1 4.550 4.390 -2.069 18 H102 MYR 1 2H10 MYR 1 3.938 3.086 -3.074 19 H111 MYR 1 1H11 MYR 1 2.168 4.475 -0.954 20 H112 MYR 1 2H11 MYR 1 3.287 3.190 -0.527 21 H121 MYR 1 1H12 MYR 1 2.125 1.684 -2.299 22 H122 MYR 1 2H12 MYR 1 0.894 2.937 -2.457 23 H131 MYR 1 1H13 MYR 1 -0.152 2.314 -0.502 24 H132 MYR 1 2H13 MYR 1 1.359 2.320 0.409 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 6.855 12.448 -6.672 29 HA2 GLY 2 2HA GLY 2 8.618 13.127 -4.412 30 HA3 GLY 2 3HA GLY 2 9.031 13.310 -6.111 31 H ASN 3 H ASN 3 6.228 14.364 -4.181 32 HA ASN 3 HA ASN 3 5.231 16.395 -3.949 33 HB2 ASN 3 2HB ASN 3 8.096 17.307 -4.269 34 HB3 ASN 3 3HB ASN 3 6.774 18.374 -3.806 35 HD21 ASN 3 1HD2 ASN 3 9.238 16.551 -2.657 36 HD22 ASN 3 2HD2 ASN 3 8.681 16.288 -1.042 37 H GLY 4 H GLY 4 4.193 15.904 -6.038 38 HA2 GLY 4 2HA GLY 4 3.322 17.383 -7.765 39 HA3 GLY 4 3HA GLY 4 4.972 17.914 -8.055 40 H ALA 5 H ALA 5 4.322 14.550 -7.528 41 HA ALA 5 HA ALA 5 4.243 13.982 -10.387 42 HB1 ALA 5 1HB ALA 5 6.172 12.231 -9.159 43 HB2 ALA 5 2HB ALA 5 6.330 13.247 -10.593 44 HB3 ALA 5 3HB ALA 5 6.662 13.917 -8.995 45 H SER 6 H SER 6 4.029 11.561 -10.757 46 HA SER 6 HA SER 6 2.899 10.066 -8.545 47 HB2 SER 6 2HB SER 6 1.237 10.875 -10.941 48 HB3 SER 6 3HB SER 6 0.772 9.617 -9.795 49 HG SER 6 HG SER 6 0.357 11.094 -8.312 50 H ARG 7 H ARG 7 5.159 9.852 -10.415 51 HA ARG 7 HA ARG 7 4.661 7.902 -12.386 52 HB2 ARG 7 2HB ARG 7 7.214 8.506 -10.880 53 HB3 ARG 7 3HB ARG 7 7.106 7.531 -12.340 54 HG2 ARG 7 2HG ARG 7 6.022 9.642 -13.376 55 HG3 ARG 7 3HG ARG 7 6.758 10.478 -12.007 56 HD2 ARG 7 2HD ARG 7 8.647 10.569 -13.175 57 HD3 ARG 7 3HD ARG 7 8.761 8.817 -13.016 58 HE ARG 7 HE ARG 7 7.080 9.338 -15.164 59 HH11 ARG 7 1HH1 ARG 7 10.406 9.868 -14.282 60 HH12 ARG 7 2HH1 ARG 7 10.983 9.814 -15.915 61 HH21 ARG 7 1HH2 ARG 7 7.828 9.265 -17.318 62 HH22 ARG 7 2HH2 ARG 7 9.516 9.472 -17.641 63 H ASP 8 H ASP 8 6.085 7.549 -9.134 64 HA ASP 8 HA ASP 8 6.229 4.753 -9.154 65 HB2 ASP 8 2HB ASP 8 6.517 6.890 -7.190 66 HB3 ASP 8 3HB ASP 8 5.831 5.425 -6.493 67 H TRP 9 H TRP 9 3.570 6.906 -8.600 68 HA TRP 9 HA TRP 9 1.882 5.036 -7.261 69 HB2 TRP 9 2HB TRP 9 1.434 7.378 -6.980 70 HB3 TRP 9 3HB TRP 9 1.296 7.616 -8.720 71 HD1 TRP 9 HD1 TRP 9 -1.078 7.490 -9.702 72 HE1 TRP 9 HE1 TRP 9 -3.384 6.758 -8.823 73 HE3 TRP 9 HE3 TRP 9 0.353 5.528 -5.203 74 HZ2 TRP 9 HZ2 TRP 9 -4.454 5.514 -6.527 75 HZ3 TRP 9 HZ3 TRP 9 -1.373 4.588 -3.724 76 HH2 TRP 9 HH2 TRP 9 -3.727 4.582 -4.374 77 H LYS 10 H LYS 10 1.604 6.433 -10.535 78 HA LYS 10 HA LYS 10 -0.325 4.722 -11.519 79 HB2 LYS 10 2HB LYS 10 0.879 6.815 -12.569 80 HB3 LYS 10 3HB LYS 10 1.903 5.595 -13.316 81 HG2 LYS 10 2HG LYS 10 -0.119 4.537 -14.265 82 HG3 LYS 10 3HG LYS 10 -1.085 5.852 -13.592 83 HD2 LYS 10 2HD LYS 10 0.763 7.285 -14.907 84 HD3 LYS 10 3HD LYS 10 0.756 5.832 -15.909 85 HE2 LYS 10 2HE LYS 10 -1.794 6.079 -15.910 86 HE3 LYS 10 3HE LYS 10 -1.509 7.709 -15.301 87 HZ1 LYS 10 3HZ LYS 10 -1.733 7.683 -17.707 88 HZ2 LYS 10 1HZ LYS 10 -0.436 6.605 -17.842 89 HZ3 LYS 10 2HZ LYS 10 -0.176 8.172 -17.260 90 H MET 11 H MET 11 3.171 4.261 -11.365 91 HA MET 11 HA MET 11 3.262 1.879 -12.882 92 HB2 MET 11 2HB MET 11 5.140 3.541 -11.861 93 HB3 MET 11 3HB MET 11 5.250 2.208 -10.720 94 HG2 MET 11 2HG MET 11 5.770 0.664 -12.454 95 HG3 MET 11 3HG MET 11 5.413 1.858 -13.699 96 HE1 MET 11 3HE MET 11 8.623 0.175 -13.147 97 HE2 MET 11 1HE MET 11 7.547 0.652 -14.461 98 HE3 MET 11 2HE MET 11 9.115 1.437 -14.277 99 H ALA 12 H ALA 12 3.095 2.462 -9.381 100 HA ALA 12 HA ALA 12 3.211 -0.176 -8.510 101 HB1 ALA 12 1HB ALA 12 2.057 0.622 -6.483 102 HB2 ALA 12 2HB ALA 12 3.379 1.681 -6.973 103 HB3 ALA 12 3HB ALA 12 1.710 2.144 -7.304 104 H ILE 13 H ILE 13 0.532 1.656 -9.832 105 HA ILE 13 HA ILE 13 -1.510 -0.189 -9.105 106 HB ILE 13 HB ILE 13 -1.483 1.880 -11.305 107 HG12 ILE 13 2HG1 ILE 13 -1.159 2.790 -9.022 108 HG13 ILE 13 3HG1 ILE 13 -2.690 3.289 -9.732 109 HG21 ILE 13 1HG2 ILE 13 -3.430 1.046 -11.962 110 HG22 ILE 13 2HG2 ILE 13 -3.356 -0.185 -10.702 111 HG23 ILE 13 3HG2 ILE 13 -4.093 1.380 -10.362 112 HD11 ILE 13 3HD1 ILE 13 -3.041 0.861 -8.253 113 HD12 ILE 13 1HD1 ILE 13 -2.266 2.085 -7.249 114 HD13 ILE 13 2HD1 ILE 13 -3.808 2.433 -8.030 115 H LYS 14 H LYS 14 0.143 0.451 -12.197 116 HA LYS 14 HA LYS 14 -1.067 -1.567 -13.687 117 HB2 LYS 14 2HB LYS 14 1.356 0.089 -13.920 118 HB3 LYS 14 3HB LYS 14 1.432 -1.442 -14.782 119 HG2 LYS 14 2HG LYS 14 0.177 -0.635 -16.414 120 HG3 LYS 14 3HG LYS 14 -1.095 -0.194 -15.273 121 HD2 LYS 14 2HD LYS 14 -0.615 1.897 -15.993 122 HD3 LYS 14 3HD LYS 14 0.663 1.779 -14.782 123 HE2 LYS 14 2HE LYS 14 1.420 0.645 -17.356 124 HE3 LYS 14 3HE LYS 14 1.004 2.355 -17.455 125 HZ1 LYS 14 3HZ LYS 14 2.544 2.384 -15.309 126 HZ2 LYS 14 1HZ LYS 14 3.160 2.566 -16.874 127 HZ3 LYS 14 2HZ LYS 14 3.236 1.061 -16.105 128 H ARG 15 H ARG 15 1.418 -1.733 -11.282 129 HA ARG 15 HA ARG 15 2.391 -4.326 -12.033 130 HB2 ARG 15 2HB ARG 15 2.987 -2.319 -10.000 131 HB3 ARG 15 3HB ARG 15 3.072 -3.961 -9.375 132 HG2 ARG 15 2HG ARG 15 5.242 -3.210 -10.161 133 HG3 ARG 15 3HG ARG 15 4.650 -4.558 -11.136 134 HD2 ARG 15 2HD ARG 15 3.728 -2.149 -12.318 135 HD3 ARG 15 3HD ARG 15 5.448 -1.962 -11.981 136 HE ARG 15 HE ARG 15 4.997 -4.461 -13.192 137 HH11 ARG 15 1HH1 ARG 15 4.978 -1.061 -13.935 138 HH12 ARG 15 2HH1 ARG 15 5.377 -1.291 -15.606 139 HH21 ARG 15 1HH2 ARG 15 5.523 -4.777 -15.388 140 HH22 ARG 15 2HH2 ARG 15 5.686 -3.405 -16.431 141 H CYS 16 H CYS 16 0.720 -3.254 -9.067 142 HA CYS 16 HA CYS 16 -0.001 -5.811 -8.207 143 HB2 CYS 16 2HB CYS 16 -1.534 -4.705 -6.683 144 HB3 CYS 16 3HB CYS 16 -0.034 -3.790 -6.775 145 HG CYS 16 HG CYS 16 -2.641 -2.322 -6.696 146 H SER 17 H SER 17 -1.345 -3.812 -10.658 147 HA SER 17 HA SER 17 -3.994 -4.613 -10.744 148 HB2 SER 17 2HB SER 17 -3.290 -2.870 -12.210 149 HB3 SER 17 3HB SER 17 -2.075 -3.901 -12.965 150 HG SER 17 HG SER 17 -3.757 -3.917 -14.356 151 H ASN 18 H ASN 18 -1.121 -6.366 -11.604 152 HA ASN 18 HA ASN 18 -2.678 -8.501 -12.857 153 HB2 ASN 18 2HB ASN 18 0.267 -7.902 -12.685 154 HB3 ASN 18 3HB ASN 18 -0.314 -9.485 -13.194 155 HD21 ASN 18 1HD2 ASN 18 -2.332 -9.089 -14.796 156 HD22 ASN 18 2HD2 ASN 18 -1.917 -8.093 -16.145 157 H VAL 19 H VAL 19 -3.068 -8.063 -10.084 158 HA VAL 19 HA VAL 19 -1.812 -10.467 -8.927 159 HB VAL 19 HB VAL 19 -2.893 -8.041 -7.486 160 HG11 VAL 19 1HG1 VAL 19 -3.207 -9.529 -5.831 161 HG12 VAL 19 2HG1 VAL 19 -2.173 -10.742 -6.587 162 HG13 VAL 19 3HG1 VAL 19 -1.455 -9.431 -5.651 163 HG21 VAL 19 3HG2 VAL 19 -0.685 -7.407 -7.051 164 HG22 VAL 19 1HG2 VAL 19 -0.046 -8.986 -7.506 165 HG23 VAL 19 2HG2 VAL 19 -0.660 -7.893 -8.746 166 H ALA 20 H ALA 20 -3.086 -11.963 -7.875 167 HA ALA 20 HA ALA 20 -5.996 -11.609 -8.192 168 HB1 ALA 20 1HB ALA 20 -4.692 -14.301 -8.093 169 HB2 ALA 20 2HB ALA 20 -6.248 -13.837 -8.783 170 HB3 ALA 20 3HB ALA 20 -4.752 -13.384 -9.599 171 H VAL 21 H VAL 21 -7.358 -12.406 -6.558 172 HA VAL 21 HA VAL 21 -6.518 -12.009 -3.933 173 HB VAL 21 HB VAL 21 -8.867 -13.711 -4.770 174 HG11 VAL 21 1HG1 VAL 21 -9.757 -12.541 -2.608 175 HG12 VAL 21 2HG1 VAL 21 -8.722 -13.965 -2.486 176 HG13 VAL 21 3HG1 VAL 21 -8.042 -12.355 -2.243 177 HG21 VAL 21 3HG2 VAL 21 -8.355 -10.942 -5.275 178 HG22 VAL 21 1HG2 VAL 21 -9.769 -11.907 -5.700 179 HG23 VAL 21 2HG2 VAL 21 -9.694 -11.092 -4.138 180 H GLY 22 H GLY 22 -6.419 -14.858 -5.924 181 HA2 GLY 22 2HA GLY 22 -4.920 -16.236 -3.838 182 HA3 GLY 22 3HA GLY 22 -6.402 -17.016 -4.372 183 H VAL 23 H VAL 23 -4.723 -18.719 -4.860 184 HA VAL 23 HA VAL 23 -3.038 -18.286 -7.152 185 HB VAL 23 HB VAL 23 -2.475 -20.645 -6.975 186 HG11 VAL 23 1HG1 VAL 23 -1.269 -19.187 -5.514 187 HG12 VAL 23 2HG1 VAL 23 -2.583 -19.194 -4.336 188 HG13 VAL 23 3HG1 VAL 23 -1.645 -20.660 -4.621 189 HG21 VAL 23 3HG2 VAL 23 -4.618 -21.602 -6.473 190 HG22 VAL 23 1HG2 VAL 23 -3.503 -22.021 -5.171 191 HG23 VAL 23 2HG2 VAL 23 -4.694 -20.742 -4.935 192 H GLY 24 H GLY 24 -6.245 -19.501 -6.556 193 HA2 GLY 24 2HA GLY 24 -6.527 -19.985 -9.455 194 HA3 GLY 24 3HA GLY 24 -7.215 -21.092 -8.277 195 H GLY 25 H GLY 25 -8.595 -19.613 -10.354 196 HA2 GLY 25 2HA GLY 25 -10.942 -18.941 -9.167 197 HA3 GLY 25 3HA GLY 25 -10.009 -17.455 -9.065 198 H LYS 26 H LYS 26 -12.402 -18.674 -10.723 199 HA LYS 26 HA LYS 26 -11.778 -18.639 -13.419 200 HB2 LYS 26 2HB LYS 26 -14.180 -18.415 -11.802 201 HB3 LYS 26 3HB LYS 26 -14.292 -17.442 -13.262 202 HG2 LYS 26 2HG LYS 26 -14.571 -19.232 -14.549 203 HG3 LYS 26 3HG LYS 26 -13.228 -20.088 -13.788 204 HD2 LYS 26 2HD LYS 26 -14.596 -21.276 -12.474 205 HD3 LYS 26 3HD LYS 26 -15.561 -19.858 -12.057 206 HE2 LYS 26 2HE LYS 26 -16.991 -21.386 -13.194 207 HE3 LYS 26 3HE LYS 26 -16.655 -20.056 -14.301 208 HZ1 LYS 26 3HZ LYS 26 -16.330 -21.859 -15.647 209 HZ2 LYS 26 1HZ LYS 26 -15.728 -22.839 -14.406 210 HZ3 LYS 26 2HZ LYS 26 -14.753 -21.631 -15.078 211 H SER 27 H SER 27 -12.163 -15.983 -11.193 212 HA SER 27 HA SER 27 -10.839 -14.156 -12.888 213 HB2 SER 27 2HB SER 27 -12.855 -12.568 -13.107 214 HB3 SER 27 3HB SER 27 -12.786 -13.948 -14.203 215 HG SER 27 HG SER 27 -14.554 -13.396 -12.155 216 H LYS 28 H LYS 28 -10.276 -14.816 -10.374 217 HA LYS 28 HA LYS 28 -11.433 -12.812 -8.591 218 HB2 LYS 28 2HB LYS 28 -9.466 -15.042 -8.042 219 HB3 LYS 28 3HB LYS 28 -10.142 -13.967 -6.825 220 HG2 LYS 28 2HG LYS 28 -12.425 -14.817 -7.625 221 HG3 LYS 28 3HG LYS 28 -11.511 -16.110 -8.407 222 HD2 LYS 28 2HD LYS 28 -10.479 -16.623 -6.197 223 HD3 LYS 28 3HD LYS 28 -11.559 -15.433 -5.467 224 HE2 LYS 28 2HE LYS 28 -12.362 -17.943 -6.933 225 HE3 LYS 28 3HE LYS 28 -12.478 -17.655 -5.198 226 HZ1 LYS 28 3HZ LYS 28 -14.591 -17.162 -5.829 227 HZ2 LYS 28 1HZ LYS 28 -14.145 -16.622 -7.369 228 HZ3 LYS 28 2HZ LYS 28 -13.904 -15.629 -6.021 229 H LYS 29 H LYS 29 -10.124 -11.487 -10.466 230 HA LYS 29 HA LYS 29 -7.466 -10.872 -9.364 231 HB2 LYS 29 2HB LYS 29 -7.013 -9.789 -11.537 232 HB3 LYS 29 3HB LYS 29 -7.411 -11.493 -11.710 233 HG2 LYS 29 2HG LYS 29 -9.445 -11.059 -12.695 234 HG3 LYS 29 3HG LYS 29 -9.563 -9.446 -11.986 235 HD2 LYS 29 2HD LYS 29 -7.697 -8.722 -13.454 236 HD3 LYS 29 3HD LYS 29 -7.724 -10.313 -14.217 237 HE2 LYS 29 2HE LYS 29 -10.220 -8.672 -14.068 238 HE3 LYS 29 3HE LYS 29 -9.013 -8.334 -15.307 239 HZ1 LYS 29 3HZ LYS 29 -10.600 -9.835 -16.209 240 HZ2 LYS 29 1HZ LYS 29 -10.479 -10.878 -14.882 241 HZ3 LYS 29 2HZ LYS 29 -9.178 -10.713 -15.950 242 H PHE 30 H PHE 30 -6.839 -8.651 -9.155 243 HA PHE 30 HA PHE 30 -9.128 -6.902 -8.575 244 HB2 PHE 30 2HB PHE 30 -6.351 -7.077 -7.434 245 HB3 PHE 30 3HB PHE 30 -7.317 -5.616 -7.245 246 HD1 PHE 30 HD2 PHE 30 -9.966 -6.520 -6.703 247 HD2 PHE 30 HD1 PHE 30 -6.266 -8.203 -5.440 248 HE1 PHE 30 HE2 PHE 30 -11.088 -7.516 -4.754 249 HE2 PHE 30 HE1 PHE 30 -7.383 -9.202 -3.489 250 HZ PHE 30 HZ PHE 30 -9.797 -8.858 -3.143 251 H GLY 31 H GLY 31 -8.189 -4.449 -8.585 252 HA2 GLY 31 2HA GLY 31 -6.454 -3.852 -10.787 253 HA3 GLY 31 3HA GLY 31 -8.147 -3.612 -11.195 254 H GLU 32 H GLU 32 -6.813 -1.418 -11.447 255 HA GLU 32 HA GLU 32 -6.157 0.156 -9.277 256 HB2 GLU 32 2HB GLU 32 -5.790 0.756 -11.665 257 HB3 GLU 32 3HB GLU 32 -7.506 1.109 -11.808 258 HG2 GLU 32 2HG GLU 32 -6.483 2.543 -9.580 259 HG3 GLU 32 3HG GLU 32 -5.419 2.813 -10.960 260 H GLY 33 H GLY 33 -9.308 -0.706 -10.500 261 HA2 GLY 33 2HA GLY 33 -10.782 1.300 -9.119 262 HA3 GLY 33 3HA GLY 33 -11.435 -0.184 -9.796 263 H ASN 34 H ASN 34 -10.524 -2.199 -8.463 264 HA ASN 34 HA ASN 34 -11.774 -2.065 -5.947 265 HB2 ASN 34 2HB ASN 34 -10.144 -4.088 -7.406 266 HB3 ASN 34 3HB ASN 34 -10.358 -4.309 -5.672 267 HD21 ASN 34 1HD2 ASN 34 -12.540 -4.409 -4.856 268 HD22 ASN 34 2HD2 ASN 34 -13.796 -5.035 -5.863 269 H PHE 35 H PHE 35 -8.347 -2.102 -6.865 270 HA PHE 35 HA PHE 35 -7.225 -2.169 -4.324 271 HB2 PHE 35 2HB PHE 35 -6.280 -0.977 -6.921 272 HB3 PHE 35 3HB PHE 35 -5.303 -0.879 -5.460 273 HD1 PHE 35 HD1 PHE 35 -5.595 -3.435 -4.204 274 HD2 PHE 35 HD2 PHE 35 -5.330 -2.503 -8.348 275 HE1 PHE 35 HE1 PHE 35 -4.703 -5.684 -4.649 276 HE2 PHE 35 HE2 PHE 35 -4.439 -4.751 -8.800 277 HZ PHE 35 HZ PHE 35 -4.125 -6.345 -6.950 278 H ARG 36 H ARG 36 -8.182 0.641 -6.274 279 HA ARG 36 HA ARG 36 -7.339 2.633 -4.504 280 HB2 ARG 36 2HB ARG 36 -9.363 2.494 -6.696 281 HB3 ARG 36 3HB ARG 36 -9.356 3.903 -5.645 282 HG2 ARG 36 2HG ARG 36 -7.045 4.358 -6.228 283 HG3 ARG 36 3HG ARG 36 -7.001 2.910 -7.236 284 HD2 ARG 36 2HD ARG 36 -7.330 4.868 -8.619 285 HD3 ARG 36 3HD ARG 36 -8.779 3.863 -8.645 286 HE ARG 36 HE ARG 36 -9.938 5.558 -7.621 287 HH11 ARG 36 1HH1 ARG 36 -6.523 6.202 -7.418 288 HH12 ARG 36 2HH1 ARG 36 -6.730 7.812 -6.812 289 HH21 ARG 36 1HH2 ARG 36 -10.224 7.675 -6.823 290 HH22 ARG 36 2HH2 ARG 36 -8.835 8.649 -6.473 291 H TRP 37 H TRP 37 -10.458 0.963 -4.761 292 HA TRP 37 HA TRP 37 -11.884 2.388 -2.856 293 HB2 TRP 37 2HB TRP 37 -13.010 0.785 -4.244 294 HB3 TRP 37 3HB TRP 37 -12.026 -0.533 -3.614 295 HD1 TRP 37 HD1 TRP 37 -15.106 1.538 -2.832 296 HE1 TRP 37 HE1 TRP 37 -16.299 0.534 -0.784 297 HE3 TRP 37 HE3 TRP 37 -11.549 -1.843 -1.398 298 HZ2 TRP 37 HZ2 TRP 37 -15.798 -1.430 1.180 299 HZ3 TRP 37 HZ3 TRP 37 -11.984 -3.246 0.577 300 HH2 TRP 37 HH2 TRP 37 -14.065 -3.042 1.838 301 H ALA 38 H ALA 38 -9.727 -0.389 -2.420 302 HA ALA 38 HA ALA 38 -10.155 -0.687 0.358 303 HB1 ALA 38 1HB ALA 38 -9.214 -2.499 -0.890 304 HB2 ALA 38 2HB ALA 38 -7.840 -1.510 -1.386 305 HB3 ALA 38 3HB ALA 38 -8.025 -1.979 0.304 306 H ILE 39 H ILE 39 -7.540 0.916 -1.454 307 HA ILE 39 HA ILE 39 -6.096 1.842 0.751 308 HB ILE 39 HB ILE 39 -6.348 3.115 -1.977 309 HG12 ILE 39 2HG1 ILE 39 -5.562 0.759 -1.989 310 HG13 ILE 39 3HG1 ILE 39 -4.329 1.890 -2.535 311 HG21 ILE 39 1HG2 ILE 39 -5.349 4.799 -0.806 312 HG22 ILE 39 2HG2 ILE 39 -4.651 3.704 0.387 313 HG23 ILE 39 3HG2 ILE 39 -3.923 3.845 -1.213 314 HD11 ILE 39 3HD1 ILE 39 -2.937 1.302 -0.909 315 HD12 ILE 39 1HD1 ILE 39 -4.198 1.394 0.320 316 HD13 ILE 39 2HD1 ILE 39 -4.011 -0.072 -0.644 317 H ARG 40 H ARG 40 -8.340 3.717 -1.299 318 HA ARG 40 HA ARG 40 -8.410 6.031 0.203 319 HB2 ARG 40 2HB ARG 40 -9.584 5.299 -2.075 320 HB3 ARG 40 3HB ARG 40 -10.966 5.097 -1.006 321 HG2 ARG 40 2HG ARG 40 -11.187 7.267 -1.801 322 HG3 ARG 40 3HG ARG 40 -10.451 7.478 -0.210 323 HD2 ARG 40 2HD ARG 40 -8.509 8.246 -1.066 324 HD3 ARG 40 3HD ARG 40 -8.570 7.158 -2.453 325 HE ARG 40 HE ARG 40 -10.543 8.967 -2.943 326 HH11 ARG 40 1HH1 ARG 40 -7.143 9.197 -2.231 327 HH12 ARG 40 2HH1 ARG 40 -6.918 10.657 -3.138 328 HH21 ARG 40 1HH2 ARG 40 -10.260 10.889 -4.140 329 HH22 ARG 40 2HH2 ARG 40 -8.693 11.618 -4.222 330 H MET 41 H MET 41 -10.447 3.142 0.532 331 HA MET 41 HA MET 41 -12.186 4.005 2.493 332 HB2 MET 41 2HB MET 41 -12.482 1.862 1.429 333 HB3 MET 41 3HB MET 41 -10.962 1.273 2.088 334 HG2 MET 41 2HG MET 41 -11.990 0.540 3.897 335 HG3 MET 41 3HG MET 41 -12.615 2.153 4.233 336 HE1 MET 41 3HE MET 41 -13.485 -0.891 4.603 337 HE2 MET 41 1HE MET 41 -14.895 -0.031 5.224 338 HE3 MET 41 2HE MET 41 -15.088 -1.239 3.954 339 H ALA 42 H ALA 42 -8.953 2.596 2.896 340 HA ALA 42 HA ALA 42 -9.014 2.784 5.754 341 HB1 ALA 42 1HB ALA 42 -7.178 1.521 5.668 342 HB2 ALA 42 2HB ALA 42 -7.473 1.416 3.932 343 HB3 ALA 42 3HB ALA 42 -6.362 2.631 4.565 344 H ASN 43 H ASN 43 -7.873 4.803 3.127 345 HA ASN 43 HA ASN 43 -6.247 6.550 4.612 346 HB2 ASN 43 2HB ASN 43 -6.274 6.421 2.131 347 HB3 ASN 43 3HB ASN 43 -7.861 7.184 2.132 348 HD21 ASN 43 1HD2 ASN 43 -7.338 9.033 1.095 349 HD22 ASN 43 2HD2 ASN 43 -6.245 10.217 1.720 350 H VAL 44 H VAL 44 -9.686 6.286 4.300 351 HA VAL 44 HA VAL 44 -10.053 8.847 5.699 352 HB VAL 44 HB VAL 44 -12.183 7.182 4.358 353 HG11 VAL 44 1HG1 VAL 44 -12.126 9.778 5.788 354 HG12 VAL 44 2HG1 VAL 44 -13.169 9.653 4.370 355 HG13 VAL 44 3HG1 VAL 44 -13.385 8.545 5.726 356 HG21 VAL 44 3HG2 VAL 44 -11.923 9.354 2.774 357 HG22 VAL 44 1HG2 VAL 44 -10.246 9.107 3.260 358 HG23 VAL 44 2HG2 VAL 44 -11.133 7.809 2.462 359 H SER 45 H SER 45 -11.638 5.648 5.641 360 HA SER 45 HA SER 45 -12.882 5.795 8.100 361 HB2 SER 45 2HB SER 45 -13.373 3.569 7.829 362 HB3 SER 45 3HB SER 45 -12.850 3.935 6.185 363 HG SER 45 HG SER 45 -11.825 2.065 6.991 364 H THR 46 H THR 46 -9.581 4.806 7.347 365 HA THR 46 HA THR 46 -8.989 4.850 10.235 366 HB THR 46 HB THR 46 -7.068 3.256 9.603 367 HG1 THR 46 HG1 THR 46 -7.213 3.316 7.370 368 HG21 THR 46 3HG2 THR 46 -9.965 2.433 9.633 369 HG22 THR 46 1HG2 THR 46 -8.821 2.439 10.974 370 HG23 THR 46 2HG2 THR 46 -8.643 1.267 9.668 371 H GLY 47 H GLY 47 -8.850 7.146 8.659 372 HA2 GLY 47 2HA GLY 47 -6.018 7.758 8.938 373 HA3 GLY 47 3HA GLY 47 -6.680 7.926 7.319 374 H ARG 48 H ARG 48 -7.879 9.697 6.806 375 HA ARG 48 HA ARG 48 -9.177 11.380 8.643 376 HB2 ARG 48 2HB ARG 48 -7.592 13.365 8.360 377 HB3 ARG 48 3HB ARG 48 -7.105 12.105 9.487 378 HG2 ARG 48 2HG ARG 48 -6.109 11.558 6.839 379 HG3 ARG 48 3HG ARG 48 -5.615 13.160 7.389 380 HD2 ARG 48 2HD ARG 48 -5.318 10.695 9.086 381 HD3 ARG 48 3HD ARG 48 -4.069 11.230 7.962 382 HE ARG 48 HE ARG 48 -4.685 12.361 10.515 383 HH11 ARG 48 1HH1 ARG 48 -3.438 13.064 7.342 384 HH12 ARG 48 2HH1 ARG 48 -2.497 14.420 7.869 385 HH21 ARG 48 1HH2 ARG 48 -3.451 14.144 11.222 386 HH22 ARG 48 2HH2 ARG 48 -2.505 15.033 10.077 387 H GLU 49 H GLU 49 -10.694 11.088 6.931 388 HA GLU 49 HA GLU 49 -11.862 11.780 5.105 389 HB2 GLU 49 2HB GLU 49 -10.164 14.050 5.809 390 HB3 GLU 49 3HB GLU 49 -10.589 14.021 4.104 391 HG2 GLU 49 2HG GLU 49 -12.983 13.489 5.328 392 HG3 GLU 49 3HG GLU 49 -12.223 14.633 6.432 393 HA PRO 50 HA PRO 50 -9.903 10.181 1.522 394 HB2 PRO 50 2HB PRO 50 -11.203 11.469 -0.483 395 HB3 PRO 50 3HB PRO 50 -11.960 10.210 0.499 396 HG2 PRO 50 2HG PRO 50 -12.182 13.186 0.736 397 HG3 PRO 50 3HG PRO 50 -13.454 11.956 0.858 398 HD2 PRO 50 2HD PRO 50 -12.334 13.114 3.034 399 HD3 PRO 50 3HD PRO 50 -12.918 11.437 3.039 400 H GLY 51 H GLY 51 -9.789 13.570 2.145 401 HA2 GLY 51 2HA GLY 51 -8.127 14.289 -0.075 402 HA3 GLY 51 3HA GLY 51 -8.441 15.267 1.351 403 H ASP 52 H ASP 52 -6.608 12.422 0.270 404 HA ASP 52 HA ASP 52 -4.147 13.343 1.219 405 HB2 ASP 52 2HB ASP 52 -5.787 12.383 3.302 406 HB3 ASP 52 3HB ASP 52 -4.580 11.133 3.014 407 H ILE 53 H ILE 53 -2.476 11.563 1.265 408 HA ILE 53 HA ILE 53 -3.210 9.105 -0.079 409 HB ILE 53 HB ILE 53 -1.420 9.522 -1.858 410 HG12 ILE 53 2HG1 ILE 53 -2.060 12.412 -1.253 411 HG13 ILE 53 3HG1 ILE 53 -0.585 11.616 -0.714 412 HG21 ILE 53 1HG2 ILE 53 -3.014 10.378 -3.389 413 HG22 ILE 53 2HG2 ILE 53 -3.915 9.452 -2.189 414 HG23 ILE 53 3HG2 ILE 53 -3.895 11.214 -2.110 415 HD11 ILE 53 3HD1 ILE 53 0.239 11.417 -2.876 416 HD12 ILE 53 1HD1 ILE 53 -1.349 11.658 -3.605 417 HD13 ILE 53 2HD1 ILE 53 -0.507 13.014 -2.854 418 HA PRO 54 HA PRO 54 0.230 7.507 2.129 419 HB2 PRO 54 2HB PRO 54 1.040 5.502 0.488 420 HB3 PRO 54 3HB PRO 54 -0.444 5.421 1.444 421 HG2 PRO 54 2HG PRO 54 -0.088 6.111 -1.447 422 HG3 PRO 54 3HG PRO 54 -1.314 5.081 -0.686 423 HD2 PRO 54 2HD PRO 54 -1.813 7.639 -1.421 424 HD3 PRO 54 3HD PRO 54 -2.592 6.879 -0.018 425 H GLU 55 H GLU 55 2.577 6.994 1.953 426 HA GLU 55 HA GLU 55 4.158 7.692 -0.243 427 HB2 GLU 55 2HB GLU 55 5.099 9.861 0.698 428 HB3 GLU 55 3HB GLU 55 3.509 9.952 -0.045 429 HG2 GLU 55 2HG GLU 55 2.443 9.989 2.103 430 HG3 GLU 55 3HG GLU 55 3.983 9.712 2.915 431 H THR 56 H THR 56 3.845 7.561 3.250 432 HA THR 56 HA THR 56 6.656 6.719 3.463 433 HB THR 56 HB THR 56 6.614 7.309 5.768 434 HG1 THR 56 HG1 THR 56 3.902 8.076 5.671 435 HG21 THR 56 3HG2 THR 56 6.326 9.161 3.815 436 HG22 THR 56 1HG2 THR 56 6.616 9.554 5.509 437 HG23 THR 56 2HG2 THR 56 4.974 9.585 4.864 438 H LEU 57 H LEU 57 7.061 4.631 3.727 439 HA LEU 57 HA LEU 57 5.172 2.620 3.805 440 HB2 LEU 57 2HB LEU 57 8.057 2.829 4.274 441 HB3 LEU 57 3HB LEU 57 7.290 1.463 5.082 442 HG LEU 57 HG LEU 57 7.227 2.029 2.118 443 HD11 LEU 57 1HD1 LEU 57 8.783 0.313 1.842 444 HD12 LEU 57 2HD1 LEU 57 8.559 -0.282 3.487 445 HD13 LEU 57 3HD1 LEU 57 9.405 1.240 3.208 446 HD21 LEU 57 3HD2 LEU 57 5.375 0.778 2.180 447 HD22 LEU 57 1HD2 LEU 57 5.667 0.265 3.842 448 HD23 LEU 57 2HD2 LEU 57 6.462 -0.573 2.508 449 H ASP 58 H ASP 58 6.518 4.479 6.428 450 HA ASP 58 HA ASP 58 5.760 2.794 8.562 451 HB2 ASP 58 2HB ASP 58 6.403 5.718 8.335 452 HB3 ASP 58 3HB ASP 58 5.804 5.054 9.853 453 H GLN 59 H GLN 59 4.183 5.716 7.261 454 HA GLN 59 HA GLN 59 1.907 5.636 8.863 455 HB2 GLN 59 2HB GLN 59 2.469 7.582 7.521 456 HB3 GLN 59 3HB GLN 59 2.222 6.667 6.040 457 HG2 GLN 59 2HG GLN 59 -0.029 6.819 6.152 458 HG3 GLN 59 3HG GLN 59 -0.054 6.787 7.915 459 HE21 GLN 59 1HE2 GLN 59 -1.084 8.555 8.532 460 HE22 GLN 59 2HE2 GLN 59 -0.749 10.161 7.991 461 H LEU 60 H LEU 60 2.471 4.195 5.669 462 HA LEU 60 HA LEU 60 -0.097 3.135 5.296 463 HB2 LEU 60 2HB LEU 60 1.473 3.300 3.477 464 HB3 LEU 60 3HB LEU 60 2.580 2.191 4.283 465 HG LEU 60 HG LEU 60 0.493 0.560 4.077 466 HD11 LEU 60 1HD1 LEU 60 -0.470 0.973 1.750 467 HD12 LEU 60 2HD1 LEU 60 0.084 2.635 1.949 468 HD13 LEU 60 3HD1 LEU 60 -1.092 1.958 3.074 469 HD21 LEU 60 3HD2 LEU 60 2.312 1.162 1.750 470 HD22 LEU 60 1HD2 LEU 60 1.519 -0.371 2.113 471 HD23 LEU 60 2HD2 LEU 60 2.783 0.242 3.179 472 H ARG 61 H ARG 61 2.835 1.629 6.635 473 HA ARG 61 HA ARG 61 1.858 -0.907 7.124 474 HB2 ARG 61 2HB ARG 61 4.197 -0.379 7.435 475 HB3 ARG 61 3HB ARG 61 3.813 0.727 8.747 476 HG2 ARG 61 2HG ARG 61 3.323 -0.993 10.226 477 HG3 ARG 61 3HG ARG 61 3.081 -2.166 8.930 478 HD2 ARG 61 2HD ARG 61 5.160 -2.847 9.392 479 HD3 ARG 61 3HD ARG 61 5.679 -1.389 8.546 480 HE ARG 61 HE ARG 61 6.373 -0.531 10.545 481 HH11 ARG 61 1HH1 ARG 61 4.173 -3.160 11.152 482 HH12 ARG 61 2HH1 ARG 61 4.433 -3.154 12.865 483 HH21 ARG 61 1HH2 ARG 61 6.723 -0.513 12.798 484 HH22 ARG 61 2HH2 ARG 61 5.883 -1.647 13.801 485 H LEU 62 H LEU 62 1.497 2.019 9.065 486 HA LEU 62 HA LEU 62 0.265 0.765 11.289 487 HB2 LEU 62 2HB LEU 62 1.158 3.320 10.642 488 HB3 LEU 62 3HB LEU 62 -0.579 3.501 10.877 489 HG LEU 62 HG LEU 62 0.640 3.995 12.922 490 HD11 LEU 62 1HD1 LEU 62 -1.611 2.649 12.789 491 HD12 LEU 62 2HD1 LEU 62 -0.796 2.906 14.331 492 HD13 LEU 62 3HD1 LEU 62 -0.629 1.364 13.493 493 HD21 LEU 62 3HD2 LEU 62 2.559 2.450 12.372 494 HD22 LEU 62 1HD2 LEU 62 1.545 1.125 12.945 495 HD23 LEU 62 2HD2 LEU 62 2.006 2.422 14.047 496 H VAL 63 H VAL 63 -0.976 2.247 8.341 497 HA VAL 63 HA VAL 63 -3.703 2.250 9.015 498 HB VAL 63 HB VAL 63 -2.446 1.969 6.281 499 HG11 VAL 63 1HG1 VAL 63 -4.725 3.158 5.724 500 HG12 VAL 63 2HG1 VAL 63 -4.626 1.401 5.856 501 HG13 VAL 63 3HG1 VAL 63 -5.251 2.354 7.202 502 HG21 VAL 63 3HG2 VAL 63 -2.444 4.127 8.108 503 HG22 VAL 63 1HG2 VAL 63 -1.879 4.110 6.438 504 HG23 VAL 63 2HG2 VAL 63 -3.549 4.547 6.800 505 H ILE 64 H ILE 64 -1.693 -0.194 7.418 506 HA ILE 64 HA ILE 64 -3.738 -2.019 6.818 507 HB ILE 64 HB ILE 64 -0.860 -2.664 7.468 508 HG12 ILE 64 2HG1 ILE 64 -2.097 -2.126 4.762 509 HG13 ILE 64 3HG1 ILE 64 -1.197 -0.923 5.680 510 HG21 ILE 64 1HG2 ILE 64 -1.321 -4.779 6.973 511 HG22 ILE 64 2HG2 ILE 64 -3.030 -4.349 6.966 512 HG23 ILE 64 3HG2 ILE 64 -2.106 -4.310 5.465 513 HD11 ILE 64 3HD1 ILE 64 -0.134 -3.534 4.629 514 HD12 ILE 64 1HD1 ILE 64 0.213 -1.923 4.002 515 HD13 ILE 64 2HD1 ILE 64 0.776 -2.385 5.608 516 H CYS 65 H CYS 65 -1.490 -1.962 9.586 517 HA CYS 65 HA CYS 65 -2.633 -4.153 10.931 518 HB2 CYS 65 2HB CYS 65 -0.981 -1.825 11.915 519 HB3 CYS 65 3HB CYS 65 -1.474 -3.154 12.957 520 HG CYS 65 HG CYS 65 0.233 -3.813 10.090 521 H ASP 66 H ASP 66 -3.012 -0.659 11.535 522 HA ASP 66 HA ASP 66 -4.877 -0.797 13.573 523 HB2 ASP 66 2HB ASP 66 -3.804 1.294 12.929 524 HB3 ASP 66 3HB ASP 66 -4.646 1.276 11.382 525 H LEU 67 H LEU 67 -5.393 -0.879 10.078 526 HA LEU 67 HA LEU 67 -8.207 -0.781 10.133 527 HB2 LEU 67 2HB LEU 67 -6.934 -0.360 8.112 528 HB3 LEU 67 3HB LEU 67 -6.341 -2.019 8.114 529 HG LEU 67 HG LEU 67 -8.616 -2.827 7.688 530 HD11 LEU 67 1HD1 LEU 67 -9.796 -0.964 8.806 531 HD12 LEU 67 2HD1 LEU 67 -10.419 -1.312 7.194 532 HD13 LEU 67 3HD1 LEU 67 -9.369 0.082 7.452 533 HD21 LEU 67 3HD2 LEU 67 -7.793 -2.712 5.614 534 HD22 LEU 67 1HD2 LEU 67 -7.072 -1.127 5.893 535 HD23 LEU 67 2HD2 LEU 67 -8.772 -1.254 5.441 536 H GLN 68 H GLN 68 -6.034 -3.584 9.739 537 HA GLN 68 HA GLN 68 -8.024 -5.547 9.815 538 HB2 GLN 68 2HB GLN 68 -5.433 -5.647 9.283 539 HB3 GLN 68 3HB GLN 68 -5.335 -6.124 10.972 540 HG2 GLN 68 2HG GLN 68 -7.404 -7.639 9.789 541 HG3 GLN 68 3HG GLN 68 -6.015 -7.696 8.705 542 HE21 GLN 68 1HE2 GLN 68 -7.161 -8.390 11.931 543 HE22 GLN 68 2HE2 GLN 68 -5.909 -9.504 12.347 544 H GLU 69 H GLU 69 -6.377 -3.833 12.377 545 HA GLU 69 HA GLU 69 -7.151 -5.558 14.498 546 HB2 GLU 69 2HB GLU 69 -6.029 -2.803 14.290 547 HB3 GLU 69 3HB GLU 69 -6.756 -3.287 15.816 548 HG2 GLU 69 2HG GLU 69 -4.650 -4.936 14.459 549 HG3 GLU 69 3HG GLU 69 -4.253 -3.615 15.557 550 H ARG 70 H ARG 70 -8.326 -2.290 13.668 551 HA ARG 70 HA ARG 70 -10.541 -2.334 15.377 552 HB2 ARG 70 2HB ARG 70 -9.462 -0.592 13.372 553 HB3 ARG 70 3HB ARG 70 -11.198 -0.739 13.131 554 HG2 ARG 70 2HG ARG 70 -11.142 -0.355 15.786 555 HG3 ARG 70 3HG ARG 70 -9.687 0.528 15.318 556 HD2 ARG 70 2HD ARG 70 -10.930 1.909 13.811 557 HD3 ARG 70 3HD ARG 70 -12.379 0.928 14.028 558 HE ARG 70 HE ARG 70 -12.818 2.061 15.971 559 HH11 ARG 70 1HH1 ARG 70 -9.537 2.687 14.989 560 HH12 ARG 70 2HH1 ARG 70 -9.279 3.922 16.176 561 HH21 ARG 70 1HH2 ARG 70 -12.490 3.685 17.539 562 HH22 ARG 70 2HH2 ARG 70 -10.959 4.488 17.627 563 H ARG 71 H ARG 71 -10.354 -3.012 11.886 564 HA ARG 71 HA ARG 71 -13.025 -3.574 11.421 565 HB2 ARG 71 2HB ARG 71 -10.538 -4.734 10.164 566 HB3 ARG 71 3HB ARG 71 -12.159 -5.060 9.565 567 HG2 ARG 71 2HG ARG 71 -10.942 -2.316 9.800 568 HG3 ARG 71 3HG ARG 71 -10.987 -3.279 8.322 569 HD2 ARG 71 2HD ARG 71 -13.044 -2.567 7.888 570 HD3 ARG 71 3HD ARG 71 -13.608 -3.181 9.441 571 HE ARG 71 HE ARG 71 -12.328 -0.764 9.928 572 HH11 ARG 71 1HH1 ARG 71 -15.121 -1.925 8.204 573 HH12 ARG 71 2HH1 ARG 71 -16.016 -0.454 8.400 574 HH21 ARG 71 1HH2 ARG 71 -13.495 1.177 10.192 575 HH22 ARG 71 2HH2 ARG 71 -15.089 1.310 9.531 576 H GLU 72 H GLU 72 -10.466 -5.718 12.598 577 HA GLU 72 HA GLU 72 -11.897 -8.117 12.568 578 HB2 GLU 72 2HB GLU 72 -9.521 -8.140 12.919 579 HB3 GLU 72 3HB GLU 72 -9.674 -7.170 14.377 580 HG2 GLU 72 2HG GLU 72 -9.229 -9.517 14.877 581 HG3 GLU 72 3HG GLU 72 -10.786 -8.991 15.514 582 H LYS 73 H LYS 73 -11.499 -5.758 15.201 583 HA LYS 73 HA LYS 73 -13.011 -7.052 17.139 584 HB2 LYS 73 2HB LYS 73 -12.045 -4.327 16.665 585 HB3 LYS 73 3HB LYS 73 -13.534 -4.386 17.599 586 HG2 LYS 73 2HG LYS 73 -12.415 -6.000 19.139 587 HG3 LYS 73 3HG LYS 73 -10.913 -5.706 18.259 588 HD2 LYS 73 2HD LYS 73 -12.476 -3.404 19.353 589 HD3 LYS 73 3HD LYS 73 -11.439 -4.351 20.423 590 HE2 LYS 73 2HE LYS 73 -9.716 -3.131 19.733 591 HE3 LYS 73 3HE LYS 73 -9.910 -3.844 18.132 592 HZ1 LYS 73 3HZ LYS 73 -10.357 -1.182 18.938 593 HZ2 LYS 73 1HZ LYS 73 -11.810 -1.832 18.364 594 HZ3 LYS 73 2HZ LYS 73 -10.433 -1.843 17.383 595 H PHE 74 H PHE 74 -14.034 -4.967 14.490 596 HA PHE 74 HA PHE 74 -16.778 -4.886 15.324 597 HB2 PHE 74 2HB PHE 74 -15.276 -3.355 13.642 598 HB3 PHE 74 3HB PHE 74 -16.176 -4.338 12.490 599 HD1 PHE 74 HD1 PHE 74 -16.483 -1.910 15.242 600 HD2 PHE 74 HD2 PHE 74 -18.491 -3.993 12.120 601 HE1 PHE 74 HE1 PHE 74 -18.432 -0.433 15.515 602 HE2 PHE 74 HE2 PHE 74 -20.443 -2.519 12.387 603 HZ PHE 74 HZ PHE 74 -20.415 -0.736 14.085 604 H GLY 75 H GLY 75 -14.818 -6.982 13.378 605 HA2 GLY 75 2HA GLY 75 -15.907 -9.271 13.256 606 HA3 GLY 75 3HA GLY 75 -17.238 -8.419 12.487 607 H SER 76 H SER 76 -16.126 -10.494 11.164 608 HA SER 76 HA SER 76 -14.142 -9.457 9.304 609 HB2 SER 76 2HB SER 76 -14.153 -11.747 8.371 610 HB3 SER 76 3HB SER 76 -13.867 -11.750 10.111 611 HG SER 76 HG SER 76 -15.459 -13.130 10.103 612 H SER 77 H SER 77 -14.478 -9.701 6.964 613 HA SER 77 HA SER 77 -17.005 -10.077 5.799 614 HB2 SER 77 2HB SER 77 -17.921 -7.977 5.571 615 HB3 SER 77 3HB SER 77 -17.149 -7.791 7.145 616 HG SER 77 HG SER 77 -16.754 -6.119 5.452 617 H LYS 78 H LYS 78 -16.956 -9.904 3.543 618 HA LYS 78 HA LYS 78 -14.556 -10.405 2.276 619 HB2 LYS 78 2HB LYS 78 -17.271 -9.610 1.373 620 HB3 LYS 78 3HB LYS 78 -15.965 -9.436 0.208 621 HG2 LYS 78 2HG LYS 78 -15.999 -12.005 1.613 622 HG3 LYS 78 3HG LYS 78 -17.412 -11.698 0.601 623 HD2 LYS 78 2HD LYS 78 -14.716 -11.128 -0.525 624 HD3 LYS 78 3HD LYS 78 -15.222 -12.813 -0.376 625 HE2 LYS 78 2HE LYS 78 -17.104 -10.851 -1.593 626 HE3 LYS 78 3HE LYS 78 -15.733 -11.412 -2.550 627 HZ1 LYS 78 3HZ LYS 78 -17.864 -12.715 -2.764 628 HZ2 LYS 78 1HZ LYS 78 -17.585 -13.282 -1.194 629 HZ3 LYS 78 2HZ LYS 78 -16.475 -13.619 -2.425 630 H GLU 79 H GLU 79 -16.137 -7.330 2.886 631 HA GLU 79 HA GLU 79 -14.519 -5.748 1.192 632 HB2 GLU 79 2HB GLU 79 -16.473 -5.283 3.343 633 HB3 GLU 79 3HB GLU 79 -15.257 -4.025 3.177 634 HG2 GLU 79 2HG GLU 79 -16.715 -3.182 1.699 635 HG3 GLU 79 3HG GLU 79 -15.956 -4.334 0.602 636 H ILE 80 H ILE 80 -14.243 -6.675 4.592 637 HA ILE 80 HA ILE 80 -11.937 -5.081 5.107 638 HB ILE 80 HB ILE 80 -12.967 -7.495 6.604 639 HG12 ILE 80 2HG1 ILE 80 -13.306 -4.598 7.362 640 HG13 ILE 80 3HG1 ILE 80 -14.478 -5.433 6.348 641 HG21 ILE 80 1HG2 ILE 80 -10.621 -7.044 7.085 642 HG22 ILE 80 2HG2 ILE 80 -11.008 -5.363 7.447 643 HG23 ILE 80 3HG2 ILE 80 -11.634 -6.652 8.475 644 HD11 ILE 80 3HD1 ILE 80 -13.669 -6.352 9.094 645 HD12 ILE 80 1HD1 ILE 80 -15.075 -5.343 8.753 646 HD13 ILE 80 2HD1 ILE 80 -14.982 -6.978 8.096 647 H ASP 81 H ASP 81 -12.383 -8.583 4.612 648 HA ASP 81 HA ASP 81 -9.745 -9.382 4.755 649 HB2 ASP 81 2HB ASP 81 -12.104 -10.630 4.193 650 HB3 ASP 81 3HB ASP 81 -11.299 -10.702 2.628 651 H MET 82 H MET 82 -11.483 -7.954 2.043 652 HA MET 82 HA MET 82 -9.376 -8.324 0.154 653 HB2 MET 82 2HB MET 82 -11.840 -6.589 0.182 654 HB3 MET 82 3HB MET 82 -10.695 -6.571 -1.152 655 HG2 MET 82 2HG MET 82 -11.122 -8.865 -1.644 656 HG3 MET 82 3HG MET 82 -12.090 -9.051 -0.183 657 HE1 MET 82 3HE MET 82 -14.201 -10.090 -2.159 658 HE2 MET 82 1HE MET 82 -14.172 -9.205 -3.684 659 HE3 MET 82 2HE MET 82 -12.685 -9.905 -3.043 660 H ALA 83 H ALA 83 -10.418 -5.644 2.216 661 HA ALA 83 HA ALA 83 -8.758 -3.640 1.261 662 HB1 ALA 83 1HB ALA 83 -9.276 -2.456 3.166 663 HB2 ALA 83 2HB ALA 83 -10.601 -3.618 3.106 664 HB3 ALA 83 3HB ALA 83 -9.241 -3.888 4.196 665 H ILE 84 H ILE 84 -8.074 -6.158 3.658 666 HA ILE 84 HA ILE 84 -5.452 -5.232 4.264 667 HB ILE 84 HB ILE 84 -6.517 -8.033 4.620 668 HG12 ILE 84 2HG1 ILE 84 -8.041 -6.410 5.647 669 HG13 ILE 84 3HG1 ILE 84 -7.176 -7.322 6.880 670 HG21 ILE 84 1HG2 ILE 84 -4.120 -7.874 4.891 671 HG22 ILE 84 2HG2 ILE 84 -4.307 -6.513 5.996 672 HG23 ILE 84 3HG2 ILE 84 -4.880 -8.113 6.464 673 HD11 ILE 84 3HD1 ILE 84 -6.480 -4.543 5.961 674 HD12 ILE 84 1HD1 ILE 84 -7.361 -4.949 7.433 675 HD13 ILE 84 2HD1 ILE 84 -5.681 -5.453 7.243 676 H VAL 85 H VAL 85 -6.608 -8.012 2.350 677 HA VAL 85 HA VAL 85 -4.165 -8.923 1.426 678 HB VAL 85 HB VAL 85 -6.792 -8.922 -0.068 679 HG11 VAL 85 1HG1 VAL 85 -4.140 -9.984 -0.705 680 HG12 VAL 85 2HG1 VAL 85 -5.444 -11.166 -0.835 681 HG13 VAL 85 3HG1 VAL 85 -5.518 -9.664 -1.757 682 HG21 VAL 85 3HG2 VAL 85 -7.475 -10.626 1.213 683 HG22 VAL 85 1HG2 VAL 85 -5.891 -11.399 1.182 684 HG23 VAL 85 2HG2 VAL 85 -6.221 -10.110 2.340 685 H THR 86 H THR 86 -6.234 -6.377 0.106 686 HA THR 86 HA THR 86 -4.749 -5.904 -2.243 687 HB THR 86 HB THR 86 -5.866 -3.656 -2.235 688 HG1 THR 86 HG1 THR 86 -6.362 -3.056 -0.246 689 HG21 THR 86 3HG2 THR 86 -7.041 -6.254 -2.447 690 HG22 THR 86 1HG2 THR 86 -7.447 -4.782 -3.328 691 HG23 THR 86 2HG2 THR 86 -8.233 -5.134 -1.789 692 H LEU 87 H LEU 87 -4.665 -4.339 0.947 693 HA LEU 87 HA LEU 87 -2.762 -2.388 0.401 694 HB2 LEU 87 2HB LEU 87 -3.902 -3.648 2.759 695 HB3 LEU 87 3HB LEU 87 -2.226 -3.159 3.000 696 HG LEU 87 HG LEU 87 -3.891 -1.474 3.744 697 HD11 LEU 87 1HD1 LEU 87 -2.686 0.379 2.949 698 HD12 LEU 87 2HD1 LEU 87 -2.288 -0.425 1.431 699 HD13 LEU 87 3HD1 LEU 87 -1.539 -0.961 2.935 700 HD21 LEU 87 3HD2 LEU 87 -5.620 -1.801 2.107 701 HD22 LEU 87 1HD2 LEU 87 -4.524 -1.357 0.799 702 HD23 LEU 87 2HD2 LEU 87 -5.024 -0.145 1.979 703 H LYS 88 H LYS 88 -2.370 -5.794 1.135 704 HA LYS 88 HA LYS 88 0.465 -5.671 1.498 705 HB2 LYS 88 2HB LYS 88 -1.595 -7.637 1.739 706 HB3 LYS 88 3HB LYS 88 -0.326 -8.286 0.709 707 HG2 LYS 88 2HG LYS 88 1.185 -8.378 2.391 708 HG3 LYS 88 3HG LYS 88 0.535 -6.952 3.204 709 HD2 LYS 88 2HD LYS 88 -1.268 -9.274 3.136 710 HD3 LYS 88 3HD LYS 88 0.210 -9.506 4.073 711 HE2 LYS 88 2HE LYS 88 -1.044 -6.925 4.561 712 HE3 LYS 88 3HE LYS 88 -2.105 -8.280 4.945 713 HZ1 LYS 88 3HZ LYS 88 -0.336 -7.315 6.652 714 HZ2 LYS 88 1HZ LYS 88 0.643 -8.466 5.891 715 HZ3 LYS 88 2HZ LYS 88 -0.795 -8.943 6.642 716 H VAL 89 H VAL 89 -1.454 -7.269 -1.053 717 HA VAL 89 HA VAL 89 0.586 -7.740 -2.843 718 HB VAL 89 HB VAL 89 -1.123 -7.747 -4.623 719 HG11 VAL 89 1HG1 VAL 89 -1.417 -9.179 -2.059 720 HG12 VAL 89 2HG1 VAL 89 -2.788 -9.272 -3.167 721 HG13 VAL 89 3HG1 VAL 89 -1.191 -9.806 -3.692 722 HG21 VAL 89 3HG2 VAL 89 -3.525 -7.358 -3.800 723 HG22 VAL 89 1HG2 VAL 89 -2.779 -6.454 -2.482 724 HG23 VAL 89 2HG2 VAL 89 -2.533 -5.943 -4.152 725 H PHE 90 H PHE 90 -1.231 -4.780 -2.309 726 HA PHE 90 HA PHE 90 -0.133 -3.419 -4.583 727 HB2 PHE 90 2HB PHE 90 -2.289 -2.710 -3.813 728 HB3 PHE 90 3HB PHE 90 -1.685 -2.457 -2.178 729 HD1 PHE 90 HD1 PHE 90 -0.340 -1.390 -5.483 730 HD2 PHE 90 HD2 PHE 90 -1.902 -0.214 -1.702 731 HE1 PHE 90 HE1 PHE 90 0.128 0.964 -6.025 732 HE2 PHE 90 HE2 PHE 90 -1.438 2.141 -2.238 733 HZ PHE 90 HZ PHE 90 -0.422 2.734 -4.403 734 H ALA 91 H ALA 91 0.674 -3.739 -1.197 735 HA ALA 91 HA ALA 91 2.484 -1.582 -1.007 736 HB1 ALA 91 1HB ALA 91 1.966 -2.306 1.078 737 HB2 ALA 91 2HB ALA 91 1.882 -3.999 0.590 738 HB3 ALA 91 3HB ALA 91 3.449 -3.234 0.852 739 H VAL 92 H VAL 92 3.082 -5.064 -1.501 740 HA VAL 92 HA VAL 92 5.870 -4.743 -1.948 741 HB VAL 92 HB VAL 92 4.153 -7.054 -2.856 742 HG11 VAL 92 1HG1 VAL 92 6.495 -8.139 -2.140 743 HG12 VAL 92 2HG1 VAL 92 6.161 -7.562 -3.774 744 HG13 VAL 92 3HG1 VAL 92 7.058 -6.546 -2.644 745 HG21 VAL 92 3HG2 VAL 92 4.844 -6.151 -0.179 746 HG22 VAL 92 1HG2 VAL 92 3.677 -7.368 -0.697 747 HG23 VAL 92 2HG2 VAL 92 5.374 -7.803 -0.497 748 H ALA 93 H ALA 93 3.212 -5.539 -4.192 749 HA ALA 93 HA ALA 93 4.750 -5.347 -6.538 750 HB1 ALA 93 1HB ALA 93 2.806 -5.722 -7.682 751 HB2 ALA 93 2HB ALA 93 2.339 -6.304 -6.084 752 HB3 ALA 93 3HB ALA 93 1.848 -4.696 -6.614 753 H GLY 94 H GLY 94 3.551 -2.933 -4.450 754 HA2 GLY 94 2HA GLY 94 3.620 -0.867 -6.526 755 HA3 GLY 94 3HA GLY 94 3.042 -0.660 -4.879 756 H LEU 95 H LEU 95 4.758 -0.848 -3.158 757 HA LEU 95 HA LEU 95 6.753 1.065 -3.599 758 HB2 LEU 95 2HB LEU 95 6.323 -0.979 -1.445 759 HB3 LEU 95 3HB LEU 95 7.713 0.104 -1.424 760 HG LEU 95 HG LEU 95 6.032 0.993 0.026 761 HD11 LEU 95 1HD1 LEU 95 5.899 2.592 -2.520 762 HD12 LEU 95 2HD1 LEU 95 7.315 2.547 -1.469 763 HD13 LEU 95 3HD1 LEU 95 5.786 3.181 -0.861 764 HD21 LEU 95 3HD2 LEU 95 4.074 1.241 -2.219 765 HD22 LEU 95 1HD2 LEU 95 3.794 1.255 -0.477 766 HD23 LEU 95 2HD2 LEU 95 4.177 -0.260 -1.296 767 H LEU 96 H LEU 96 6.951 -2.476 -3.445 768 HA LEU 96 HA LEU 96 9.771 -2.430 -4.121 769 HB2 LEU 96 2HB LEU 96 8.022 -4.238 -2.848 770 HB3 LEU 96 3HB LEU 96 8.605 -5.038 -4.306 771 HG LEU 96 HG LEU 96 10.884 -3.947 -3.120 772 HD11 LEU 96 1HD1 LEU 96 8.914 -4.904 -1.095 773 HD12 LEU 96 2HD1 LEU 96 10.052 -3.561 -1.011 774 HD13 LEU 96 3HD1 LEU 96 10.633 -5.219 -0.858 775 HD21 LEU 96 3HD2 LEU 96 11.104 -5.978 -4.199 776 HD22 LEU 96 1HD2 LEU 96 9.700 -6.678 -3.393 777 HD23 LEU 96 2HD2 LEU 96 11.206 -6.452 -2.503 778 H ASN 97 H ASN 97 7.013 -2.056 -5.847 779 HA ASN 97 HA ASN 97 6.404 -2.317 -8.027 780 HB2 ASN 97 2HB ASN 97 9.410 -2.171 -8.259 781 HB3 ASN 97 3HB ASN 97 8.349 -2.197 -9.664 782 HD21 ASN 97 1HD2 ASN 97 10.190 -0.158 -8.344 783 HD22 ASN 97 2HD2 ASN 97 9.227 1.275 -8.277 784 H MET 98 H MET 98 6.780 -4.747 -6.431 785 HA MET 98 HA MET 98 8.017 -6.783 -7.926 786 HB2 MET 98 2HB MET 98 6.471 -6.578 -5.530 787 HB3 MET 98 3HB MET 98 5.818 -7.886 -6.508 788 HG2 MET 98 2HG MET 98 8.727 -7.900 -6.345 789 HG3 MET 98 3HG MET 98 7.929 -8.074 -4.784 790 HE1 MET 98 3HE MET 98 8.222 -10.520 -8.397 791 HE2 MET 98 1HE MET 98 9.307 -9.355 -7.637 792 HE3 MET 98 2HE MET 98 9.362 -11.052 -7.160 793 H THR 99 H THR 99 6.340 -8.787 -8.431 794 HA THR 99 HA THR 99 4.173 -7.790 -10.122 795 HB THR 99 HB THR 99 4.924 -9.283 -11.995 796 HG1 THR 99 HG1 THR 99 6.616 -10.494 -11.654 797 HG21 THR 99 3HG2 THR 99 7.055 -7.244 -11.469 798 HG22 THR 99 1HG2 THR 99 5.386 -6.741 -11.734 799 HG23 THR 99 2HG2 THR 99 6.244 -7.644 -12.983 800 H VAL 100 H VAL 100 3.772 -9.047 -7.757 801 HA VAL 100 HA VAL 100 3.581 -11.873 -7.936 802 HB VAL 100 HB VAL 100 2.032 -11.651 -5.970 803 HG11 VAL 100 1HG1 VAL 100 4.822 -10.772 -6.143 804 HG12 VAL 100 2HG1 VAL 100 3.980 -10.249 -4.683 805 HG13 VAL 100 3HG1 VAL 100 4.069 -11.964 -5.084 806 HG21 VAL 100 3HG2 VAL 100 1.863 -8.982 -6.914 807 HG22 VAL 100 1HG2 VAL 100 1.034 -9.715 -5.541 808 HG23 VAL 100 2HG2 VAL 100 2.603 -8.943 -5.314 809 H SER 101 H SER 101 1.657 -13.156 -8.054 810 HA SER 101 HA SER 101 -0.530 -11.867 -9.553 811 HB2 SER 101 2HB SER 101 0.848 -14.502 -10.027 812 HB3 SER 101 3HB SER 101 -0.786 -14.206 -10.621 813 HG SER 101 HG SER 101 0.142 -12.282 -11.641 814 H THR 102 H THR 102 0.265 -13.281 -6.716 815 HA THR 102 HA THR 102 -2.516 -13.978 -6.168 816 HB THR 102 HB THR 102 -2.051 -16.092 -5.183 817 HG1 THR 102 HG1 THR 102 -0.079 -16.712 -4.603 818 HG21 THR 102 3HG2 THR 102 -2.245 -16.105 -7.638 819 HG22 THR 102 1HG2 THR 102 -1.193 -17.394 -7.055 820 HG23 THR 102 2HG2 THR 102 -0.494 -15.940 -7.768 821 H ALA 103 H ALA 103 -3.148 -13.614 -4.068 822 HA ALA 103 HA ALA 103 -1.862 -11.694 -2.563 823 HB1 ALA 103 1HB ALA 103 -4.182 -12.154 -2.212 824 HB2 ALA 103 2HB ALA 103 -3.829 -13.798 -1.678 825 HB3 ALA 103 3HB ALA 103 -3.334 -12.425 -0.689 826 H ALA 104 H ALA 104 -1.515 -15.188 -2.447 827 HA ALA 104 HA ALA 104 -0.087 -15.374 -0.029 828 HB1 ALA 104 1HB ALA 104 -0.294 -17.133 -2.445 829 HB2 ALA 104 2HB ALA 104 0.800 -17.532 -1.120 830 HB3 ALA 104 3HB ALA 104 -0.932 -17.390 -0.821 831 H ALA 105 H ALA 105 1.054 -15.147 -3.393 832 HA ALA 105 HA ALA 105 3.796 -15.237 -2.857 833 HB1 ALA 105 1HB ALA 105 4.131 -14.594 -5.063 834 HB2 ALA 105 2HB ALA 105 2.539 -15.354 -5.107 835 HB3 ALA 105 3HB ALA 105 2.677 -13.596 -5.097 836 H ALA 106 H ALA 106 1.524 -12.548 -2.831 837 HA ALA 106 HA ALA 106 3.378 -10.446 -2.674 838 HB1 ALA 106 1HB ALA 106 0.546 -10.665 -1.673 839 HB2 ALA 106 2HB ALA 106 1.481 -9.169 -1.652 840 HB3 ALA 106 3HB ALA 106 1.105 -9.952 -3.186 841 H GLU 107 H GLU 107 1.602 -12.108 -0.064 842 HA GLU 107 HA GLU 107 2.948 -10.755 2.030 843 HB2 GLU 107 2HB GLU 107 0.718 -11.962 2.167 844 HB3 GLU 107 3HB GLU 107 1.632 -13.462 2.231 845 HG2 GLU 107 2HG GLU 107 2.727 -12.734 4.271 846 HG3 GLU 107 3HG GLU 107 1.867 -11.197 4.199 847 H ASN 108 H ASN 108 3.517 -13.798 0.353 848 HA ASN 108 HA ASN 108 5.425 -14.925 2.028 849 HB2 ASN 108 2HB ASN 108 4.412 -16.075 0.082 850 HB3 ASN 108 3HB ASN 108 5.357 -15.051 -0.995 851 HD21 ASN 108 1HD2 ASN 108 5.877 -17.404 -1.605 852 HD22 ASN 108 2HD2 ASN 108 7.298 -18.062 -0.874 853 H MET 109 H MET 109 5.843 -12.591 -0.608 854 HA MET 109 HA MET 109 8.679 -12.468 -0.375 855 HB2 MET 109 2HB MET 109 6.627 -11.280 -2.023 856 HB3 MET 109 3HB MET 109 7.789 -10.062 -1.514 857 HG2 MET 109 2HG MET 109 8.534 -12.668 -2.815 858 HG3 MET 109 3HG MET 109 8.319 -11.148 -3.680 859 HE1 MET 109 3HE MET 109 9.201 -9.058 -2.629 860 HE2 MET 109 1HE MET 109 10.365 -9.024 -1.304 861 HE3 MET 109 2HE MET 109 10.927 -8.928 -2.973 862 H TYR 110 H TYR 110 6.037 -10.382 0.757 863 HA TYR 110 HA TYR 110 7.566 -8.368 1.914 864 HB2 TYR 110 2HB TYR 110 4.962 -8.654 1.606 865 HB3 TYR 110 3HB TYR 110 5.047 -9.264 3.255 866 HD1 TYR 110 HD2 TYR 110 6.390 -6.376 1.287 867 HD2 TYR 110 HD1 TYR 110 4.653 -7.734 4.927 868 HE1 TYR 110 HE2 TYR 110 6.378 -4.068 2.136 869 HE2 TYR 110 HE1 TYR 110 4.636 -5.429 5.785 870 HH TYR 110 HH TYR 110 6.203 -3.210 5.132 871 H SER 111 H SER 111 6.770 -11.563 3.084 872 HA SER 111 HA SER 111 7.801 -11.030 5.740 873 HB2 SER 111 2HB SER 111 6.958 -13.671 4.527 874 HB3 SER 111 3HB SER 111 7.202 -13.327 6.239 875 HG SER 111 HG SER 111 5.190 -12.755 6.256 876 H GLN 112 H GLN 112 8.697 -13.043 2.951 877 HA GLN 112 HA GLN 112 11.032 -14.143 4.004 878 HB2 GLN 112 2HB GLN 112 9.872 -14.821 1.876 879 HB3 GLN 112 3HB GLN 112 10.589 -13.410 1.108 880 HG2 GLN 112 2HG GLN 112 11.861 -15.414 0.616 881 HG3 GLN 112 3HG GLN 112 12.816 -14.277 1.567 882 HE21 GLN 112 1HE2 GLN 112 10.597 -17.005 2.043 883 HE22 GLN 112 2HE2 GLN 112 11.501 -17.739 3.319 884 H MET 113 H MET 113 10.396 -10.977 2.725 885 HA MET 113 HA MET 113 13.177 -10.282 2.411 886 HB2 MET 113 2HB MET 113 11.073 -9.326 1.170 887 HB3 MET 113 3HB MET 113 10.981 -8.252 2.560 888 HG2 MET 113 2HG MET 113 13.615 -8.488 1.252 889 HG3 MET 113 3HG MET 113 12.345 -7.677 0.338 890 HE1 MET 113 3HE MET 113 14.140 -6.052 0.250 891 HE2 MET 113 1HE MET 113 13.838 -4.554 1.131 892 HE3 MET 113 2HE MET 113 15.116 -5.647 1.663 893 H GLY 114 H GLY 114 10.758 -10.093 4.897 894 HA2 GLY 114 2HA GLY 114 11.386 -9.885 7.194 895 HA3 GLY 114 3HA GLY 114 12.778 -8.937 6.693 896 H LEU 115 H LEU 115 9.736 -8.237 5.229 897 HA LEU 115 HA LEU 115 9.709 -5.649 6.578 898 HB2 LEU 115 2HB LEU 115 8.025 -6.615 4.274 899 HB3 LEU 115 3HB LEU 115 8.163 -4.957 4.854 900 HG LEU 115 HG LEU 115 10.580 -6.397 3.833 901 HD11 LEU 115 1HD1 LEU 115 10.136 -5.727 1.598 902 HD12 LEU 115 2HD1 LEU 115 8.683 -4.853 2.079 903 HD13 LEU 115 3HD1 LEU 115 8.720 -6.614 2.163 904 HD21 LEU 115 3HD2 LEU 115 10.068 -3.859 4.879 905 HD22 LEU 115 1HD2 LEU 115 10.265 -3.620 3.143 906 HD23 LEU 115 2HD2 LEU 115 11.538 -4.408 4.075 907 H ASP 116 H ASP 116 7.726 -8.521 6.150 908 HA ASP 116 HA ASP 116 5.382 -7.543 7.376 909 HB2 ASP 116 2HB ASP 116 6.003 -9.819 6.050 910 HB3 ASP 116 3HB ASP 116 6.004 -10.417 7.707 911 H THR 117 H THR 117 4.647 -9.125 9.400 912 HA THR 117 HA THR 117 6.647 -9.336 11.445 913 HB THR 117 HB THR 117 4.940 -7.706 12.845 914 HG1 THR 117 HG1 THR 117 3.915 -6.649 11.285 915 HG21 THR 117 3HG2 THR 117 7.541 -7.847 12.598 916 HG22 THR 117 1HG2 THR 117 6.787 -6.353 13.154 917 HG23 THR 117 2HG2 THR 117 7.311 -6.506 11.477 918 H ARG 118 H ARG 118 3.166 -9.053 10.794 919 HA ARG 118 HA ARG 118 2.731 -11.313 12.636 920 HB2 ARG 118 2HB ARG 118 1.745 -8.982 13.208 921 HB3 ARG 118 3HB ARG 118 0.590 -9.328 11.928 922 HG2 ARG 118 2HG ARG 118 -0.495 -10.008 13.865 923 HG3 ARG 118 3HG ARG 118 0.138 -11.511 13.189 924 HD2 ARG 118 2HD ARG 118 2.099 -11.293 14.703 925 HD3 ARG 118 3HD ARG 118 1.325 -9.888 15.436 926 HE ARG 118 HE ARG 118 -0.464 -12.042 15.522 927 HH11 ARG 118 1HH1 ARG 118 2.567 -11.040 16.912 928 HH12 ARG 118 2HH1 ARG 118 2.334 -11.924 18.384 929 HH21 ARG 118 1HH2 ARG 118 -0.782 -13.210 17.455 930 HH22 ARG 118 2HH2 ARG 118 0.429 -13.159 18.691 931 HA PRO 119 HA PRO 119 1.562 -12.593 8.313 932 HB2 PRO 119 2HB PRO 119 2.862 -14.975 8.407 933 HB3 PRO 119 3HB PRO 119 3.647 -13.472 7.909 934 HG2 PRO 119 2HG PRO 119 3.721 -14.858 10.561 935 HG3 PRO 119 3HG PRO 119 5.044 -14.098 9.659 936 HD2 PRO 119 2HD PRO 119 3.805 -12.876 11.732 937 HD3 PRO 119 3HD PRO 119 4.467 -11.977 10.352 938 H SER 120 H SER 120 0.872 -15.085 7.813 939 HA SER 120 HA SER 120 -0.713 -16.110 10.049 940 HB2 SER 120 2HB SER 120 -2.125 -16.002 7.442 941 HB3 SER 120 3HB SER 120 -2.759 -15.825 9.077 942 HG SER 120 HG SER 120 -1.193 -13.864 7.754 943 H MET 121 H MET 121 -2.086 -18.095 8.903 944 HA MET 121 HA MET 121 0.008 -19.940 8.143 945 HB2 MET 121 2HB MET 121 -2.765 -20.131 9.130 946 HB3 MET 121 3HB MET 121 -2.280 -21.405 8.018 947 HG2 MET 121 2HG MET 121 -1.421 -22.446 9.773 948 HG3 MET 121 3HG MET 121 -0.152 -21.223 9.762 949 HE1 MET 121 3HE MET 121 -2.494 -22.661 12.793 950 HE2 MET 121 1HE MET 121 -3.846 -21.702 12.189 951 HE3 MET 121 2HE MET 121 -3.001 -22.812 11.110 952 H LYS 122 H LYS 122 -0.409 -21.516 6.348 953 HA LYS 122 HA LYS 122 -0.715 -20.127 3.905 954 HB2 LYS 122 2HB LYS 122 -0.217 -22.929 4.732 955 HB3 LYS 122 3HB LYS 122 -0.892 -22.701 3.124 956 HG2 LYS 122 2HG LYS 122 0.962 -21.267 2.516 957 HG3 LYS 122 3HG LYS 122 1.624 -21.398 4.147 958 HD2 LYS 122 2HD LYS 122 2.368 -23.532 3.821 959 HD3 LYS 122 3HD LYS 122 1.094 -23.916 2.661 960 HE2 LYS 122 2HE LYS 122 2.514 -23.535 0.998 961 HE3 LYS 122 3HE LYS 122 2.679 -21.863 1.531 962 HZ1 LYS 122 3HZ LYS 122 4.801 -22.395 1.879 963 HZ2 LYS 122 1HZ LYS 122 4.509 -24.060 1.806 964 HZ3 LYS 122 2HZ LYS 122 4.265 -23.222 3.254 965 H GLU 123 H GLU 123 -2.915 -21.927 5.908 966 HA GLU 123 HA GLU 123 -5.162 -22.263 5.804 967 HB2 GLU 123 2HB GLU 123 -4.693 -19.793 4.369 968 HB3 GLU 123 3HB GLU 123 -6.069 -20.657 3.697 969 HG2 GLU 123 2HG GLU 123 -7.211 -19.573 5.286 970 HG3 GLU 123 3HG GLU 123 -6.611 -20.862 6.329 971 H ALA 124 H ALA 124 -6.991 -22.871 4.208 972 HA ALA 124 HA ALA 124 -6.194 -23.921 1.663 973 HB1 ALA 124 1HB ALA 124 -7.152 -26.246 2.946 974 HB2 ALA 124 2HB ALA 124 -5.554 -25.960 2.255 975 HB3 ALA 124 3HB ALA 124 -5.861 -25.588 3.952 976 H GLY 125 H GLY 125 -7.914 -23.776 0.381 977 HA2 GLY 125 2HA GLY 125 -10.536 -24.586 1.277 978 HA3 GLY 125 3HA GLY 125 -10.380 -22.854 1.026 979 H GLY 126 H GLY 126 -9.219 -25.732 -0.738 980 HA2 GLY 126 2HA GLY 126 -10.927 -25.672 -2.887 981 HA3 GLY 126 3HA GLY 126 -9.688 -24.486 -3.273 982 H LYS 127 H LYS 127 -9.953 -26.556 -4.954 983 HA LYS 127 HA LYS 127 -7.878 -28.499 -4.219 984 HB2 LYS 127 2HB LYS 127 -9.851 -28.551 -6.510 985 HB3 LYS 127 3HB LYS 127 -8.700 -29.822 -6.122 986 HG2 LYS 127 2HG LYS 127 -9.814 -30.192 -3.985 987 HG3 LYS 127 3HG LYS 127 -10.961 -28.903 -4.357 988 HD2 LYS 127 2HD LYS 127 -12.251 -30.433 -5.332 989 HD3 LYS 127 3HD LYS 127 -11.009 -30.610 -6.573 990 HE2 LYS 127 2HE LYS 127 -10.884 -32.103 -3.970 991 HE3 LYS 127 3HE LYS 127 -11.781 -32.722 -5.355 992 HZ1 LYS 127 3HZ LYS 127 -9.678 -33.683 -5.519 993 HZ2 LYS 127 1HZ LYS 127 -8.872 -32.251 -5.117 994 HZ3 LYS 127 2HZ LYS 127 -9.621 -32.405 -6.625 995 H GLU 128 H GLU 128 -6.673 -29.274 -6.353 996 HA GLU 128 HA GLU 128 -5.244 -26.931 -7.283 997 HB2 GLU 128 2HB GLU 128 -4.639 -29.702 -6.887 998 HB3 GLU 128 3HB GLU 128 -4.275 -29.274 -8.553 999 HG2 GLU 128 2HG GLU 128 -3.185 -27.178 -7.217 1000 HG3 GLU 128 3HG GLU 128 -2.942 -28.492 -6.067 1001 H GLU 129 H GLU 129 -6.037 -25.844 -8.959 1002 HA GLU 129 HA GLU 129 -6.804 -27.342 -11.356 1003 HB2 GLU 129 2HB GLU 129 -8.757 -25.903 -11.711 1004 HB3 GLU 129 3HB GLU 129 -8.897 -26.814 -10.214 1005 HG2 GLU 129 2HG GLU 129 -7.778 -24.577 -9.263 1006 HG3 GLU 129 3HG GLU 129 -8.633 -23.911 -10.653 1007 H GLY 130 H GLY 130 -6.137 -26.439 -13.237 1008 HA2 GLY 130 2HA GLY 130 -4.318 -24.204 -13.056 1009 HA3 GLY 130 3HA GLY 130 -4.667 -25.155 -14.493 1010 HA PRO 131 HA PRO 131 -6.601 -20.928 -14.902 1011 HB2 PRO 131 2HB PRO 131 -5.489 -20.368 -17.315 1012 HB3 PRO 131 3HB PRO 131 -4.691 -20.002 -15.781 1013 HG2 PRO 131 2HG PRO 131 -4.264 -22.314 -17.633 1014 HG3 PRO 131 3HG PRO 131 -3.063 -21.329 -16.778 1015 HD2 PRO 131 2HD PRO 131 -3.829 -23.775 -15.906 1016 HD3 PRO 131 3HD PRO 131 -3.350 -22.474 -14.798 1017 HA PRO 132 HA PRO 132 -9.829 -22.204 -17.602 1018 HB2 PRO 132 2HB PRO 132 -10.488 -19.903 -18.881 1019 HB3 PRO 132 3HB PRO 132 -10.861 -20.196 -17.178 1020 HG2 PRO 132 2HG PRO 132 -8.608 -18.635 -18.383 1021 HG3 PRO 132 3HG PRO 132 -9.631 -18.231 -16.992 1022 HD2 PRO 132 2HD PRO 132 -7.135 -19.244 -16.719 1023 HD3 PRO 132 3HD PRO 132 -8.435 -19.585 -15.560 1024 H GLN 133 H GLN 133 -7.580 -20.018 -19.306 1025 HA GLN 133 HA GLN 133 -6.611 -20.129 -21.360 1026 HB2 GLN 133 2HB GLN 133 -7.337 -23.057 -21.375 1027 HB3 GLN 133 3HB GLN 133 -6.035 -22.269 -22.255 1028 HG2 GLN 133 2HG GLN 133 -4.894 -21.790 -20.155 1029 HG3 GLN 133 3HG GLN 133 -6.204 -22.565 -19.265 1030 HE21 GLN 133 1HE2 GLN 133 -3.244 -23.121 -19.694 1031 HE22 GLN 133 2HE2 GLN 133 -3.195 -24.800 -20.097 1032 H ALA 134 H ALA 134 -8.298 -18.824 -22.221 1033 HA ALA 134 HA ALA 134 -10.046 -20.298 -24.075 1034 HB1 ALA 134 1HB ALA 134 -10.926 -17.745 -22.770 1035 HB2 ALA 134 2HB ALA 134 -11.899 -18.957 -23.604 1036 HB3 ALA 134 3HB ALA 134 -11.215 -19.314 -22.018 1037 H TYR 135 H TYR 135 -11.066 -18.517 -25.646 1038 HA TYR 135 HA TYR 135 -8.983 -16.621 -26.454 1039 HB2 TYR 135 2HB TYR 135 -10.327 -18.474 -28.425 1040 HB3 TYR 135 3HB TYR 135 -9.007 -17.352 -28.738 1041 HD1 TYR 135 HD2 TYR 135 -6.752 -17.816 -27.709 1042 HD2 TYR 135 HD1 TYR 135 -9.904 -20.674 -27.684 1043 HE1 TYR 135 HE2 TYR 135 -5.122 -19.602 -27.257 1044 HE2 TYR 135 HE1 TYR 135 -8.283 -22.467 -27.231 1045 HH TYR 135 HH TYR 135 -5.370 -22.060 -26.062 Start of MODEL 8 1 H21 MYR 1 1H2 MYR 1 3.773 11.870 7.200 2 H22 MYR 1 2H2 MYR 1 5.440 11.541 7.631 3 H31 MYR 1 1H3 MYR 1 4.663 9.319 7.354 4 H32 MYR 1 2H3 MYR 1 5.242 9.621 5.715 5 H41 MYR 1 1H4 MYR 1 2.988 10.097 4.884 6 H42 MYR 1 2H4 MYR 1 2.326 10.240 6.514 7 H51 MYR 1 1H5 MYR 1 1.714 8.041 5.458 8 H52 MYR 1 2H5 MYR 1 2.648 7.812 6.938 9 H61 MYR 1 1H6 MYR 1 4.658 7.200 5.739 10 H62 MYR 1 2H6 MYR 1 4.096 7.918 4.228 11 H71 MYR 1 1H7 MYR 1 2.126 6.100 4.387 12 H72 MYR 1 2H7 MYR 1 3.190 5.290 5.539 13 H81 MYR 1 1H8 MYR 1 4.937 4.951 3.891 14 H82 MYR 1 2H8 MYR 1 4.279 6.172 2.799 15 H91 MYR 1 1H9 MYR 1 2.458 3.826 3.464 16 H92 MYR 1 2H9 MYR 1 3.868 3.464 2.469 17 H101 MYR 1 1H10 MYR 1 2.988 5.744 1.178 18 H102 MYR 1 2H10 MYR 1 1.444 5.188 1.805 19 H111 MYR 1 1H11 MYR 1 3.379 3.633 -0.042 20 H112 MYR 1 2H11 MYR 1 1.833 4.340 -0.481 21 H121 MYR 1 1H12 MYR 1 0.931 2.692 1.524 22 H122 MYR 1 2H12 MYR 1 2.369 1.780 1.067 23 H131 MYR 1 1H13 MYR 1 1.351 2.308 -1.462 24 H132 MYR 1 2H13 MYR 1 -0.152 2.314 -0.538 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 6.985 12.593 6.350 29 HA2 GLY 2 2HA GLY 2 7.162 13.008 3.706 30 HA3 GLY 2 3HA GLY 2 5.999 14.241 4.172 31 H ASN 3 H ASN 3 9.164 13.742 3.546 32 HA ASN 3 HA ASN 3 11.086 14.896 3.932 33 HB2 ASN 3 2HB ASN 3 9.370 16.757 3.337 34 HB3 ASN 3 3HB ASN 3 9.452 17.156 5.050 35 HD21 ASN 3 1HD2 ASN 3 10.212 18.900 3.014 36 HD22 ASN 3 2HD2 ASN 3 11.913 19.176 3.134 37 H GLY 4 H GLY 4 11.712 13.440 5.609 38 HA2 GLY 4 2HA GLY 4 12.641 14.566 7.929 39 HA3 GLY 4 3HA GLY 4 11.044 13.965 8.347 40 H ALA 5 H ALA 5 10.840 11.888 8.914 41 HA ALA 5 HA ALA 5 13.169 10.135 8.487 42 HB1 ALA 5 1HB ALA 5 11.213 10.316 10.756 43 HB2 ALA 5 2HB ALA 5 12.207 8.882 10.496 44 HB3 ALA 5 3HB ALA 5 12.972 10.442 10.799 45 H SER 6 H SER 6 9.637 9.953 8.966 46 HA SER 6 HA SER 6 8.049 8.584 8.082 47 HB2 SER 6 2HB SER 6 9.959 8.200 5.770 48 HB3 SER 6 3HB SER 6 8.202 8.051 5.747 49 HG SER 6 HG SER 6 8.045 10.136 5.524 50 H ARG 7 H ARG 7 9.037 7.237 9.964 51 HA ARG 7 HA ARG 7 10.632 4.996 9.468 52 HB2 ARG 7 2HB ARG 7 9.660 4.083 11.557 53 HB3 ARG 7 3HB ARG 7 10.199 5.748 11.725 54 HG2 ARG 7 2HG ARG 7 7.651 6.204 11.087 55 HG3 ARG 7 3HG ARG 7 7.474 4.613 11.831 56 HD2 ARG 7 2HD ARG 7 8.651 7.099 13.060 57 HD3 ARG 7 3HD ARG 7 7.171 6.264 13.533 58 HE ARG 7 HE ARG 7 9.846 5.604 14.309 59 HH11 ARG 7 1HH1 ARG 7 6.662 4.315 13.743 60 HH12 ARG 7 2HH1 ARG 7 6.878 2.964 14.806 61 HH21 ARG 7 1HH2 ARG 7 10.143 3.830 15.711 62 HH22 ARG 7 2HH2 ARG 7 8.858 2.690 15.926 63 H ASP 8 H ASP 8 7.167 5.487 9.135 64 HA ASP 8 HA ASP 8 6.400 2.808 8.790 65 HB2 ASP 8 2HB ASP 8 4.901 4.845 9.138 66 HB3 ASP 8 3HB ASP 8 5.086 5.148 7.413 67 H TRP 9 H TRP 9 7.711 5.175 6.555 68 HA TRP 9 HA TRP 9 7.248 3.564 4.222 69 HB2 TRP 9 2HB TRP 9 7.327 5.965 3.967 70 HB3 TRP 9 3HB TRP 9 8.939 6.030 4.672 71 HD1 TRP 9 HD1 TRP 9 10.990 5.439 3.107 72 HE1 TRP 9 HE1 TRP 9 11.219 5.148 0.560 73 HE3 TRP 9 HE3 TRP 9 6.039 5.093 1.882 74 HZ2 TRP 9 HZ2 TRP 9 9.525 4.817 -1.673 75 HZ3 TRP 9 HZ3 TRP 9 5.428 4.790 -0.482 76 HH2 TRP 9 HH2 TRP 9 7.136 4.656 -2.221 77 H LYS 10 H LYS 10 10.154 4.505 6.058 78 HA LYS 10 HA LYS 10 12.014 3.012 4.628 79 HB2 LYS 10 2HB LYS 10 12.551 4.721 6.359 80 HB3 LYS 10 3HB LYS 10 12.059 3.574 7.598 81 HG2 LYS 10 2HG LYS 10 13.825 2.020 6.705 82 HG3 LYS 10 3HG LYS 10 14.395 3.369 5.720 83 HD2 LYS 10 2HD LYS 10 14.923 4.660 7.647 84 HD3 LYS 10 3HD LYS 10 14.087 3.528 8.713 85 HE2 LYS 10 2HE LYS 10 16.318 2.495 7.041 86 HE3 LYS 10 3HE LYS 10 16.722 3.505 8.428 87 HZ1 LYS 10 3HZ LYS 10 15.301 0.910 8.409 88 HZ2 LYS 10 1HZ LYS 10 15.243 1.950 9.742 89 HZ3 LYS 10 2HZ LYS 10 16.725 1.321 9.224 90 H MET 11 H MET 11 9.942 2.065 7.329 91 HA MET 11 HA MET 11 11.067 -0.535 7.625 92 HB2 MET 11 2HB MET 11 9.776 0.693 9.392 93 HB3 MET 11 3HB MET 11 8.315 0.390 8.462 94 HG2 MET 11 2HG MET 11 8.105 -1.472 9.643 95 HG3 MET 11 3HG MET 11 9.447 -2.107 8.694 96 HE1 MET 11 3HE MET 11 9.519 -3.538 11.886 97 HE2 MET 11 1HE MET 11 9.888 -3.728 10.171 98 HE3 MET 11 2HE MET 11 11.197 -3.550 11.340 99 H ALA 12 H ALA 12 8.137 0.695 6.034 100 HA ALA 12 HA ALA 12 7.022 -1.682 5.186 101 HB1 ALA 12 1HB ALA 12 5.947 -0.401 3.414 102 HB2 ALA 12 2HB ALA 12 5.934 0.494 4.934 103 HB3 ALA 12 3HB ALA 12 7.084 0.924 3.668 104 H ILE 13 H ILE 13 9.690 0.135 3.775 105 HA ILE 13 HA ILE 13 9.883 -1.581 1.468 106 HB ILE 13 HB ILE 13 11.814 0.500 2.500 107 HG12 ILE 13 2HG1 ILE 13 9.594 1.399 1.874 108 HG13 ILE 13 3HG1 ILE 13 10.866 1.955 0.792 109 HG21 ILE 13 1HG2 ILE 13 13.236 -0.388 1.034 110 HG22 ILE 13 2HG2 ILE 13 11.994 -1.442 0.360 111 HG23 ILE 13 3HG2 ILE 13 12.163 0.210 -0.232 112 HD11 ILE 13 3HD1 ILE 13 9.716 -0.454 -0.231 113 HD13 ILE 13 1HD1 ILE 13 8.448 0.720 0.117 114 H LYS 14 H LYS 14 11.500 -1.242 4.573 115 HA LYS 14 HA LYS 14 13.690 -2.918 4.128 116 HB2 LYS 14 2HB LYS 14 13.547 -1.514 6.100 117 HB3 LYS 14 3HB LYS 14 12.136 -2.397 6.667 118 HG2 LYS 14 2HG LYS 14 13.363 -4.175 7.389 119 HG3 LYS 14 3HG LYS 14 14.634 -3.926 6.190 120 HD2 LYS 14 2HD LYS 14 15.841 -2.713 7.619 121 HD3 LYS 14 3HD LYS 14 14.459 -1.685 8.005 122 HE2 LYS 14 2HE LYS 14 14.916 -4.419 9.189 123 HE3 LYS 14 3HE LYS 14 15.424 -2.915 9.957 124 HZ1 LYS 14 3HZ LYS 14 12.615 -3.364 9.154 125 HZ2 LYS 14 1HZ LYS 14 13.229 -2.250 10.271 126 HZ3 LYS 14 2HZ LYS 14 13.200 -3.898 10.649 127 H ARG 15 H ARG 15 10.343 -3.648 4.763 128 HA ARG 15 HA ARG 15 10.897 -6.466 5.227 129 HB2 ARG 15 2HB ARG 15 8.219 -5.086 4.993 130 HB3 ARG 15 3HB ARG 15 8.529 -6.689 5.646 131 HG2 ARG 15 2HG ARG 15 10.128 -5.146 7.215 132 HG3 ARG 15 3HG ARG 15 8.771 -4.061 6.906 133 HD2 ARG 15 2HD ARG 15 7.295 -5.362 8.045 134 HD3 ARG 15 3HD ARG 15 8.122 -6.860 7.620 135 HE ARG 15 HE ARG 15 8.563 -5.238 9.948 136 HH11 ARG 15 1HH1 ARG 15 9.978 -7.562 7.776 137 HH12 ARG 15 2HH1 ARG 15 11.131 -8.137 8.934 138 HH21 ARG 15 1HH2 ARG 15 10.076 -5.987 11.481 139 HH22 ARG 15 2HH2 ARG 15 11.185 -7.241 11.042 140 H CYS 16 H CYS 16 8.906 -4.578 2.943 141 HA CYS 16 HA CYS 16 8.275 -6.656 1.211 142 HB2 CYS 16 2HB CYS 16 7.484 -4.150 1.301 143 HB3 CYS 16 3HB CYS 16 8.776 -3.909 0.132 144 HG CYS 16 HG CYS 16 7.573 -6.159 -1.429 145 H SER 17 H SER 17 11.228 -4.894 1.592 146 HA SER 17 HA SER 17 12.446 -5.180 -0.867 147 HB2 SER 17 2HB SER 17 13.778 -3.967 0.551 148 HB3 SER 17 3HB SER 17 13.424 -4.998 1.937 149 HG SER 17 HG SER 17 15.400 -5.224 0.009 150 H ASN 18 H ASN 18 11.832 -7.586 1.579 151 HA ASN 18 HA ASN 18 13.452 -9.569 0.175 152 HB2 ASN 18 2HB ASN 18 11.959 -9.650 2.801 153 HB3 ASN 18 3HB ASN 18 12.775 -11.048 2.108 154 HD21 ASN 18 1HD2 ASN 18 13.104 -8.809 4.370 155 HD22 ASN 18 2HD2 ASN 18 14.821 -8.616 4.395 156 H VAL 19 H VAL 19 11.204 -8.584 -1.217 157 HA VAL 19 HA VAL 19 9.180 -10.681 -1.018 158 HB VAL 19 HB VAL 19 8.470 -8.310 -1.261 159 HG11 VAL 19 1HG1 VAL 19 10.330 -7.637 -2.763 160 HG12 VAL 19 2HG1 VAL 19 9.554 -8.542 -4.065 161 HG13 VAL 19 3HG1 VAL 19 8.739 -7.151 -3.349 162 HG21 VAL 19 3HG2 VAL 19 7.702 -10.194 -3.488 163 HG22 VAL 19 1HG2 VAL 19 6.944 -10.059 -1.901 164 HG23 VAL 19 2HG2 VAL 19 6.811 -8.734 -3.057 165 H ALA 20 H ALA 20 8.850 -12.232 -2.532 166 HA ALA 20 HA ALA 20 10.745 -12.309 -4.789 167 HB1 ALA 20 1HB ALA 20 10.815 -14.067 -2.837 168 HB2 ALA 20 2HB ALA 20 9.493 -14.801 -3.745 169 HB3 ALA 20 3HB ALA 20 11.063 -14.561 -4.512 170 H VAL 21 H VAL 21 10.007 -13.070 -6.795 171 HA VAL 21 HA VAL 21 7.443 -12.269 -7.559 172 HB VAL 21 HB VAL 21 9.265 -14.219 -8.976 173 HG11 VAL 21 1HG1 VAL 21 6.810 -12.725 -9.844 174 HG12 VAL 21 2HG1 VAL 21 8.015 -13.287 -11.003 175 HG13 VAL 21 3HG1 VAL 21 7.162 -14.447 -9.984 176 HG21 VAL 21 3HG2 VAL 21 10.216 -12.381 -10.106 177 HG22 VAL 21 1HG2 VAL 21 8.978 -11.274 -9.512 178 HG23 VAL 21 2HG2 VAL 21 10.187 -11.921 -8.404 179 H GLY 22 H GLY 22 8.645 -15.359 -6.441 180 HA2 GLY 22 2HA GLY 22 5.934 -16.299 -6.077 181 HA3 GLY 22 3HA GLY 22 6.851 -17.198 -7.276 182 H VAL 23 H VAL 23 6.031 -18.721 -5.343 183 HA VAL 23 HA VAL 23 7.797 -18.773 -3.072 184 HB VAL 23 HB VAL 23 5.913 -20.945 -3.994 185 HG11 VAL 23 1HG1 VAL 23 7.078 -20.326 -1.281 186 HG12 VAL 23 2HG1 VAL 23 5.946 -21.628 -1.651 187 HG13 VAL 23 3HG1 VAL 23 7.570 -21.648 -2.339 188 HG21 VAL 23 3HG2 VAL 23 5.361 -18.670 -2.090 189 HG22 VAL 23 1HG2 VAL 23 4.741 -18.796 -3.737 190 HG23 VAL 23 2HG2 VAL 23 4.251 -19.972 -2.518 191 H GLY 24 H GLY 24 7.656 -20.270 -6.216 192 HA2 GLY 24 2HA GLY 24 10.289 -21.449 -5.723 193 HA3 GLY 24 3HA GLY 24 9.003 -22.528 -6.241 194 H GLY 25 H GLY 25 11.388 -20.300 -7.221 195 HA2 GLY 25 2HA GLY 25 11.387 -21.007 -9.887 196 HA3 GLY 25 3HA GLY 25 10.308 -19.625 -9.775 197 H LYS 26 H LYS 26 13.588 -20.703 -8.970 198 HA LYS 26 HA LYS 26 15.582 -19.609 -8.924 199 HB2 LYS 26 2HB LYS 26 14.163 -17.628 -10.715 200 HB3 LYS 26 3HB LYS 26 15.904 -17.762 -10.503 201 HG2 LYS 26 2HG LYS 26 14.670 -20.274 -11.290 202 HG3 LYS 26 3HG LYS 26 14.409 -18.978 -12.459 203 HD2 LYS 26 2HD LYS 26 16.418 -19.781 -13.203 204 HD3 LYS 26 3HD LYS 26 16.986 -18.568 -12.054 205 HE2 LYS 26 2HE LYS 26 17.262 -20.286 -10.353 206 HE3 LYS 26 3HE LYS 26 16.633 -21.505 -11.460 207 HZ1 LYS 26 3HZ LYS 26 18.530 -21.450 -12.738 208 HZ2 LYS 26 1HZ LYS 26 19.169 -21.230 -11.187 209 HZ3 LYS 26 2HZ LYS 26 18.983 -19.904 -12.221 210 H SER 27 H SER 27 16.603 -17.353 -8.452 211 HA SER 27 HA SER 27 15.251 -16.347 -6.086 212 HB2 SER 27 2HB SER 27 17.932 -15.425 -7.112 213 HB3 SER 27 3HB SER 27 17.327 -15.408 -5.455 214 HG SER 27 HG SER 27 18.044 -17.362 -5.221 215 H LYS 28 H LYS 28 13.556 -15.420 -7.586 216 HA LYS 28 HA LYS 28 14.379 -12.864 -8.765 217 HB2 LYS 28 2HB LYS 28 11.686 -14.210 -8.984 218 HB3 LYS 28 3HB LYS 28 12.298 -12.882 -9.961 219 HG2 LYS 28 2HG LYS 28 14.177 -14.847 -10.354 220 HG3 LYS 28 3HG LYS 28 12.663 -15.751 -10.265 221 HD2 LYS 28 2HD LYS 28 11.769 -13.957 -11.898 222 HD3 LYS 28 3HD LYS 28 13.472 -13.601 -12.192 223 HE2 LYS 28 2HE LYS 28 12.381 -16.392 -12.379 224 HE3 LYS 28 3HE LYS 28 12.314 -15.278 -13.744 225 HZ1 LYS 28 3HZ LYS 28 14.549 -15.354 -14.037 226 HZ2 LYS 28 1HZ LYS 28 14.338 -16.896 -13.375 227 HZ3 LYS 28 2HZ LYS 28 14.887 -15.627 -12.402 228 H LYS 29 H LYS 29 14.379 -11.274 -7.303 229 HA LYS 29 HA LYS 29 11.960 -10.923 -5.664 230 HB2 LYS 29 2HB LYS 29 13.467 -9.952 -3.889 231 HB3 LYS 29 3HB LYS 29 13.603 -11.690 -4.123 232 HG2 LYS 29 2HG LYS 29 15.652 -11.443 -5.318 233 HG3 LYS 29 3HG LYS 29 15.474 -9.687 -5.364 234 HD2 LYS 29 2HD LYS 29 15.572 -9.696 -2.863 235 HD3 LYS 29 3HD LYS 29 15.960 -11.417 -2.942 236 HE2 LYS 29 2HE LYS 29 18.089 -11.010 -3.485 237 HE3 LYS 29 3HE LYS 29 17.634 -9.811 -4.695 238 HZ1 LYS 29 3HZ LYS 29 18.985 -8.975 -2.768 239 HZ2 LYS 29 1HZ LYS 29 17.628 -9.231 -1.790 240 HZ3 LYS 29 2HZ LYS 29 17.551 -8.128 -3.070 241 H PHE 30 H PHE 30 11.688 -8.659 -4.894 242 HA PHE 30 HA PHE 30 12.532 -6.795 -7.003 243 HB2 PHE 30 2HB PHE 30 10.248 -6.449 -5.056 244 HB3 PHE 30 3HB PHE 30 10.574 -5.492 -6.497 245 HD1 PHE 30 HD2 PHE 30 11.120 -7.527 -8.508 246 HD2 PHE 30 HD1 PHE 30 8.206 -7.465 -5.406 247 HE1 PHE 30 HE2 PHE 30 9.687 -9.028 -9.829 248 HE2 PHE 30 HE1 PHE 30 6.768 -8.967 -6.722 249 HZ PHE 30 HZ PHE 30 7.507 -9.749 -8.937 250 H GLY 31 H GLY 31 12.244 -4.384 -5.954 251 HA2 GLY 31 2HA GLY 31 13.530 -4.245 -3.346 252 HA3 GLY 31 3HA GLY 31 14.489 -3.672 -4.703 253 H GLU 32 H GLU 32 14.381 -1.682 -3.305 254 HA GLU 32 HA GLU 32 12.036 -0.221 -2.915 255 HB2 GLU 32 2HB GLU 32 14.745 0.991 -3.459 256 HB3 GLU 32 3HB GLU 32 13.434 1.676 -2.510 257 HG2 GLU 32 2HG GLU 32 14.363 0.818 -0.701 258 HG3 GLU 32 3HG GLU 32 14.010 -0.791 -1.328 259 H GLY 33 H GLY 33 14.377 -0.067 -5.593 260 HA2 GLY 33 2HA GLY 33 13.112 1.958 -7.059 261 HA3 GLY 33 3HA GLY 33 14.175 0.732 -7.734 262 H ASN 34 H ASN 34 12.376 -1.437 -6.779 263 HA ASN 34 HA ASN 34 10.748 -1.588 -9.120 264 HB2 ASN 34 2HB ASN 34 11.886 -3.483 -7.664 265 HB3 ASN 34 3HB ASN 34 10.344 -3.444 -6.813 266 HD21 ASN 34 1HD2 ASN 34 8.404 -3.450 -8.341 267 HD22 ASN 34 2HD2 ASN 34 8.475 -4.587 -9.640 268 H PHE 35 H PHE 35 10.084 -1.184 -5.660 269 HA PHE 35 HA PHE 35 7.281 -1.181 -5.841 270 HB2 PHE 35 2HB PHE 35 8.894 0.369 -3.814 271 HB3 PHE 35 3HB PHE 35 7.278 -0.301 -3.620 272 HD1 PHE 35 HD2 PHE 35 7.592 -3.018 -4.632 273 HD2 PHE 35 HD1 PHE 35 10.212 -0.674 -2.232 274 HE1 PHE 35 HE2 PHE 35 8.559 -5.073 -3.686 275 HE2 PHE 35 HE1 PHE 35 11.184 -2.725 -1.283 276 HZ PHE 35 HZ PHE 35 10.357 -4.929 -2.009 277 H ARG 36 H ARG 36 9.547 1.564 -5.644 278 HA ARG 36 HA ARG 36 7.655 3.596 -5.932 279 HB2 ARG 36 2HB ARG 36 9.567 5.002 -6.672 280 HB3 ARG 36 3HB ARG 36 9.898 4.095 -5.203 281 HG2 ARG 36 2HG ARG 36 11.817 3.593 -6.246 282 HG3 ARG 36 3HG ARG 36 10.833 2.374 -7.059 283 HD2 ARG 36 2HD ARG 36 11.661 3.343 -8.920 284 HD3 ARG 36 3HD ARG 36 10.355 4.494 -8.644 285 HE ARG 36 HE ARG 36 12.626 5.342 -7.233 286 HH11 ARG 36 1HH1 ARG 36 11.487 4.985 -10.503 287 HH12 ARG 36 2HH1 ARG 36 12.462 6.277 -11.122 288 HH21 ARG 36 1HH2 ARG 36 13.915 7.043 -8.035 289 HH22 ARG 36 2HH2 ARG 36 13.844 7.446 -9.718 290 H TRP 37 H TRP 37 9.505 1.823 -8.376 291 HA TRP 37 HA TRP 37 8.694 3.292 -10.617 292 HB2 TRP 37 2HB TRP 37 10.526 1.750 -10.806 293 HB3 TRP 37 3HB TRP 37 9.504 0.395 -10.337 294 HD1 TRP 37 HD1 TRP 37 10.484 2.505 -13.329 295 HE1 TRP 37 HE1 TRP 37 9.454 1.484 -15.456 296 HE3 TRP 37 HE3 TRP 37 7.414 -0.962 -11.161 297 HZ2 TRP 37 HZ2 TRP 37 7.587 -0.524 -16.125 298 HZ3 TRP 37 HZ3 TRP 37 6.039 -2.393 -12.615 299 HH2 TRP 37 HH2 TRP 37 6.124 -2.177 -15.046 300 H ALA 38 H ALA 38 7.232 0.476 -9.044 301 HA ALA 38 HA ALA 38 5.128 0.190 -10.944 302 HB1 ALA 38 1HB ALA 38 5.694 -1.735 -9.704 303 HB2 ALA 38 2HB ALA 38 5.535 -0.885 -8.166 304 HB3 ALA 38 3HB ALA 38 4.101 -1.243 -9.128 305 H ILE 39 H ILE 39 5.125 1.371 -7.575 306 HA ILE 39 HA ILE 39 2.503 2.216 -7.432 307 HB ILE 39 HB ILE 39 4.896 3.551 -6.161 308 HG12 ILE 39 2HG1 ILE 39 3.043 1.555 -4.877 309 HG13 ILE 39 3HG1 ILE 39 4.472 1.040 -5.766 310 HG21 ILE 39 1HG2 ILE 39 2.937 3.976 -4.411 311 HG22 ILE 39 2HG2 ILE 39 3.289 5.096 -5.726 312 HG23 ILE 39 3HG2 ILE 39 1.972 3.934 -5.886 313 HD11 ILE 39 3HD1 ILE 39 5.778 2.592 -4.229 314 HD12 ILE 39 1HD1 ILE 39 4.319 2.638 -3.239 315 HD13 ILE 39 2HD1 ILE 39 5.138 1.103 -3.533 316 H ARG 40 H ARG 40 5.316 4.250 -8.264 317 HA ARG 40 HA ARG 40 3.944 6.577 -8.877 318 HB2 ARG 40 2HB ARG 40 6.510 5.459 -10.005 319 HB3 ARG 40 3HB ARG 40 5.918 7.070 -10.389 320 HG2 ARG 40 2HG ARG 40 5.941 6.647 -7.542 321 HG3 ARG 40 3HG ARG 40 7.528 6.326 -8.244 322 HD2 ARG 40 2HD ARG 40 7.404 8.521 -9.394 323 HD3 ARG 40 3HD ARG 40 5.888 8.837 -8.552 324 HE ARG 40 HE ARG 40 8.540 9.010 -7.467 325 HH11 ARG 40 1HH1 ARG 40 5.176 8.511 -6.720 326 HH12 ARG 40 2HH1 ARG 40 5.326 9.046 -5.079 327 HH21 ARG 40 1HH2 ARG 40 8.750 9.716 -5.308 328 HH22 ARG 40 2HH2 ARG 40 7.360 9.732 -4.277 329 H MET 41 H MET 41 4.895 3.947 -11.082 330 HA MET 41 HA MET 41 3.909 4.969 -13.449 331 HB2 MET 41 2HB MET 41 5.231 2.911 -13.316 332 HB3 MET 41 3HB MET 41 3.888 2.087 -12.534 333 HG2 MET 41 2HG MET 41 2.771 1.784 -14.463 334 HG3 MET 41 3HG MET 41 3.284 3.333 -15.129 335 HE1 MET 41 3HE MET 41 4.407 3.235 -17.296 336 HE2 MET 41 1HE MET 41 5.714 3.732 -16.221 337 HE3 MET 41 2HE MET 41 6.013 2.527 -17.474 338 H ALA 42 H ALA 42 2.181 3.460 -10.801 339 HA ALA 42 HA ALA 42 -0.310 3.305 -12.251 340 HB1 ALA 42 1HB ALA 42 -1.171 2.203 -10.423 341 HB2 ALA 42 2HB ALA 42 0.543 1.804 -10.294 342 HB3 ALA 42 3HB ALA 42 -0.146 3.072 -9.281 343 H ASN 43 H ASN 43 1.070 5.332 -9.691 344 HA ASN 43 HA ASN 43 -1.172 6.887 -9.132 345 HB2 ASN 43 2HB ASN 43 1.200 6.801 -8.016 346 HB3 ASN 43 3HB ASN 43 1.564 8.110 -9.136 347 HD21 ASN 43 1HD2 ASN 43 1.899 9.235 -7.056 348 HD22 ASN 43 2HD2 ASN 43 0.535 10.000 -6.321 349 H VAL 44 H VAL 44 0.911 6.881 -11.878 350 HA VAL 44 HA VAL 44 -0.046 9.489 -12.788 351 HB VAL 44 HB VAL 44 1.957 7.612 -14.051 352 HG11 VAL 44 1HG1 VAL 44 0.894 8.966 -15.739 353 HG12 VAL 44 2HG1 VAL 44 1.146 10.425 -14.777 354 HG13 VAL 44 3HG1 VAL 44 2.528 9.567 -15.458 355 HG21 VAL 44 3HG2 VAL 44 2.611 8.656 -11.861 356 HG22 VAL 44 1HG2 VAL 44 3.658 9.056 -13.223 357 HG23 VAL 44 2HG2 VAL 44 2.472 10.228 -12.649 358 H SER 45 H SER 45 0.358 6.288 -14.314 359 HA SER 45 HA SER 45 -1.311 6.675 -16.472 360 HB2 SER 45 2HB SER 45 -0.499 4.232 -14.934 361 HB3 SER 45 3HB SER 45 -1.694 4.092 -16.223 362 HG SER 45 HG SER 45 0.795 3.971 -16.605 363 H THR 46 H THR 46 -2.144 5.738 -13.184 364 HA THR 46 HA THR 46 -4.990 6.036 -13.893 365 HB THR 46 HB THR 46 -5.614 4.358 -12.325 366 HG1 THR 46 HG1 THR 46 -3.945 3.292 -11.063 367 HG21 THR 46 3HG2 THR 46 -4.038 3.794 -14.544 368 HG22 THR 46 1HG2 THR 46 -5.082 2.664 -13.682 369 HG23 THR 46 2HG2 THR 46 -3.372 2.779 -13.265 370 H GLY 47 H GLY 47 -3.607 8.264 -13.182 371 HA2 GLY 47 2HA GLY 47 -5.060 9.202 -10.946 372 HA3 GLY 47 3HA GLY 47 -3.405 8.862 -10.464 373 H ARG 48 H ARG 48 -1.978 9.647 -12.664 374 HA ARG 48 HA ARG 48 -1.051 11.468 -13.664 375 HB2 ARG 48 2HB ARG 48 -3.568 11.547 -14.492 376 HB3 ARG 48 3HB ARG 48 -3.605 13.003 -13.507 377 HG2 ARG 48 2HG ARG 48 -1.262 13.043 -15.132 378 HG3 ARG 48 3HG ARG 48 -2.668 12.704 -16.143 379 HD2 ARG 48 2HD ARG 48 -3.736 14.668 -14.775 380 HD3 ARG 48 3HD ARG 48 -2.053 15.103 -14.480 381 HE ARG 48 HE ARG 48 -2.514 14.643 -17.241 382 HH11 ARG 48 1HH1 ARG 48 -3.040 16.966 -14.702 383 HH12 ARG 48 2HH1 ARG 48 -3.080 18.326 -15.775 384 HH21 ARG 48 1HH2 ARG 48 -2.565 16.425 -18.664 385 HH22 ARG 48 2HH2 ARG 48 -2.811 18.016 -18.029 386 H GLU 49 H GLU 49 -0.596 11.300 -11.006 387 HA GLU 49 HA GLU 49 0.039 13.965 -10.308 388 HB2 GLU 49 2HB GLU 49 -2.429 13.902 -9.780 389 HB3 GLU 49 3HB GLU 49 -2.064 12.703 -8.548 390 HG2 GLU 49 2HG GLU 49 -1.714 14.353 -7.124 391 HG3 GLU 49 3HG GLU 49 -0.306 14.822 -8.074 392 HA PRO 50 HA PRO 50 2.518 10.550 -8.374 393 HB2 PRO 50 2HB PRO 50 4.918 11.510 -9.203 394 HB3 PRO 50 3HB PRO 50 3.917 10.441 -10.193 395 HG2 PRO 50 2HG PRO 50 4.204 13.418 -10.316 396 HG3 PRO 50 3HG PRO 50 4.141 12.244 -11.644 397 HD2 PRO 50 2HD PRO 50 1.999 13.728 -10.909 398 HD3 PRO 50 3HD PRO 50 1.843 12.085 -11.562 399 H GLY 51 H GLY 51 2.254 13.936 -8.118 400 HA2 GLY 51 2HA GLY 51 4.211 14.194 -5.982 401 HA3 GLY 51 3HA GLY 51 3.199 15.475 -6.632 402 H ASP 52 H ASP 52 2.415 12.313 -5.198 403 HA ASP 52 HA ASP 52 1.509 13.304 -2.734 404 HB2 ASP 52 2HB ASP 52 -0.257 13.936 -4.789 405 HB3 ASP 52 3HB ASP 52 -0.961 12.502 -4.046 406 H ILE 53 H ILE 53 1.572 11.622 -1.404 407 HA ILE 53 HA ILE 53 1.100 8.937 -2.525 408 HB ILE 53 HB ILE 53 2.833 9.631 -0.152 409 HG12 ILE 53 2HG1 ILE 53 4.439 8.562 -2.153 410 HG13 ILE 53 3HG1 ILE 53 3.367 9.658 -3.017 411 HG21 ILE 53 1HG2 ILE 53 3.657 7.220 -0.781 412 HG22 ILE 53 2HG2 ILE 53 2.227 7.452 0.224 413 HG23 ILE 53 3HG2 ILE 53 2.048 7.089 -1.492 414 HD11 ILE 53 3HD1 ILE 53 5.690 10.307 -1.640 415 HD12 ILE 53 1HD1 ILE 53 4.494 11.421 -2.301 416 HD13 ILE 53 2HD1 ILE 53 4.373 10.892 -0.623 417 HA PRO 54 HA PRO 54 -2.245 9.650 0.577 418 HB2 PRO 54 2HB PRO 54 -4.152 8.366 -0.866 419 HB3 PRO 54 3HB PRO 54 -3.754 10.072 -1.103 420 HG2 PRO 54 2HG PRO 54 -2.869 7.685 -2.677 421 HG3 PRO 54 3HG PRO 54 -3.405 9.272 -3.258 422 HD2 PRO 54 2HD PRO 54 -0.790 8.584 -3.103 423 HD3 PRO 54 3HD PRO 54 -1.355 10.249 -2.861 424 H GLU 55 H GLU 55 -1.616 8.271 2.176 425 HA GLU 55 HA GLU 55 -1.375 5.433 1.712 426 HB2 GLU 55 2HB GLU 55 -0.865 5.339 4.146 427 HB3 GLU 55 3HB GLU 55 0.171 6.445 3.254 428 HG2 GLU 55 2HG GLU 55 -0.452 8.164 4.502 429 HG3 GLU 55 3HG GLU 55 -2.161 7.801 4.269 430 H THR 56 H THR 56 -3.777 5.649 0.946 431 HA THR 56 HA THR 56 -5.471 4.883 3.231 432 HB THR 56 HB THR 56 -7.378 5.949 2.283 433 HG1 THR 56 HG1 THR 56 -7.469 6.622 0.229 434 HG21 THR 56 3HG2 THR 56 -6.761 8.273 2.328 435 HG22 THR 56 1HG2 THR 56 -5.087 7.884 1.933 436 HG23 THR 56 2HG2 THR 56 -5.758 7.412 3.495 437 H LEU 57 H LEU 57 -6.275 2.897 3.077 438 HA LEU 57 HA LEU 57 -5.717 1.112 1.047 439 HB2 LEU 57 2HB LEU 57 -7.721 1.196 3.243 440 HB3 LEU 57 3HB LEU 57 -7.892 -0.046 2.005 441 HG LEU 57 HG LEU 57 -6.717 -0.864 3.998 442 HD11 LEU 57 1HD1 LEU 57 -4.441 -1.059 2.309 443 HD12 LEU 57 2HD1 LEU 57 -5.887 -1.082 1.301 444 HD13 LEU 57 3HD1 LEU 57 -5.704 -2.255 2.605 445 HD21 LEU 57 3HD2 LEU 57 -5.669 1.331 4.570 446 HD22 LEU 57 1HD2 LEU 57 -4.522 1.062 3.257 447 HD23 LEU 57 2HD2 LEU 57 -4.565 -0.044 4.630 448 H ASP 58 H ASP 58 -8.394 3.346 1.356 449 HA ASP 58 HA ASP 58 -10.057 2.265 -0.647 450 HB2 ASP 58 2HB ASP 58 -9.837 4.866 0.772 451 HB3 ASP 58 3HB ASP 58 -10.721 4.863 -0.751 452 H GLN 59 H GLN 59 -7.694 4.927 -0.785 453 HA GLN 59 HA GLN 59 -7.963 5.402 -3.549 454 HB2 GLN 59 2HB GLN 59 -6.916 6.943 -1.844 455 HB3 GLN 59 3HB GLN 59 -5.493 5.911 -1.890 456 HG2 GLN 59 2HG GLN 59 -5.372 7.967 -3.304 457 HG3 GLN 59 3HG GLN 59 -5.059 6.452 -4.150 458 HE21 GLN 59 1HE2 GLN 59 -5.596 7.261 -6.151 459 HE22 GLN 59 2HE2 GLN 59 -7.218 7.653 -6.600 460 H LEU 60 H LEU 60 -5.387 3.684 -1.777 461 HA LEU 60 HA LEU 60 -3.917 2.796 -3.936 462 HB2 LEU 60 2HB LEU 60 -3.410 2.575 -1.459 463 HB3 LEU 60 3HB LEU 60 -4.420 1.131 -1.483 464 HG LEU 60 HG LEU 60 -2.793 0.363 -3.373 465 HD11 LEU 60 1HD1 LEU 60 -1.435 2.170 -3.805 466 HD12 LEU 60 2HD1 LEU 60 -0.449 1.254 -2.666 467 HD13 LEU 60 3HD1 LEU 60 -1.361 2.658 -2.112 468 HD21 LEU 60 3HD2 LEU 60 -2.977 -0.824 -1.313 469 HD22 LEU 60 1HD2 LEU 60 -2.112 0.441 -0.440 470 HD23 LEU 60 2HD2 LEU 60 -1.261 -0.555 -1.621 471 H ARG 61 H ARG 61 -6.832 1.405 -2.522 472 HA ARG 61 HA ARG 61 -6.837 -1.007 -3.972 473 HB2 ARG 61 2HB ARG 61 -8.246 -0.709 -2.020 474 HB3 ARG 61 3HB ARG 61 -9.130 0.585 -2.816 475 HG2 ARG 61 2HG ARG 61 -10.297 -0.855 -4.169 476 HG3 ARG 61 3HG ARG 61 -9.062 -2.112 -4.077 477 HD2 ARG 61 2HD ARG 61 -9.898 -2.979 -2.164 478 HD3 ARG 61 3HD ARG 61 -10.363 -1.400 -1.530 479 HE ARG 61 HE ARG 61 -12.000 -2.217 -3.724 480 HH11 ARG 61 1HH1 ARG 61 -11.490 -2.587 -0.300 481 HH12 ARG 61 2HH1 ARG 61 -13.138 -3.004 0.033 482 HH21 ARG 61 1HH2 ARG 61 -14.173 -2.766 -3.298 483 HH22 ARG 61 2HH2 ARG 61 -14.663 -3.107 -1.673 484 H LEU 62 H LEU 62 -8.319 2.145 -4.646 485 HA LEU 62 HA LEU 62 -9.591 1.367 -7.049 486 HB2 LEU 62 2HB LEU 62 -9.089 3.838 -5.582 487 HB3 LEU 62 3HB LEU 62 -9.104 4.058 -7.331 488 HG LEU 62 HG LEU 62 -11.289 4.509 -6.302 489 HD11 LEU 62 1HD1 LEU 62 -12.229 2.251 -7.704 490 HD12 LEU 62 2HD1 LEU 62 -10.740 2.769 -8.494 491 HD13 LEU 62 3HD1 LEU 62 -12.069 3.909 -8.285 492 HD21 LEU 62 3HD2 LEU 62 -11.900 1.689 -5.808 493 HD22 LEU 62 1HD2 LEU 62 -12.330 3.126 -4.880 494 HD23 LEU 62 2HD2 LEU 62 -10.740 2.389 -4.677 495 H VAL 63 H VAL 63 -6.336 2.196 -6.280 496 HA VAL 63 HA VAL 63 -5.514 2.976 -8.899 497 HB VAL 63 HB VAL 63 -3.822 1.921 -6.629 498 HG11 VAL 63 1HG1 VAL 63 -3.150 2.431 -9.293 499 HG12 VAL 63 2HG1 VAL 63 -2.550 3.818 -8.381 500 HG13 VAL 63 3HG1 VAL 63 -2.047 2.186 -7.941 501 HG21 VAL 63 3HG2 VAL 63 -3.444 4.648 -6.799 502 HG22 VAL 63 1HG2 VAL 63 -5.182 4.458 -7.035 503 HG23 VAL 63 2HG2 VAL 63 -4.411 3.807 -5.588 504 H ILE 64 H ILE 64 -4.771 0.038 -7.010 505 HA ILE 64 HA ILE 64 -3.598 -1.434 -9.032 506 HB ILE 64 HB ILE 64 -3.518 -2.204 -6.748 507 HG12 ILE 64 2HG1 ILE 64 -5.142 -4.325 -8.107 508 HG13 ILE 64 3HG1 ILE 64 -3.608 -3.824 -8.809 509 HG21 ILE 64 1HG2 ILE 64 -5.783 -1.413 -6.118 510 HG22 ILE 64 2HG2 ILE 64 -6.464 -2.800 -6.966 511 HG23 ILE 64 3HG2 ILE 64 -5.430 -3.049 -5.559 512 HD11 ILE 64 3HD1 ILE 64 -3.908 -5.791 -6.974 513 HD12 ILE 64 1HD1 ILE 64 -2.414 -4.897 -7.255 514 HD13 ILE 64 2HD1 ILE 64 -3.496 -4.418 -5.947 515 H CYS 65 H CYS 65 -7.021 -1.096 -8.233 516 HA CYS 65 HA CYS 65 -7.973 -3.045 -10.046 517 HB2 CYS 65 2HB CYS 65 -9.110 -1.015 -8.292 518 HB3 CYS 65 3HB CYS 65 -10.013 -1.178 -9.792 519 HG CYS 65 HG CYS 65 -11.281 -3.312 -9.143 520 H ASP 66 H ASP 66 -7.989 0.514 -10.286 521 HA ASP 66 HA ASP 66 -8.900 0.690 -12.908 522 HB2 ASP 66 2HB ASP 66 -8.583 2.563 -11.188 523 HB3 ASP 66 3HB ASP 66 -6.906 2.615 -11.724 524 H LEU 67 H LEU 67 -5.652 0.190 -11.661 525 HA LEU 67 HA LEU 67 -4.337 0.517 -14.172 526 HB2 LEU 67 2HB LEU 67 -3.031 0.864 -12.241 527 HB3 LEU 67 3HB LEU 67 -3.524 -0.675 -11.538 528 HG LEU 67 HG LEU 67 -2.155 -1.124 -14.025 529 HD11 LEU 67 1HD1 LEU 67 -0.358 0.149 -12.014 530 HD12 LEU 67 2HD1 LEU 67 -1.201 1.156 -13.190 531 HD13 LEU 67 3HD1 LEU 67 -0.110 -0.115 -13.740 532 HD21 LEU 67 3HD2 LEU 67 -0.975 -1.800 -11.387 533 HD22 LEU 67 1HD2 LEU 67 -1.157 -2.788 -12.837 534 HD23 LEU 67 2HD2 LEU 67 -2.545 -2.497 -11.789 535 H GLN 68 H GLN 68 -4.817 -2.404 -12.175 536 HA GLN 68 HA GLN 68 -4.034 -4.270 -14.062 537 HB2 GLN 68 2HB GLN 68 -4.400 -4.862 -11.734 538 HB3 GLN 68 3HB GLN 68 -6.121 -4.538 -11.893 539 HG2 GLN 68 2HG GLN 68 -6.273 -6.373 -13.540 540 HG3 GLN 68 3HG GLN 68 -4.571 -6.730 -13.251 541 HE21 GLN 68 1HE2 GLN 68 -7.584 -7.682 -12.515 542 HE22 GLN 68 2HE2 GLN 68 -7.312 -8.401 -10.968 543 H GLU 69 H GLU 69 -7.027 -2.517 -13.787 544 HA GLU 69 HA GLU 69 -8.577 -4.190 -15.487 545 HB2 GLU 69 2HB GLU 69 -9.572 -2.590 -13.887 546 HB3 GLU 69 3HB GLU 69 -8.942 -1.258 -14.845 547 HG2 GLU 69 2HG GLU 69 -10.287 -2.328 -16.776 548 HG3 GLU 69 3HG GLU 69 -11.148 -3.165 -15.486 549 H ARG 70 H ARG 70 -7.240 -0.933 -16.086 550 HA ARG 70 HA ARG 70 -7.698 -0.941 -18.848 551 HB2 ARG 70 2HB ARG 70 -5.999 0.643 -16.987 552 HB3 ARG 70 3HB ARG 70 -5.641 0.754 -18.705 553 HG2 ARG 70 2HG ARG 70 -7.905 1.487 -19.160 554 HG3 ARG 70 3HG ARG 70 -8.323 1.307 -17.454 555 HD2 ARG 70 2HD ARG 70 -7.895 3.627 -17.907 556 HD3 ARG 70 3HD ARG 70 -6.590 2.993 -16.905 557 HE ARG 70 HE ARG 70 -5.896 2.806 -19.635 558 HH11 ARG 70 1HH1 ARG 70 -6.289 5.133 -17.075 559 HH12 ARG 70 2HH1 ARG 70 -5.137 6.247 -17.734 560 HH21 ARG 70 1HH2 ARG 70 -4.378 4.265 -20.513 561 HH22 ARG 70 2HH2 ARG 70 -4.052 5.753 -19.690 562 H ARG 71 H ARG 71 -4.747 -1.715 -17.016 563 HA ARG 71 HA ARG 71 -3.055 -2.243 -19.150 564 HB2 ARG 71 2HB ARG 71 -3.148 -3.546 -16.424 565 HB3 ARG 71 3HB ARG 71 -1.813 -3.707 -17.558 566 HG2 ARG 71 2HG ARG 71 -2.767 -1.070 -16.470 567 HG3 ARG 71 3HG ARG 71 -1.468 -2.023 -15.750 568 HD2 ARG 71 2HD ARG 71 -0.041 -1.070 -17.158 569 HD3 ARG 71 3HD ARG 71 -0.893 -1.842 -18.495 570 HE ARG 71 HE ARG 71 -2.276 0.485 -17.771 571 HH11 ARG 71 1HH1 ARG 71 0.737 -0.486 -19.219 572 HH12 ARG 71 2HH1 ARG 71 0.893 0.953 -20.171 573 HH21 ARG 71 1HH2 ARG 71 -2.081 2.384 -19.019 574 HH22 ARG 71 2HH2 ARG 71 -0.710 2.585 -20.055 575 H GLU 72 H GLU 72 -5.312 -4.415 -17.489 576 HA GLU 72 HA GLU 72 -4.637 -6.781 -18.809 577 HB2 GLU 72 2HB GLU 72 -6.053 -6.835 -16.865 578 HB3 GLU 72 3HB GLU 72 -7.274 -5.856 -17.666 579 HG2 GLU 72 2HG GLU 72 -7.674 -7.676 -19.258 580 HG3 GLU 72 3HG GLU 72 -6.476 -8.659 -18.417 581 H LYS 73 H LYS 73 -7.131 -4.376 -19.618 582 HA LYS 73 HA LYS 73 -8.166 -5.601 -21.885 583 HB2 LYS 73 2HB LYS 73 -8.158 -2.909 -20.741 584 HB3 LYS 73 3HB LYS 73 -8.279 -2.912 -22.495 585 HG2 LYS 73 2HG LYS 73 -10.394 -3.592 -22.446 586 HG3 LYS 73 3HG LYS 73 -10.044 -4.861 -21.269 587 HD2 LYS 73 2HD LYS 73 -9.854 -2.698 -19.683 588 HD3 LYS 73 3HD LYS 73 -11.026 -2.103 -20.860 589 HE2 LYS 73 2HE LYS 73 -11.679 -4.790 -20.083 590 HE3 LYS 73 3HE LYS 73 -11.496 -3.776 -18.653 591 HZ1 LYS 73 3HZ LYS 73 -13.672 -3.402 -19.163 592 HZ2 LYS 73 1HZ LYS 73 -13.447 -3.581 -20.830 593 HZ3 LYS 73 2HZ LYS 73 -12.964 -2.155 -20.060 594 H PHE 74 H PHE 74 -5.310 -3.571 -21.518 595 HA PHE 74 HA PHE 74 -4.777 -3.440 -24.335 596 HB2 PHE 74 2HB PHE 74 -4.053 -1.752 -22.545 597 HB3 PHE 74 3HB PHE 74 -2.780 -2.900 -22.145 598 HD1 PHE 74 HD2 PHE 74 -1.041 -3.445 -23.815 599 HD2 PHE 74 HD1 PHE 74 -3.926 -0.387 -24.477 600 HE1 PHE 74 HE2 PHE 74 0.362 -2.515 -25.608 601 HE2 PHE 74 HE1 PHE 74 -2.527 0.548 -26.272 602 HZ PHE 74 HZ PHE 74 -0.380 -0.515 -26.840 603 H GLY 75 H GLY 75 -3.987 -5.593 -21.735 604 HA2 GLY 75 2HA GLY 75 -3.401 -7.871 -22.720 605 HA3 GLY 75 3HA GLY 75 -2.068 -7.007 -23.473 606 H SER 76 H SER 76 -1.482 -9.147 -21.936 607 HA SER 76 HA SER 76 -0.819 -8.217 -19.259 608 HB2 SER 76 2HB SER 76 -1.640 -10.459 -19.338 609 HB3 SER 76 3HB SER 76 -0.529 -10.890 -20.638 610 HG SER 76 HG SER 76 -0.044 -11.427 -18.266 611 H SER 77 H SER 77 1.327 -8.264 -18.422 612 HA SER 77 HA SER 77 3.599 -8.677 -20.086 613 HB2 SER 77 2HB SER 77 4.244 -6.544 -20.661 614 HB3 SER 77 3HB SER 77 2.493 -6.344 -20.726 615 HG SER 77 HG SER 77 3.818 -4.757 -19.467 616 H LYS 78 H LYS 78 5.544 -8.586 -18.940 617 HA LYS 78 HA LYS 78 5.485 -9.234 -16.258 618 HB2 LYS 78 2HB LYS 78 7.766 -7.952 -17.775 619 HB3 LYS 78 3HB LYS 78 7.910 -8.813 -16.249 620 HG2 LYS 78 2HG LYS 78 6.964 -10.829 -17.450 621 HG3 LYS 78 3HG LYS 78 7.209 -9.927 -18.948 622 HD2 LYS 78 2HD LYS 78 9.433 -10.317 -16.968 623 HD3 LYS 78 3HD LYS 78 9.061 -11.537 -18.188 624 HE2 LYS 78 2HE LYS 78 9.407 -8.697 -19.030 625 HE3 LYS 78 3HE LYS 78 10.837 -9.657 -18.652 626 HZ1 LYS 78 3HZ LYS 78 10.694 -10.367 -20.741 627 HZ2 LYS 78 1HZ LYS 78 9.126 -9.765 -20.946 628 HZ3 LYS 78 2HZ LYS 78 9.363 -11.289 -20.252 629 H GLU 79 H GLU 79 5.772 -6.073 -17.767 630 HA GLU 79 HA GLU 79 6.473 -4.624 -15.446 631 HB2 GLU 79 2HB GLU 79 5.418 -3.954 -18.143 632 HB3 GLU 79 3HB GLU 79 5.232 -2.741 -16.884 633 HG2 GLU 79 2HG GLU 79 7.238 -2.193 -17.918 634 HG3 GLU 79 3HG GLU 79 7.727 -3.051 -16.458 635 H ILE 80 H ILE 80 3.358 -5.423 -16.918 636 HA ILE 80 HA ILE 80 1.799 -3.911 -15.076 637 HB ILE 80 HB ILE 80 0.972 -6.236 -16.818 638 HG12 ILE 80 2HG1 ILE 80 0.496 -3.310 -17.350 639 HG13 ILE 80 3HG1 ILE 80 1.955 -4.122 -17.907 640 HG21 ILE 80 1HG2 ILE 80 -0.696 -4.152 -15.416 641 HG22 ILE 80 2HG2 ILE 80 -1.303 -5.375 -16.531 642 HG23 ILE 80 3HG2 ILE 80 -0.593 -5.861 -14.992 643 HD11 ILE 80 3HD1 ILE 80 -0.256 -3.892 -19.381 644 HD12 ILE 80 1HD1 ILE 80 0.871 -5.240 -19.533 645 HD13 ILE 80 2HD1 ILE 80 -0.602 -5.424 -18.579 646 H ASP 81 H ASP 81 2.306 -7.427 -15.420 647 HA ASP 81 HA ASP 81 0.927 -8.268 -13.182 648 HB2 ASP 81 2HB ASP 81 1.876 -9.783 -14.891 649 HB3 ASP 81 3HB ASP 81 3.490 -9.454 -14.267 650 H MET 82 H MET 82 4.211 -7.012 -13.418 651 HA MET 82 HA MET 82 4.971 -7.588 -10.751 652 HB2 MET 82 2HB MET 82 6.014 -5.842 -12.932 653 HB3 MET 82 3HB MET 82 6.599 -5.567 -11.297 654 HG2 MET 82 2HG MET 82 7.228 -7.979 -11.200 655 HG3 MET 82 3HG MET 82 6.812 -8.094 -12.908 656 HE1 MET 82 3HE MET 82 9.488 -8.173 -14.432 657 HE2 MET 82 1HE MET 82 10.500 -8.474 -13.019 658 HE3 MET 82 2HE MET 82 8.882 -9.171 -13.109 659 H ALA 83 H ALA 83 3.671 -4.670 -12.300 660 HA ALA 83 HA ALA 83 3.753 -2.953 -10.116 661 HB1 ALA 83 1HB ALA 83 2.045 -1.655 -11.245 662 HB2 ALA 83 2HB ALA 83 3.228 -2.248 -12.412 663 HB3 ALA 83 3HB ALA 83 1.652 -3.029 -12.279 664 H ILE 84 H ILE 84 1.436 -5.459 -10.941 665 HA ILE 84 HA ILE 84 -0.521 -4.725 -9.010 666 HB ILE 84 HB ILE 84 -0.047 -7.405 -10.320 667 HG12 ILE 84 2HG1 ILE 84 -1.926 -5.148 -11.049 668 HG13 ILE 84 3HG1 ILE 84 -0.478 -5.607 -11.938 669 HG21 ILE 84 1HG2 ILE 84 -1.372 -7.603 -8.288 670 HG22 ILE 84 2HG2 ILE 84 -2.461 -6.341 -8.861 671 HG23 ILE 84 3HG2 ILE 84 -2.372 -7.882 -9.713 672 HD11 ILE 84 3HD1 ILE 84 -2.437 -6.456 -13.047 673 HD12 ILE 84 1HD1 ILE 84 -1.491 -7.797 -12.402 674 HD13 ILE 84 2HD1 ILE 84 -2.956 -7.272 -11.573 675 H VAL 85 H VAL 85 1.778 -7.456 -9.073 676 HA VAL 85 HA VAL 85 1.330 -8.337 -6.467 677 HB VAL 85 HB VAL 85 3.600 -9.369 -6.613 678 HG11 VAL 85 1HG1 VAL 85 1.377 -10.211 -7.711 679 HG12 VAL 85 2HG1 VAL 85 2.238 -9.883 -9.216 680 HG13 VAL 85 3HG1 VAL 85 2.905 -11.024 -8.048 681 HG21 VAL 85 3HG2 VAL 85 4.768 -9.189 -8.813 682 HG22 VAL 85 1HG2 VAL 85 3.679 -7.864 -9.223 683 HG23 VAL 85 2HG2 VAL 85 4.788 -7.705 -7.861 684 H THR 86 H THR 86 3.540 -5.882 -7.702 685 HA THR 86 HA THR 86 5.025 -5.450 -5.366 686 HB THR 86 HB THR 86 5.408 -3.131 -6.318 687 HG1 THR 86 HG1 THR 86 3.812 -2.605 -7.642 688 HG21 THR 86 3HG2 THR 86 7.128 -4.404 -7.031 689 HG22 THR 86 1HG2 THR 86 6.309 -4.315 -8.590 690 HG23 THR 86 2HG2 THR 86 6.074 -5.719 -7.548 691 H LEU 87 H LEU 87 2.154 -3.722 -6.580 692 HA LEU 87 HA LEU 87 1.885 -1.984 -4.393 693 HB2 LEU 87 2HB LEU 87 -0.036 -3.012 -6.454 694 HB3 LEU 87 3HB LEU 87 -0.567 -1.932 -5.166 695 HG LEU 87 HG LEU 87 1.682 -1.183 -7.009 696 HD11 LEU 87 1HD1 LEU 87 -0.099 -1.658 -8.508 697 HD12 LEU 87 2HD1 LEU 87 -0.052 0.091 -8.295 698 HD13 LEU 87 3HD1 LEU 87 -1.277 -0.865 -7.461 699 HD21 LEU 87 3HD2 LEU 87 -0.205 0.304 -5.198 700 HD22 LEU 87 1HD2 LEU 87 0.788 1.106 -6.416 701 HD23 LEU 87 2HD2 LEU 87 1.554 0.210 -5.104 702 H LYS 88 H LYS 88 0.760 -5.261 -4.933 703 HA LYS 88 HA LYS 88 -0.998 -5.361 -2.696 704 HB2 LYS 88 2HB LYS 88 -0.380 -7.025 -4.853 705 HB3 LYS 88 3HB LYS 88 0.117 -7.937 -3.433 706 HG2 LYS 88 2HG LYS 88 -2.059 -7.898 -2.523 707 HG3 LYS 88 3HG LYS 88 -2.597 -6.671 -3.674 708 HD2 LYS 88 2HD LYS 88 -1.548 -9.167 -4.846 709 HD3 LYS 88 3HD LYS 88 -3.069 -9.312 -3.962 710 HE2 LYS 88 2HE LYS 88 -3.725 -7.196 -5.361 711 HE3 LYS 88 3HE LYS 88 -2.442 -7.757 -6.432 712 HZ1 LYS 88 3HZ LYS 88 -4.789 -9.363 -5.575 713 HZ2 LYS 88 1HZ LYS 88 -3.567 -9.878 -6.625 714 HZ3 LYS 88 2HZ LYS 88 -4.604 -8.624 -7.086 715 H VAL 89 H VAL 89 2.149 -6.969 -3.210 716 HA VAL 89 HA VAL 89 2.550 -7.824 -0.604 717 HB VAL 89 HB VAL 89 4.725 -6.923 -2.496 718 HG11 VAL 89 1HG1 VAL 89 6.215 -7.860 -1.110 719 HG12 VAL 89 2HG1 VAL 89 4.944 -7.729 0.107 720 HG13 VAL 89 3HG1 VAL 89 5.173 -9.241 -0.771 721 HG21 VAL 89 3HG2 VAL 89 4.374 -9.734 -2.537 722 HG22 VAL 89 1HG2 VAL 89 2.796 -8.992 -2.806 723 HG23 VAL 89 2HG2 VAL 89 4.154 -8.584 -3.856 724 H PHE 90 H PHE 90 3.418 -4.738 -2.104 725 HA PHE 90 HA PHE 90 4.788 -3.699 0.152 726 HB2 PHE 90 2HB PHE 90 5.235 -2.732 -1.993 727 HB3 PHE 90 3HB PHE 90 3.532 -2.363 -2.247 728 HD1 PHE 90 HD1 PHE 90 5.811 -1.753 0.639 729 HD2 PHE 90 HD2 PHE 90 3.288 -0.081 -2.354 730 HE1 PHE 90 HE1 PHE 90 6.156 0.484 1.603 731 HE2 PHE 90 HE2 PHE 90 3.630 2.159 -1.395 732 HZ PHE 90 HZ PHE 90 5.066 2.444 0.585 733 H ALA 91 H ALA 91 1.441 -3.746 -0.840 734 HA ALA 91 HA ALA 91 0.481 -1.735 0.899 735 HB1 ALA 91 1HB ALA 91 -1.736 -2.864 0.551 736 HB2 ALA 91 2HB ALA 91 -0.892 -2.393 -0.924 737 HB3 ALA 91 3HB ALA 91 -0.886 -4.079 -0.405 738 H VAL 92 H VAL 92 0.641 -5.273 1.225 739 HA VAL 92 HA VAL 92 -0.374 -5.211 3.919 740 HB VAL 92 HB VAL 92 0.968 -7.521 2.514 741 HG11 VAL 92 1HG1 VAL 92 -0.130 -7.162 5.131 742 HG12 VAL 92 2HG1 VAL 92 -1.089 -8.351 4.247 743 HG13 VAL 92 3HG1 VAL 92 0.649 -8.583 4.437 744 HG21 VAL 92 3HG2 VAL 92 -1.802 -6.430 2.310 745 HG22 VAL 92 1HG2 VAL 92 -0.757 -7.091 1.052 746 HG23 VAL 92 2HG2 VAL 92 -1.547 -8.172 2.200 747 H ALA 93 H ALA 93 2.737 -6.248 2.506 748 HA ALA 93 HA ALA 93 4.115 -6.527 4.917 749 HB1 ALA 93 1HB ALA 93 6.089 -6.664 3.641 750 HB2 ALA 93 2HB ALA 93 4.815 -7.316 2.610 751 HB3 ALA 93 3HB ALA 93 5.414 -5.679 2.343 752 H GLY 94 H GLY 94 3.219 -3.694 3.161 753 HA2 GLY 94 2HA GLY 94 5.142 -2.022 4.597 754 HA3 GLY 94 3HA GLY 94 4.071 -1.497 3.306 755 H LEU 95 H LEU 95 1.691 -1.545 3.881 756 HA LEU 95 HA LEU 95 1.223 0.142 6.061 757 HB2 LEU 95 2HB LEU 95 -0.856 -1.625 4.802 758 HB3 LEU 95 3HB LEU 95 -1.083 -0.051 5.562 759 HG LEU 95 HG LEU 95 0.292 -0.578 2.927 760 HD11 LEU 95 1HD1 LEU 95 -2.255 0.937 3.412 761 HD12 LEU 95 2HD1 LEU 95 -2.235 -0.791 3.062 762 HD13 LEU 95 3HD1 LEU 95 -1.595 0.354 1.884 763 HD21 LEU 95 3HD2 LEU 95 -0.242 2.115 3.121 764 HD22 LEU 95 1HD2 LEU 95 1.334 1.353 3.332 765 HD23 LEU 95 2HD2 LEU 95 0.327 1.700 4.738 766 H LEU 96 H LEU 96 0.529 -3.328 5.685 767 HA LEU 96 HA LEU 96 -0.286 -3.566 8.445 768 HB2 LEU 96 2HB LEU 96 -0.452 -5.154 6.042 769 HB3 LEU 96 3HB LEU 96 0.124 -6.123 7.397 770 HG LEU 96 HG LEU 96 -2.392 -4.474 7.526 771 HD11 LEU 96 1HD1 LEU 96 -3.385 -6.902 7.298 772 HD12 LEU 96 2HD1 LEU 96 -1.909 -7.172 6.372 773 HD13 LEU 96 3HD1 LEU 96 -3.043 -5.914 5.878 774 HD21 LEU 96 3HD2 LEU 96 -1.495 -5.075 9.676 775 HD22 LEU 96 1HD2 LEU 96 -1.299 -6.753 9.171 776 HD23 LEU 96 2HD2 LEU 96 -2.915 -6.070 9.351 777 H ASN 97 H ASN 97 2.636 -3.222 7.057 778 HA ASN 97 HA ASN 97 4.784 -3.747 7.607 779 HB2 ASN 97 2HB ASN 97 3.423 -3.968 10.294 780 HB3 ASN 97 3HB ASN 97 5.169 -4.073 10.095 781 HD21 ASN 97 1HD2 ASN 97 2.782 -2.056 10.926 782 HD22 ASN 97 2HD2 ASN 97 3.484 -0.541 10.484 783 H MET 98 H MET 98 3.061 -5.926 6.691 784 HA MET 98 HA MET 98 3.607 -8.282 8.174 785 HB2 MET 98 2HB MET 98 2.040 -7.614 5.973 786 HB3 MET 98 3HB MET 98 3.232 -8.733 5.327 787 HG2 MET 98 2HG MET 98 1.605 -10.190 5.963 788 HG3 MET 98 3HG MET 98 2.581 -10.151 7.429 789 HE1 MET 98 3HE MET 98 -0.494 -10.263 9.517 790 HE2 MET 98 1HE MET 98 -0.283 -11.265 8.081 791 HE3 MET 98 2HE MET 98 1.103 -10.888 9.104 792 H THR 99 H THR 99 4.745 -10.175 6.918 793 HA THR 99 HA THR 99 7.300 -9.195 5.833 794 HB THR 99 HB THR 99 7.690 -9.842 8.151 795 HG1 THR 99 HG1 THR 99 9.510 -10.572 7.377 796 HG21 THR 99 3HG2 THR 99 7.459 -12.568 8.290 797 HG22 THR 99 1HG2 THR 99 6.013 -12.117 7.388 798 HG23 THR 99 2HG2 THR 99 6.315 -11.415 8.978 799 H VAL 100 H VAL 100 5.321 -9.932 4.141 800 HA VAL 100 HA VAL 100 5.512 -12.727 3.460 801 HB VAL 100 HB VAL 100 4.155 -12.081 1.466 802 HG11 VAL 100 1HG1 VAL 100 3.169 -12.757 3.656 803 HG12 VAL 100 2HG1 VAL 100 3.011 -11.045 4.055 804 HG13 VAL 100 3HG1 VAL 100 2.127 -11.717 2.685 805 HG21 VAL 100 3HG2 VAL 100 4.084 -9.966 0.794 806 HG22 VAL 100 1HG2 VAL 100 3.305 -9.510 2.310 807 HG23 VAL 100 2HG2 VAL 100 5.064 -9.484 2.178 808 H SER 101 H SER 101 7.056 -13.613 2.269 809 HA SER 101 HA SER 101 8.773 -11.865 0.652 810 HB2 SER 101 2HB SER 101 9.194 -14.538 1.958 811 HB3 SER 101 3HB SER 101 10.232 -14.022 0.629 812 HG SER 101 HG SER 101 9.898 -12.848 3.174 813 H THR 102 H THR 102 6.063 -13.200 0.017 814 HA THR 102 HA THR 102 6.829 -14.018 -2.678 815 HB THR 102 HB THR 102 5.590 -16.048 -2.685 816 HG1 THR 102 HG1 THR 102 4.641 -16.665 -0.495 817 HG21 THR 102 3HG2 THR 102 7.032 -16.109 -0.043 818 HG22 THR 102 1HG2 THR 102 7.881 -16.043 -1.586 819 HG23 THR 102 2HG2 THR 102 6.839 -17.415 -1.211 820 H ALA 103 H ALA 103 5.524 -13.138 -4.150 821 HA ALA 103 HA ALA 103 3.535 -11.311 -3.561 822 HB1 ALA 103 1HB ALA 103 2.873 -11.504 -5.931 823 HB2 ALA 103 2HB ALA 103 4.618 -11.362 -5.719 824 HB3 ALA 103 3HB ALA 103 3.898 -12.931 -6.078 825 H ALA 104 H ALA 104 3.330 -14.774 -3.864 826 HA ALA 104 HA ALA 104 0.511 -14.950 -4.176 827 HB1 ALA 104 1HB ALA 104 2.589 -16.929 -3.276 828 HB2 ALA 104 2HB ALA 104 0.877 -17.332 -3.411 829 HB3 ALA 104 3HB ALA 104 1.779 -16.829 -4.840 830 H ALA 105 H ALA 105 2.667 -15.133 -1.365 831 HA ALA 105 HA ALA 105 0.689 -15.710 0.550 832 HB1 ALA 105 1HB ALA 105 2.340 -14.923 2.201 833 HB2 ALA 105 2HB ALA 105 3.036 -16.040 1.027 834 HB3 ALA 105 3HB ALA 105 3.338 -14.309 0.882 835 H ALA 106 H ALA 106 1.921 -12.662 -0.729 836 HA ALA 106 HA ALA 106 0.638 -10.945 1.099 837 HB1 ALA 106 1HB ALA 106 1.396 -10.381 -1.765 838 HB2 ALA 106 2HB ALA 106 1.066 -9.183 -0.512 839 HB3 ALA 106 3HB ALA 106 2.473 -10.238 -0.376 840 H GLU 107 H GLU 107 -0.303 -11.851 -2.224 841 HA GLU 107 HA GLU 107 -2.755 -10.535 -2.270 842 HB2 GLU 107 2HB GLU 107 -1.692 -11.478 -4.270 843 HB3 GLU 107 3HB GLU 107 -1.985 -13.103 -3.667 844 HG2 GLU 107 2HG GLU 107 -4.486 -11.982 -3.617 845 HG3 GLU 107 3HG GLU 107 -3.765 -11.274 -5.062 846 H ASN 108 H ASN 108 -1.910 -13.731 -1.056 847 HA ASN 108 HA ASN 108 -4.500 -14.716 -0.645 848 HB2 ASN 108 2HB ASN 108 -1.894 -15.612 -0.173 849 HB3 ASN 108 3HB ASN 108 -2.654 -15.589 1.415 850 HD21 ASN 108 1HD2 ASN 108 -5.112 -16.370 1.126 851 HD22 ASN 108 2HD2 ASN 108 -5.235 -17.919 0.371 852 H MET 109 H MET 109 -2.319 -13.017 1.598 853 HA MET 109 HA MET 109 -4.155 -12.949 3.749 854 HB2 MET 109 2HB MET 109 -1.496 -12.320 3.417 855 HB3 MET 109 3HB MET 109 -2.232 -10.742 3.664 856 HG2 MET 109 2HG MET 109 -2.450 -13.116 5.501 857 HG3 MET 109 3HG MET 109 -1.466 -11.677 5.760 858 HE1 MET 109 3HE MET 109 -3.185 -9.488 7.629 859 HE2 MET 109 1HE MET 109 -1.993 -9.682 6.343 860 HE3 MET 109 2HE MET 109 -3.529 -8.882 6.008 861 H TYR 110 H TYR 110 -3.447 -10.722 1.110 862 HA TYR 110 HA TYR 110 -4.942 -8.531 2.023 863 HB2 TYR 110 2HB TYR 110 -3.287 -8.661 0.058 864 HB3 TYR 110 3HB TYR 110 -4.651 -9.246 -0.888 865 HD1 TYR 110 HD1 TYR 110 -3.859 -6.445 1.465 866 HD2 TYR 110 HD2 TYR 110 -5.831 -7.680 -2.098 867 HE1 TYR 110 HE1 TYR 110 -4.560 -4.123 1.054 868 HE2 TYR 110 HE2 TYR 110 -6.536 -5.362 -2.518 869 HH TYR 110 HH TYR 110 -6.253 -3.212 -1.906 870 H SER 111 H SER 111 -5.862 -11.384 0.171 871 HA SER 111 HA SER 111 -8.561 -10.460 -0.246 872 HB2 SER 111 2HB SER 111 -8.040 -11.861 -1.979 873 HB3 SER 111 3HB SER 111 -6.973 -12.859 -0.992 874 HG SER 111 HG SER 111 -9.727 -13.032 -1.381 875 H GLN 112 H GLN 112 -6.962 -12.890 1.782 876 HA GLN 112 HA GLN 112 -9.182 -14.024 2.983 877 HB2 GLN 112 2HB GLN 112 -6.756 -14.715 3.229 878 HB3 GLN 112 3HB GLN 112 -6.599 -13.438 4.428 879 HG2 GLN 112 2HG GLN 112 -8.034 -14.506 5.927 880 HG3 GLN 112 3HG GLN 112 -8.689 -15.568 4.682 881 HE21 GLN 112 1HE2 GLN 112 -5.914 -14.897 6.703 882 HE22 GLN 112 2HE2 GLN 112 -5.207 -16.469 6.587 883 H MET 113 H MET 113 -7.623 -10.956 3.626 884 HA MET 113 HA MET 113 -9.100 -10.463 6.048 885 HB2 MET 113 2HB MET 113 -6.777 -9.526 5.339 886 HB3 MET 113 3HB MET 113 -7.715 -8.330 4.455 887 HG2 MET 113 2HG MET 113 -8.539 -8.710 7.239 888 HG3 MET 113 3HG MET 113 -6.905 -8.083 7.030 889 HE1 MET 113 3HE MET 113 -9.546 -5.589 8.194 890 HE2 MET 113 1HE MET 113 -8.150 -6.588 8.602 891 HE3 MET 113 2HE MET 113 -7.914 -4.975 7.929 892 H GLY 114 H GLY 114 -9.493 -9.822 2.649 893 HA2 GLY 114 2HA GLY 114 -11.714 -9.445 1.789 894 HA3 GLY 114 3HA GLY 114 -12.083 -8.556 3.259 895 H LEU 115 H LEU 115 -9.072 -8.092 1.568 896 HA LEU 115 HA LEU 115 -9.926 -5.359 0.924 897 HB2 LEU 115 2HB LEU 115 -7.118 -6.437 0.936 898 HB3 LEU 115 3HB LEU 115 -7.625 -4.750 0.917 899 HG LEU 115 HG LEU 115 -8.101 -6.617 3.235 900 HD11 LEU 115 1HD1 LEU 115 -5.730 -6.402 2.974 901 HD12 LEU 115 2HD1 LEU 115 -6.238 -5.375 4.315 902 HD13 LEU 115 3HD1 LEU 115 -5.865 -4.658 2.748 903 HD21 LEU 115 3HD2 LEU 115 -8.255 -4.312 4.380 904 HD22 LEU 115 1HD2 LEU 115 -9.625 -4.873 3.421 905 HD23 LEU 115 2HD2 LEU 115 -8.505 -3.688 2.748 906 H ASP 116 H ASP 116 -8.442 -8.238 -0.467 907 HA ASP 116 HA ASP 116 -7.875 -7.195 -3.013 908 HB2 ASP 116 2HB ASP 116 -7.371 -9.552 -1.804 909 HB3 ASP 116 3HB ASP 116 -8.707 -10.034 -2.845 910 H THR 117 H THR 117 -9.057 -8.568 -4.949 911 HA THR 117 HA THR 117 -11.956 -8.297 -4.645 912 HB THR 117 HB THR 117 -10.854 -7.197 -7.168 913 HG1 THR 117 HG1 THR 117 -11.002 -5.457 -4.958 914 HG21 THR 117 3HG2 THR 117 -13.165 -7.106 -7.094 915 HG22 THR 117 1HG2 THR 117 -12.727 -5.495 -6.526 916 HG23 THR 117 2HG2 THR 117 -13.200 -6.740 -5.369 917 H ARG 118 H ARG 118 -9.507 -8.907 -7.173 918 HA ARG 118 HA ARG 118 -10.882 -11.441 -7.762 919 HB2 ARG 118 2HB ARG 118 -11.436 -9.700 -9.457 920 HB3 ARG 118 3HB ARG 118 -9.723 -9.568 -9.831 921 HG2 ARG 118 2HG ARG 118 -9.750 -11.389 -11.117 922 HG3 ARG 118 3HG ARG 118 -10.722 -12.302 -9.961 923 HD2 ARG 118 2HD ARG 118 -12.669 -11.762 -10.972 924 HD3 ARG 118 3HD ARG 118 -12.122 -10.138 -11.388 925 HE ARG 118 HE ARG 118 -10.743 -12.042 -12.946 926 HH11 ARG 118 1HH1 ARG 118 -13.884 -10.583 -12.590 927 HH12 ARG 118 2HH1 ARG 118 -14.314 -10.792 -14.255 928 HH21 ARG 118 1HH2 ARG 118 -11.297 -12.323 -15.141 929 HH22 ARG 118 2HH2 ARG 118 -12.842 -11.783 -15.705 930 HA PRO 119 HA PRO 119 -6.336 -12.067 -6.976 931 HB2 PRO 119 2HB PRO 119 -6.672 -14.147 -5.264 932 HB3 PRO 119 3HB PRO 119 -6.683 -12.459 -4.739 933 HG2 PRO 119 2HG PRO 119 -8.990 -14.288 -5.282 934 HG3 PRO 119 3HG PRO 119 -8.761 -13.142 -3.949 935 HD2 PRO 119 2HD PRO 119 -10.307 -12.583 -6.100 936 HD3 PRO 119 3HD PRO 119 -9.398 -11.333 -5.227 937 H SER 120 H SER 120 -5.224 -13.315 -8.339 938 HA SER 120 HA SER 120 -5.887 -16.038 -8.866 939 HB2 SER 120 2HB SER 120 -7.496 -15.430 -10.412 940 HB3 SER 120 3HB SER 120 -6.669 -13.933 -10.842 941 HG SER 120 HG SER 120 -6.317 -16.507 -11.818 942 H MET 121 H MET 121 -4.143 -17.139 -9.605 943 HA MET 121 HA MET 121 -2.025 -15.885 -11.068 944 HB2 MET 121 2HB MET 121 -1.670 -15.177 -8.641 945 HB3 MET 121 3HB MET 121 -1.303 -16.865 -8.311 946 HG2 MET 121 2HG MET 121 0.651 -16.820 -9.543 947 HG3 MET 121 3HG MET 121 0.147 -15.414 -10.478 948 HE1 MET 121 3HE MET 121 -0.761 -13.296 -8.762 949 HE2 MET 121 1HE MET 121 0.606 -12.481 -8.001 950 HE3 MET 121 2HE MET 121 0.660 -12.875 -9.720 951 H LYS 122 H LYS 122 -1.931 -17.478 -12.542 952 HA LYS 122 HA LYS 122 -2.085 -20.258 -11.784 953 HB2 LYS 122 2HB LYS 122 -2.163 -18.706 -14.272 954 HB3 LYS 122 3HB LYS 122 -1.308 -20.235 -14.421 955 HG2 LYS 122 2HG LYS 122 -3.408 -21.213 -13.234 956 HG3 LYS 122 3HG LYS 122 -4.177 -19.723 -13.787 957 HD2 LYS 122 2HD LYS 122 -4.191 -20.385 -15.938 958 HD3 LYS 122 3HD LYS 122 -2.585 -21.110 -15.827 959 HE2 LYS 122 2HE LYS 122 -4.551 -22.570 -14.274 960 HE3 LYS 122 3HE LYS 122 -5.008 -22.454 -15.973 961 HZ1 LYS 122 3HZ LYS 122 -2.256 -23.215 -15.293 962 HZ2 LYS 122 1HZ LYS 122 -3.188 -23.641 -16.639 963 HZ3 LYS 122 2HZ LYS 122 -3.480 -24.373 -15.143 964 H GLU 123 H GLU 123 0.346 -18.373 -13.599 965 HA GLU 123 HA GLU 123 2.609 -18.553 -13.746 966 HB2 GLU 123 2HB GLU 123 1.953 -19.052 -10.972 967 HB3 GLU 123 3HB GLU 123 3.388 -19.950 -11.446 968 HG2 GLU 123 2HG GLU 123 4.553 -17.997 -12.024 969 HG3 GLU 123 3HG GLU 123 3.085 -17.023 -12.020 970 H ALA 124 H ALA 124 2.665 -19.977 -15.474 971 HA ALA 124 HA ALA 124 3.656 -22.629 -14.830 972 HB1 ALA 124 1HB ALA 124 0.997 -22.437 -15.317 973 HB2 ALA 124 2HB ALA 124 1.618 -22.724 -16.943 974 HB3 ALA 124 3HB ALA 124 1.971 -23.870 -15.649 975 H GLY 125 H GLY 125 4.424 -23.775 -16.837 976 HA2 GLY 125 2HA GLY 125 5.409 -23.782 -18.948 977 HA3 GLY 125 3HA GLY 125 4.937 -22.101 -19.147 978 H GLY 126 H GLY 126 7.058 -21.732 -20.023 979 HA2 GLY 126 2HA GLY 126 8.889 -20.788 -18.042 980 HA3 GLY 126 3HA GLY 126 9.484 -22.244 -18.827 981 H LYS 127 H LYS 127 10.853 -19.842 -18.980 982 HA LYS 127 HA LYS 127 10.995 -19.512 -21.833 983 HB2 LYS 127 2HB LYS 127 10.739 -17.027 -21.747 984 HB3 LYS 127 3HB LYS 127 9.250 -17.912 -21.438 985 HG2 LYS 127 2HG LYS 127 10.643 -17.395 -18.976 986 HG3 LYS 127 3HG LYS 127 10.387 -15.900 -19.878 987 HD2 LYS 127 2HD LYS 127 8.028 -16.290 -19.986 988 HD3 LYS 127 3HD LYS 127 8.214 -17.913 -19.318 989 HE2 LYS 127 2HE LYS 127 9.252 -16.714 -17.285 990 HE3 LYS 127 3HE LYS 127 8.503 -15.262 -17.947 991 HZ1 LYS 127 3HZ LYS 127 6.369 -16.558 -17.948 992 HZ2 LYS 127 1HZ LYS 127 6.979 -16.167 -16.420 993 HZ3 LYS 127 2HZ LYS 127 7.160 -17.736 -17.026 994 H GLU 128 H GLU 128 12.949 -18.619 -22.518 995 HA GLU 128 HA GLU 128 14.969 -18.386 -20.400 996 HB2 GLU 128 2HB GLU 128 14.928 -19.770 -22.868 997 HB3 GLU 128 3HB GLU 128 16.111 -18.480 -23.029 998 HG2 GLU 128 2HG GLU 128 17.356 -20.263 -22.238 999 HG3 GLU 128 3HG GLU 128 17.034 -19.313 -20.788 1000 H GLU 129 H GLU 129 16.734 -16.821 -20.761 1001 HA GLU 129 HA GLU 129 15.869 -14.449 -22.269 1002 HB2 GLU 129 2HB GLU 129 16.784 -13.052 -20.385 1003 HB3 GLU 129 3HB GLU 129 15.307 -13.929 -20.013 1004 HG2 GLU 129 2HG GLU 129 16.275 -15.075 -18.374 1005 HG3 GLU 129 3HG GLU 129 17.692 -15.444 -19.354 1006 H GLY 130 H GLY 130 17.431 -13.446 -23.416 1007 HA2 GLY 130 2HA GLY 130 20.021 -12.997 -23.044 1008 HA3 GLY 130 3HA GLY 130 20.060 -14.707 -23.447 1009 HA PRO 131 HA PRO 131 18.432 -12.375 -27.374 1010 HB2 PRO 131 2HB PRO 131 18.716 -9.675 -27.356 1011 HB3 PRO 131 3HB PRO 131 17.257 -10.491 -26.781 1012 HG2 PRO 131 2HG PRO 131 19.557 -9.393 -25.210 1013 HG3 PRO 131 3HG PRO 131 17.819 -9.277 -24.879 1014 HD2 PRO 131 2HD PRO 131 19.426 -11.057 -23.622 1015 HD3 PRO 131 3HD PRO 131 17.721 -11.397 -23.981 1016 HA PRO 132 HA PRO 132 22.382 -11.962 -29.260 1017 HB2 PRO 132 2HB PRO 132 21.830 -10.540 -31.506 1018 HB3 PRO 132 3HB PRO 132 21.344 -12.226 -31.293 1019 HG2 PRO 132 2HG PRO 132 19.729 -9.730 -30.940 1020 HG3 PRO 132 3HG PRO 132 19.273 -11.257 -31.717 1021 HD2 PRO 132 2HD PRO 132 18.510 -10.619 -29.198 1022 HD3 PRO 132 3HD PRO 132 18.823 -12.291 -29.706 1023 H GLN 133 H GLN 133 24.123 -10.541 -29.706 1024 HA GLN 133 HA GLN 133 23.696 -7.759 -28.835 1025 HB2 GLN 133 2HB GLN 133 26.046 -9.560 -28.228 1026 HB3 GLN 133 3HB GLN 133 25.987 -7.841 -27.861 1027 HG2 GLN 133 2HG GLN 133 23.826 -9.602 -26.825 1028 HG3 GLN 133 3HG GLN 133 25.409 -9.642 -26.049 1029 HE21 GLN 133 1HE2 GLN 133 22.568 -7.764 -26.679 1030 HE22 GLN 133 2HE2 GLN 133 22.910 -6.490 -25.563 1031 H ALA 134 H ALA 134 25.523 -6.296 -29.544 1032 HA ALA 134 HA ALA 134 26.968 -7.085 -31.913 1033 HB1 ALA 134 1HB ALA 134 25.001 -6.648 -33.085 1034 HB2 ALA 134 2HB ALA 134 24.594 -5.261 -32.073 1035 HB3 ALA 134 3HB ALA 134 25.919 -5.148 -33.232 1036 H TYR 135 H TYR 135 25.728 -4.050 -30.497 1037 HA TYR 135 HA TYR 135 26.781 -2.180 -29.748 1038 HB2 TYR 135 2HB TYR 135 28.045 -4.238 -28.511 1039 HB3 TYR 135 3HB TYR 135 29.400 -3.488 -29.347 1040 HD1 TYR 135 HD1 TYR 135 26.409 -2.280 -27.443 1041 HD2 TYR 135 HD2 TYR 135 30.616 -2.045 -28.037 1042 HE1 TYR 135 HE1 TYR 135 26.559 -0.586 -25.666 1043 HE2 TYR 135 HE2 TYR 135 30.778 -0.351 -26.261 1044 HH TYR 135 HH TYR 135 28.086 1.248 -24.995 Start of MODEL 9 1 H21 MYR 1 1H2 MYR 1 0.914 10.304 3.773 2 H22 MYR 1 2H2 MYR 1 -0.695 10.985 3.923 3 H31 MYR 1 1H3 MYR 1 -1.271 8.707 4.125 4 H32 MYR 1 2H3 MYR 1 -0.961 9.033 5.831 5 H41 MYR 1 1H4 MYR 1 0.312 7.054 5.427 6 H42 MYR 1 2H4 MYR 1 1.534 8.326 5.361 7 H51 MYR 1 1H5 MYR 1 1.143 8.381 2.764 8 H52 MYR 1 2H5 MYR 1 0.192 6.908 2.968 9 H61 MYR 1 1H6 MYR 1 2.095 5.619 3.723 10 H62 MYR 1 2H6 MYR 1 3.034 7.057 4.133 11 H71 MYR 1 1H7 MYR 1 3.989 6.202 2.071 12 H72 MYR 1 2H7 MYR 1 3.099 7.660 1.625 13 H81 MYR 1 1H8 MYR 1 1.243 6.387 0.685 14 H82 MYR 1 2H8 MYR 1 1.755 4.891 1.470 15 H91 MYR 1 1H9 MYR 1 3.715 4.671 0.003 16 H92 MYR 1 2H9 MYR 1 3.533 6.312 -0.617 17 H101 MYR 1 1H10 MYR 1 2.154 5.591 -2.274 18 H102 MYR 1 2H10 MYR 1 0.999 4.951 -1.116 19 H111 MYR 1 1H11 MYR 1 3.234 3.066 -1.256 20 H112 MYR 1 2H11 MYR 1 2.851 3.548 -2.901 21 H121 MYR 1 1H12 MYR 1 1.438 1.675 -2.614 22 H122 MYR 1 2H12 MYR 1 0.332 3.019 -2.329 23 H131 MYR 1 1H13 MYR 1 -0.096 2.316 -0.186 24 H132 MYR 1 2H13 MYR 1 1.621 2.319 0.223 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 2.160 11.917 4.677 29 HA2 GLY 2 2HA GLY 2 1.386 13.039 7.254 30 HA3 GLY 2 3HA GLY 2 2.853 12.071 7.239 31 H ASN 3 H ASN 3 3.993 13.970 7.916 32 HA ASN 3 HA ASN 3 4.052 16.393 6.540 33 HB2 ASN 3 2HB ASN 3 6.139 14.991 8.210 34 HB3 ASN 3 3HB ASN 3 6.383 16.606 7.550 35 HD21 ASN 3 1HD2 ASN 3 5.179 18.321 8.348 36 HD22 ASN 3 2HD2 ASN 3 4.307 18.219 9.837 37 H GLY 4 H GLY 4 5.918 13.430 6.038 38 HA2 GLY 4 2HA GLY 4 6.783 14.539 3.442 39 HA3 GLY 4 3HA GLY 4 7.897 13.653 4.473 40 H ALA 5 H ALA 5 7.706 12.708 2.022 41 HA ALA 5 HA ALA 5 5.979 10.333 2.285 42 HB1 ALA 5 1HB ALA 5 6.682 11.808 -0.250 43 HB2 ALA 5 2HB ALA 5 5.776 10.297 -0.165 44 HB3 ALA 5 3HB ALA 5 5.104 11.769 0.538 45 H SER 6 H SER 6 8.980 11.639 0.922 46 HA SER 6 HA SER 6 10.111 9.322 -0.066 47 HB2 SER 6 2HB SER 6 12.306 10.418 0.325 48 HB3 SER 6 3HB SER 6 11.132 11.506 -0.415 49 HG SER 6 HG SER 6 12.287 11.579 2.102 50 H ARG 7 H ARG 7 10.205 10.580 3.246 51 HA ARG 7 HA ARG 7 11.869 8.539 4.286 52 HB2 ARG 7 2HB ARG 7 10.439 10.837 5.291 53 HB3 ARG 7 3HB ARG 7 10.238 9.468 6.376 54 HG2 ARG 7 2HG ARG 7 12.773 9.219 6.257 55 HG3 ARG 7 3HG ARG 7 12.772 10.830 5.537 56 HD2 ARG 7 2HD ARG 7 11.338 11.489 7.581 57 HD3 ARG 7 3HD ARG 7 11.936 9.989 8.288 58 HE ARG 7 HE ARG 7 13.418 12.419 7.858 59 HH11 ARG 7 1HH1 ARG 7 13.612 8.975 8.327 60 HH12 ARG 7 2HH1 ARG 7 15.237 9.016 8.927 61 HH21 ARG 7 1HH2 ARG 7 15.558 12.487 8.647 62 HH22 ARG 7 2HH2 ARG 7 16.342 11.014 9.109 63 H ASP 8 H ASP 8 8.343 9.017 4.436 64 HA ASP 8 HA ASP 8 7.691 6.704 5.832 65 HB2 ASP 8 2HB ASP 8 6.279 8.775 4.686 66 HB3 ASP 8 3HB ASP 8 5.766 7.385 3.732 67 H TRP 9 H TRP 9 8.372 7.174 2.421 68 HA TRP 9 HA TRP 9 7.468 4.644 1.530 69 HB2 TRP 9 2HB TRP 9 7.808 6.477 -0.034 70 HB3 TRP 9 3HB TRP 9 9.527 6.520 0.349 71 HD1 TRP 9 HD1 TRP 9 11.080 4.659 -0.749 72 HE1 TRP 9 HE1 TRP 9 10.714 3.030 -2.707 73 HE3 TRP 9 HE3 TRP 9 6.000 5.040 -1.183 74 HZ2 TRP 9 HZ2 TRP 9 8.557 2.038 -4.235 75 HZ3 TRP 9 HZ3 TRP 9 4.863 3.718 -2.919 76 HH2 TRP 9 HH2 TRP 9 6.116 2.249 -4.412 77 H LYS 10 H LYS 10 10.780 5.833 2.126 78 HA LYS 10 HA LYS 10 12.148 3.471 1.720 79 HB2 LYS 10 2HB LYS 10 12.907 5.942 2.401 80 HB3 LYS 10 3HB LYS 10 13.035 5.186 3.984 81 HG2 LYS 10 2HG LYS 10 14.912 4.125 3.439 82 HG3 LYS 10 3HG LYS 10 14.258 3.590 1.889 83 HD2 LYS 10 2HD LYS 10 15.152 5.336 0.759 84 HD3 LYS 10 3HD LYS 10 14.910 6.462 2.097 85 HE2 LYS 10 2HE LYS 10 17.123 6.324 2.386 86 HE3 LYS 10 3HE LYS 10 16.798 4.745 3.099 87 HZ1 LYS 10 3HZ LYS 10 18.387 4.284 1.511 88 HZ2 LYS 10 1HZ LYS 10 17.764 5.388 0.391 89 HZ3 LYS 10 2HZ LYS 10 16.958 3.930 0.678 90 H MET 11 H MET 11 10.274 4.487 4.492 91 HA MET 11 HA MET 11 11.212 2.513 6.299 92 HB2 MET 11 2HB MET 11 9.967 4.631 6.896 93 HB3 MET 11 3HB MET 11 8.500 3.838 6.338 94 HG2 MET 11 2HG MET 11 8.445 2.383 8.105 95 HG3 MET 11 3HG MET 11 10.184 2.472 8.372 96 HE1 MET 11 3HE MET 11 11.358 3.862 9.757 97 HE2 MET 11 1HE MET 11 11.059 5.466 9.089 98 HE3 MET 11 2HE MET 11 10.769 5.156 10.801 99 H ALA 12 H ALA 12 8.240 2.707 4.340 100 HA ALA 12 HA ALA 12 7.136 0.259 5.015 101 HB1 ALA 12 1HB ALA 12 5.986 0.372 2.814 102 HB2 ALA 12 2HB ALA 12 5.879 1.863 3.751 103 HB3 ALA 12 3HB ALA 12 7.006 1.749 2.399 104 H ILE 13 H ILE 13 9.696 1.005 2.731 105 HA ILE 13 HA ILE 13 9.771 -1.535 1.467 106 HB ILE 13 HB ILE 13 11.965 0.524 1.736 107 HG12 ILE 13 2HG1 ILE 13 9.917 1.361 0.627 108 HG13 ILE 13 3HG1 ILE 13 11.281 1.266 -0.481 109 HG21 ILE 13 1HG2 ILE 13 11.724 -2.001 0.151 110 HG22 ILE 13 2HG2 ILE 13 12.704 -0.662 -0.443 111 HG23 ILE 13 3HG2 ILE 13 13.080 -1.408 1.109 112 HD11 ILE 13 3HD1 ILE 13 10.052 0.060 -1.857 113 HD12 ILE 13 1HD1 ILE 13 9.909 -1.195 -0.626 114 HD13 ILE 13 2HD1 ILE 13 8.709 0.095 -0.715 115 H LYS 14 H LYS 14 11.746 -0.091 4.052 116 HA LYS 14 HA LYS 14 13.401 -2.301 4.507 117 HB2 LYS 14 2HB LYS 14 13.615 0.095 5.402 118 HB3 LYS 14 3HB LYS 14 12.510 -0.409 6.674 119 HG2 LYS 14 2HG LYS 14 14.199 -2.331 7.049 120 HG3 LYS 14 3HG LYS 14 15.311 -1.302 6.144 121 HD2 LYS 14 2HD LYS 14 13.794 0.026 8.298 122 HD3 LYS 14 3HD LYS 14 14.979 -1.174 8.820 123 HE2 LYS 14 2HE LYS 14 16.681 -0.010 7.433 124 HE3 LYS 14 3HE LYS 14 15.484 1.233 7.074 125 HZ1 LYS 14 3HZ LYS 14 15.483 1.974 9.257 126 HZ2 LYS 14 1HZ LYS 14 17.117 1.636 8.981 127 HZ3 LYS 14 2HZ LYS 14 16.167 0.550 9.863 128 H ARG 15 H ARG 15 10.120 -1.686 5.421 129 HA ARG 15 HA ARG 15 10.000 -3.611 7.534 130 HB2 ARG 15 2HB ARG 15 7.922 -2.117 5.951 131 HB3 ARG 15 3HB ARG 15 7.474 -3.354 7.118 132 HG2 ARG 15 2HG ARG 15 9.206 -1.010 7.841 133 HG3 ARG 15 3HG ARG 15 7.444 -0.958 7.925 134 HD2 ARG 15 2HD ARG 15 7.419 -2.770 9.512 135 HD3 ARG 15 3HD ARG 15 9.160 -2.992 9.341 136 HE ARG 15 HE ARG 15 8.593 -0.353 10.173 137 HH11 ARG 15 1HH1 ARG 15 8.633 -3.633 11.339 138 HH12 ARG 15 2HH1 ARG 15 8.934 -3.183 12.985 139 HH21 ARG 15 1HH2 ARG 15 8.988 0.253 12.337 140 HH22 ARG 15 2HH2 ARG 15 9.134 -0.972 13.551 141 H CYS 16 H CYS 16 8.374 -3.601 4.357 142 HA CYS 16 HA CYS 16 7.730 -6.329 4.389 143 HB2 CYS 16 2HB CYS 16 7.342 -6.057 1.952 144 HB3 CYS 16 3HB CYS 16 6.582 -4.792 2.909 145 HG CYS 16 HG CYS 16 8.226 -2.780 2.191 146 H SER 17 H SER 17 10.660 -4.679 3.599 147 HA SER 17 HA SER 17 11.925 -6.426 1.878 148 HB2 SER 17 2HB SER 17 12.822 -4.470 3.914 149 HB3 SER 17 3HB SER 17 14.014 -5.674 3.425 150 HG SER 17 HG SER 17 13.977 -4.915 1.396 151 H ASN 18 H ASN 18 11.275 -6.775 5.285 152 HA ASN 18 HA ASN 18 12.930 -9.175 5.456 153 HB2 ASN 18 2HB ASN 18 11.462 -7.512 7.493 154 HB3 ASN 18 3HB ASN 18 12.091 -9.108 7.892 155 HD21 ASN 18 1HD2 ASN 18 13.439 -8.085 9.437 156 HD22 ASN 18 2HD2 ASN 18 14.896 -7.295 8.949 157 H VAL 19 H VAL 19 10.705 -9.316 3.726 158 HA VAL 19 HA VAL 19 8.981 -11.218 5.178 159 HB VAL 19 HB VAL 19 8.223 -9.487 2.820 160 HG11 VAL 19 1HG1 VAL 19 5.900 -10.496 3.769 161 HG12 VAL 19 2HG1 VAL 19 6.809 -11.195 2.428 162 HG13 VAL 19 3HG1 VAL 19 6.988 -11.854 4.054 163 HG21 VAL 19 3HG2 VAL 19 8.438 -8.429 5.144 164 HG22 VAL 19 1HG2 VAL 19 6.920 -8.199 4.276 165 HG23 VAL 19 2HG2 VAL 19 7.024 -9.392 5.571 166 H ALA 20 H ALA 20 8.551 -13.178 4.230 167 HA ALA 20 HA ALA 20 10.393 -14.008 2.156 168 HB1 ALA 20 1HB ALA 20 8.299 -15.720 3.467 169 HB2 ALA 20 2HB ALA 20 9.807 -16.224 2.703 170 HB3 ALA 20 3HB ALA 20 9.843 -15.352 4.236 171 H VAL 21 H VAL 21 9.522 -15.512 0.417 172 HA VAL 21 HA VAL 21 7.241 -14.186 -0.862 173 HB VAL 21 HB VAL 21 9.254 -16.069 -2.098 174 HG11 VAL 21 1HG1 VAL 21 8.309 -14.698 -4.163 175 HG12 VAL 21 2HG1 VAL 21 7.524 -16.166 -3.578 176 HG13 VAL 21 3HG1 VAL 21 6.894 -14.585 -3.116 177 HG21 VAL 21 3HG2 VAL 21 10.691 -14.376 -2.158 178 HG22 VAL 21 1HG2 VAL 21 9.522 -13.428 -3.077 179 HG23 VAL 21 2HG2 VAL 21 9.536 -13.344 -1.315 180 H GLY 22 H GLY 22 8.493 -17.421 -0.103 181 HA2 GLY 22 2HA GLY 22 5.943 -18.612 -0.901 182 HA3 GLY 22 3HA GLY 22 7.410 -19.485 -0.483 183 H VAL 23 H VAL 23 5.467 -20.640 0.650 184 HA VAL 23 HA VAL 23 5.389 -19.624 3.413 185 HB VAL 23 HB VAL 23 3.122 -20.493 3.677 186 HG11 VAL 23 1HG1 VAL 23 2.001 -18.905 1.961 187 HG12 VAL 23 2HG1 VAL 23 3.076 -18.229 3.186 188 HG13 VAL 23 3HG1 VAL 23 3.657 -18.471 1.537 189 HG21 VAL 23 3HG2 VAL 23 1.845 -21.134 1.613 190 HG22 VAL 23 1HG2 VAL 23 3.388 -21.200 0.761 191 HG23 VAL 23 2HG2 VAL 23 3.080 -22.291 2.112 192 H GLY 24 H GLY 24 7.146 -21.589 2.093 193 HA2 GLY 24 2HA GLY 24 6.501 -23.891 3.824 194 HA3 GLY 24 3HA GLY 24 7.053 -24.129 2.172 195 H GLY 25 H GLY 25 7.968 -23.475 5.424 196 HA2 GLY 25 2HA GLY 25 10.013 -23.385 6.462 197 HA3 GLY 25 3HA GLY 25 10.608 -24.312 5.093 198 H LYS 26 H LYS 26 12.595 -23.206 5.150 199 HA LYS 26 HA LYS 26 12.725 -20.357 4.905 200 HB2 LYS 26 2HB LYS 26 14.585 -22.559 5.228 201 HB3 LYS 26 3HB LYS 26 15.168 -21.400 4.042 202 HG2 LYS 26 2HG LYS 26 15.859 -20.090 5.681 203 HG3 LYS 26 3HG LYS 26 14.194 -19.923 6.243 204 HD2 LYS 26 2HD LYS 26 15.759 -22.361 6.972 205 HD3 LYS 26 3HD LYS 26 16.042 -20.852 7.844 206 HE2 LYS 26 2HE LYS 26 13.362 -20.910 7.910 207 HE3 LYS 26 3HE LYS 26 13.686 -22.641 7.843 208 HZ1 LYS 26 3HZ LYS 26 13.628 -22.096 10.105 209 HZ2 LYS 26 1HZ LYS 26 14.560 -20.699 9.897 210 HZ3 LYS 26 2HZ LYS 26 15.276 -22.224 9.744 211 H SER 27 H SER 27 12.088 -19.344 3.122 212 HA SER 27 HA SER 27 12.913 -20.452 0.522 213 HB2 SER 27 2HB SER 27 10.283 -19.080 1.129 214 HB3 SER 27 3HB SER 27 10.808 -19.642 -0.458 215 HG SER 27 HG SER 27 9.775 -21.382 0.164 216 H LYS 28 H LYS 28 12.582 -18.647 -1.230 217 HA LYS 28 HA LYS 28 14.383 -16.563 -0.595 218 HB2 LYS 28 2HB LYS 28 12.911 -17.487 -2.947 219 HB3 LYS 28 3HB LYS 28 13.109 -15.740 -2.903 220 HG2 LYS 28 2HG LYS 28 15.565 -16.141 -2.526 221 HG3 LYS 28 3HG LYS 28 15.257 -17.842 -2.885 222 HD2 LYS 28 2HD LYS 28 15.183 -17.451 -5.081 223 HD3 LYS 28 3HD LYS 28 14.081 -16.088 -4.871 224 HE2 LYS 28 2HE LYS 28 16.202 -14.828 -4.068 225 HE3 LYS 28 3HE LYS 28 17.074 -16.120 -4.890 226 HZ1 LYS 28 3HZ LYS 28 16.831 -14.883 -6.707 227 HZ2 LYS 28 1HZ LYS 28 15.667 -13.883 -5.995 228 HZ3 LYS 28 2HZ LYS 28 15.204 -15.347 -6.705 229 H LYS 29 H LYS 29 14.051 -14.335 -0.408 230 HA LYS 29 HA LYS 29 11.331 -13.591 0.434 231 HB2 LYS 29 2HB LYS 29 12.523 -11.699 1.628 232 HB3 LYS 29 3HB LYS 29 12.820 -13.314 2.257 233 HG2 LYS 29 2HG LYS 29 14.715 -12.321 0.220 234 HG3 LYS 29 3HG LYS 29 14.760 -11.539 1.802 235 HD2 LYS 29 2HD LYS 29 14.757 -14.526 1.583 236 HD3 LYS 29 3HD LYS 29 16.254 -13.615 1.371 237 HE2 LYS 29 2HE LYS 29 14.677 -12.834 3.715 238 HE3 LYS 29 3HE LYS 29 15.273 -14.492 3.760 239 HZ1 LYS 29 3HZ LYS 29 17.193 -13.645 4.438 240 HZ2 LYS 29 1HZ LYS 29 16.700 -12.058 4.122 241 HZ3 LYS 29 2HZ LYS 29 17.398 -12.987 2.893 242 H PHE 30 H PHE 30 10.951 -11.130 0.187 243 HA PHE 30 HA PHE 30 11.519 -10.473 -2.609 244 HB2 PHE 30 2HB PHE 30 9.368 -9.706 -0.674 245 HB3 PHE 30 3HB PHE 30 9.717 -8.644 -2.035 246 HD1 PHE 30 HD2 PHE 30 10.115 -10.209 -4.299 247 HD2 PHE 30 HD1 PHE 30 7.528 -11.013 -1.016 248 HE1 PHE 30 HE2 PHE 30 8.712 -11.612 -5.753 249 HE2 PHE 30 HE1 PHE 30 6.121 -12.418 -2.465 250 HZ PHE 30 HZ PHE 30 6.711 -12.718 -4.837 251 H GLY 31 H GLY 31 12.120 -8.314 -3.214 252 HA2 GLY 31 2HA GLY 31 13.438 -6.801 -1.047 253 HA3 GLY 31 3HA GLY 31 14.256 -7.120 -2.569 254 H GLU 32 H GLU 32 14.052 -4.553 -1.754 255 HA GLU 32 HA GLU 32 11.816 -3.081 -2.427 256 HB2 GLU 32 2HB GLU 32 13.279 -1.180 -2.681 257 HB3 GLU 32 3HB GLU 32 13.862 -2.172 -1.352 258 HG2 GLU 32 2HG GLU 32 15.840 -1.847 -2.367 259 HG3 GLU 32 3HG GLU 32 15.312 -3.219 -3.339 260 H GLY 33 H GLY 33 14.173 -4.587 -4.513 261 HA2 GLY 33 2HA GLY 33 13.671 -3.180 -6.888 262 HA3 GLY 33 3HA GLY 33 14.272 -4.829 -6.792 263 H ASN 34 H ASN 34 12.199 -6.192 -5.687 264 HA ASN 34 HA ASN 34 10.375 -6.340 -7.899 265 HB2 ASN 34 2HB ASN 34 10.926 -7.939 -5.455 266 HB3 ASN 34 3HB ASN 34 9.313 -8.076 -6.150 267 HD21 ASN 34 1HD2 ASN 34 9.288 -9.965 -7.152 268 HD22 ASN 34 2HD2 ASN 34 10.448 -10.502 -8.314 269 H PHE 35 H PHE 35 10.245 -5.225 -4.567 270 HA PHE 35 HA PHE 35 7.478 -4.934 -4.305 271 HB2 PHE 35 2HB PHE 35 9.802 -3.498 -3.038 272 HB3 PHE 35 3HB PHE 35 8.137 -3.094 -2.634 273 HD1 PHE 35 HD1 PHE 35 6.731 -5.510 -2.365 274 HD2 PHE 35 HD2 PHE 35 10.797 -4.723 -1.384 275 HE1 PHE 35 HE1 PHE 35 6.685 -7.341 -0.723 276 HE2 PHE 35 HE2 PHE 35 10.758 -6.553 0.260 277 HZ PHE 35 HZ PHE 35 8.700 -7.866 0.592 278 H ARG 36 H ARG 36 9.919 -2.609 -5.429 279 HA ARG 36 HA ARG 36 8.024 -0.549 -5.971 280 HB2 ARG 36 2HB ARG 36 10.828 -0.874 -7.054 281 HB3 ARG 36 3HB ARG 36 9.878 0.605 -7.052 282 HG2 ARG 36 2HG ARG 36 10.132 0.927 -4.782 283 HG3 ARG 36 3HG ARG 36 10.482 -0.776 -4.477 284 HD2 ARG 36 2HD ARG 36 12.657 -0.351 -4.588 285 HD3 ARG 36 3HD ARG 36 12.462 0.217 -6.246 286 HE ARG 36 HE ARG 36 12.786 1.828 -3.886 287 HH11 ARG 36 1HH1 ARG 36 11.593 1.736 -7.155 288 HH12 ARG 36 2HH1 ARG 36 11.705 3.449 -7.383 289 HH21 ARG 36 1HH2 ARG 36 12.938 4.086 -4.173 290 HH22 ARG 36 2HH2 ARG 36 12.471 4.785 -5.686 291 H TRP 37 H TRP 37 9.690 -2.958 -7.964 292 HA TRP 37 HA TRP 37 8.795 -2.112 -10.466 293 HB2 TRP 37 2HB TRP 37 10.533 -3.760 -10.322 294 HB3 TRP 37 3HB TRP 37 9.483 -4.872 -9.448 295 HD1 TRP 37 HD1 TRP 37 10.429 -3.789 -12.937 296 HE1 TRP 37 HE1 TRP 37 9.189 -5.254 -14.652 297 HE3 TRP 37 HE3 TRP 37 7.187 -6.169 -9.780 298 HZ2 TRP 37 HZ2 TRP 37 7.112 -7.165 -14.665 299 HZ3 TRP 37 HZ3 TRP 37 5.606 -7.800 -10.724 300 HH2 TRP 37 HH2 TRP 37 5.570 -8.286 -13.116 301 H ALA 38 H ALA 38 7.171 -3.890 -7.950 302 HA ALA 38 HA ALA 38 5.001 -4.776 -9.617 303 HB1 ALA 38 1HB ALA 38 5.377 -4.748 -6.629 304 HB2 ALA 38 2HB ALA 38 3.955 -5.411 -7.435 305 HB3 ALA 38 3HB ALA 38 5.543 -6.121 -7.723 306 H ILE 39 H ILE 39 5.119 -2.534 -6.838 307 HA ILE 39 HA ILE 39 2.583 -1.449 -7.162 308 HB ILE 39 HB ILE 39 3.876 -1.058 -5.147 309 HG12 ILE 39 2HG1 ILE 39 3.463 1.369 -4.880 310 HG13 ILE 39 3HG1 ILE 39 3.255 1.512 -6.622 311 HG21 ILE 39 1HG2 ILE 39 5.613 0.844 -6.697 312 HG22 ILE 39 2HG2 ILE 39 5.824 0.271 -5.043 313 HG23 ILE 39 3HG2 ILE 39 6.065 -0.834 -6.396 314 HD11 ILE 39 3HD1 ILE 39 1.521 -0.060 -4.732 315 HD12 ILE 39 1HD1 ILE 39 1.111 1.457 -5.533 316 HD13 ILE 39 2HD1 ILE 39 1.329 -0.012 -6.484 317 H ARG 40 H ARG 40 5.635 -0.550 -8.674 318 HA ARG 40 HA ARG 40 4.650 1.822 -9.908 319 HB2 ARG 40 2HB ARG 40 7.044 1.458 -9.493 320 HB3 ARG 40 3HB ARG 40 7.038 0.111 -10.623 321 HG2 ARG 40 2HG ARG 40 6.378 1.696 -12.419 322 HG3 ARG 40 3HG ARG 40 6.569 3.014 -11.261 323 HD2 ARG 40 2HD ARG 40 8.786 3.015 -11.496 324 HD3 ARG 40 3HD ARG 40 8.878 1.266 -11.300 325 HE ARG 40 HE ARG 40 7.901 1.889 -13.870 326 HH11 ARG 40 1HH1 ARG 40 10.824 1.980 -11.982 327 HH12 ARG 40 2HH1 ARG 40 11.870 1.817 -13.354 328 HH21 ARG 40 1HH2 ARG 40 9.267 1.674 -15.684 329 HH22 ARG 40 2HH2 ARG 40 10.983 1.644 -15.459 330 H MET 41 H MET 41 5.181 -1.499 -11.048 331 HA MET 41 HA MET 41 4.526 -1.198 -13.711 332 HB2 MET 41 2HB MET 41 5.376 -3.292 -12.931 333 HB3 MET 41 3HB MET 41 4.020 -3.504 -11.833 334 HG2 MET 41 2HG MET 41 2.831 -4.523 -13.393 335 HG3 MET 41 3HG MET 41 3.078 -3.195 -14.525 336 HE1 MET 41 3HE MET 41 5.029 -2.931 -16.071 337 HE2 MET 41 1HE MET 41 5.632 -4.341 -16.943 338 HE3 MET 41 2HE MET 41 3.902 -4.001 -16.906 339 H ALA 42 H ALA 42 2.375 -1.591 -10.938 340 HA ALA 42 HA ALA 42 0.011 -1.549 -12.614 341 HB1 ALA 42 1HB ALA 42 0.123 -2.957 -10.587 342 HB2 ALA 42 2HB ALA 42 0.205 -1.493 -9.606 343 HB3 ALA 42 3HB ALA 42 -1.234 -1.831 -10.568 344 H ASN 43 H ASN 43 1.785 0.622 -10.501 345 HA ASN 43 HA ASN 43 -0.115 2.648 -10.215 346 HB2 ASN 43 2HB ASN 43 1.914 2.638 -8.889 347 HB3 ASN 43 3HB ASN 43 2.903 2.826 -10.334 348 HD21 ASN 43 1HD2 ASN 43 3.834 4.700 -9.489 349 HD22 ASN 43 2HD2 ASN 43 2.978 6.200 -9.446 350 H VAL 44 H VAL 44 1.821 1.733 -12.928 351 HA VAL 44 HA VAL 44 1.105 4.203 -14.352 352 HB VAL 44 HB VAL 44 3.045 2.072 -15.250 353 HG11 VAL 44 1HG1 VAL 44 1.960 4.474 -16.449 354 HG12 VAL 44 2HG1 VAL 44 3.722 4.522 -16.360 355 HG13 VAL 44 3HG1 VAL 44 2.915 3.182 -17.176 356 HG21 VAL 44 3HG2 VAL 44 4.271 2.823 -13.505 357 HG22 VAL 44 1HG2 VAL 44 4.618 4.158 -14.604 358 HG23 VAL 44 2HG2 VAL 44 3.363 4.329 -13.376 359 H SER 45 H SER 45 1.230 0.678 -14.867 360 HA SER 45 HA SER 45 -0.142 0.586 -17.279 361 HB2 SER 45 2HB SER 45 1.005 -1.364 -16.371 362 HB3 SER 45 3HB SER 45 -0.138 -1.442 -15.030 363 HG SER 45 HG SER 45 -1.327 -2.613 -16.288 364 H THR 46 H THR 46 -1.351 0.877 -14.007 365 HA THR 46 HA THR 46 -4.069 1.181 -15.101 366 HB THR 46 HB THR 46 -5.042 0.123 -13.202 367 HG1 THR 46 HG1 THR 46 -3.827 0.678 -11.477 368 HG21 THR 46 3HG2 THR 46 -4.379 -2.098 -13.507 369 HG22 THR 46 1HG2 THR 46 -2.692 -1.657 -13.772 370 HG23 THR 46 2HG2 THR 46 -3.899 -1.314 -15.012 371 H GLY 47 H GLY 47 -2.188 3.275 -14.705 372 HA2 GLY 47 2HA GLY 47 -3.747 4.920 -12.878 373 HA3 GLY 47 3HA GLY 47 -2.050 4.718 -12.467 374 H ARG 48 H ARG 48 -0.521 5.879 -13.537 375 HA ARG 48 HA ARG 48 -0.784 7.043 -16.062 376 HB2 ARG 48 2HB ARG 48 -1.019 9.455 -15.318 377 HB3 ARG 48 3HB ARG 48 -2.480 8.480 -15.242 378 HG2 ARG 48 2HG ARG 48 -2.637 8.657 -13.013 379 HG3 ARG 48 3HG ARG 48 -0.894 8.512 -12.776 380 HD2 ARG 48 2HD ARG 48 -0.550 10.807 -13.279 381 HD3 ARG 48 3HD ARG 48 -2.200 10.992 -13.870 382 HE ARG 48 HE ARG 48 -2.216 10.179 -11.164 383 HH11 ARG 48 1HH1 ARG 48 -1.564 12.938 -13.185 384 HH12 ARG 48 2HH1 ARG 48 -1.963 14.095 -11.958 385 HH21 ARG 48 1HH2 ARG 48 -2.744 11.693 -9.541 386 HH22 ARG 48 2HH2 ARG 48 -2.633 13.385 -9.886 387 H GLU 49 H GLU 49 1.346 6.421 -16.252 388 HA GLU 49 HA GLU 49 3.609 6.643 -16.175 389 HB2 GLU 49 2HB GLU 49 2.583 9.296 -15.473 390 HB3 GLU 49 3HB GLU 49 4.199 8.983 -14.856 391 HG2 GLU 49 2HG GLU 49 4.339 8.085 -17.450 392 HG3 GLU 49 3HG GLU 49 3.303 9.506 -17.568 393 HA PRO 50 HA PRO 50 5.017 5.154 -12.298 394 HB2 PRO 50 2HB PRO 50 7.625 5.907 -12.290 395 HB3 PRO 50 3HB PRO 50 7.000 4.620 -13.328 396 HG2 PRO 50 2HG PRO 50 7.574 7.481 -13.996 397 HG3 PRO 50 3HG PRO 50 7.931 6.020 -14.935 398 HD2 PRO 50 2HD PRO 50 5.812 7.617 -15.475 399 HD3 PRO 50 3HD PRO 50 5.779 5.862 -15.745 400 H GLY 51 H GLY 51 5.913 8.521 -12.977 401 HA2 GLY 51 2HA GLY 51 6.489 9.220 -10.288 402 HA3 GLY 51 3HA GLY 51 6.149 10.343 -11.597 403 H ASP 52 H ASP 52 4.761 8.426 -9.020 404 HA ASP 52 HA ASP 52 2.765 10.302 -8.431 405 HB2 ASP 52 2HB ASP 52 2.083 8.431 -10.534 406 HB3 ASP 52 3HB ASP 52 1.008 8.245 -9.152 407 H ILE 53 H ILE 53 3.049 10.016 -6.302 408 HA ILE 53 HA ILE 53 2.802 7.284 -5.227 409 HB ILE 53 HB ILE 53 4.050 9.654 -3.837 410 HG12 ILE 53 2HG1 ILE 53 5.330 9.054 -5.857 411 HG13 ILE 53 3HG1 ILE 53 6.219 8.671 -4.387 412 HG21 ILE 53 1HG2 ILE 53 5.106 7.655 -2.552 413 HG22 ILE 53 2HG2 ILE 53 3.463 8.167 -2.172 414 HG23 ILE 53 3HG2 ILE 53 3.732 6.754 -3.193 415 HD11 ILE 53 3HD1 ILE 53 4.692 6.709 -6.081 416 HD12 ILE 53 1HD1 ILE 53 6.443 6.918 -6.055 417 HD13 ILE 53 2HD1 ILE 53 5.604 6.329 -4.620 418 HA PRO 54 HA PRO 54 -1.046 9.472 -3.914 419 HB2 PRO 54 2HB PRO 54 -2.640 7.294 -4.206 420 HB3 PRO 54 3HB PRO 54 -2.253 8.387 -5.540 421 HG2 PRO 54 2HG PRO 54 -1.046 5.736 -4.852 422 HG3 PRO 54 3HG PRO 54 -1.516 6.374 -6.439 423 HD2 PRO 54 2HD PRO 54 1.050 6.366 -5.574 424 HD3 PRO 54 3HD PRO 54 0.407 7.628 -6.644 425 H GLU 55 H GLU 55 -1.289 9.679 -1.785 426 HA GLU 55 HA GLU 55 -0.620 7.442 -0.030 427 HB2 GLU 55 2HB GLU 55 -1.334 10.257 0.787 428 HB3 GLU 55 3HB GLU 55 -0.508 9.037 1.746 429 HG2 GLU 55 2HG GLU 55 1.392 9.978 1.109 430 HG3 GLU 55 3HG GLU 55 1.088 9.315 -0.495 431 H THR 56 H THR 56 -2.961 7.067 -1.463 432 HA THR 56 HA THR 56 -5.048 7.445 0.586 433 HB THR 56 HB THR 56 -5.780 8.601 -1.343 434 HG1 THR 56 HG1 THR 56 -7.613 7.392 -1.905 435 HG21 THR 56 3HG2 THR 56 -5.781 7.660 -3.586 436 HG22 THR 56 1HG2 THR 56 -5.097 6.153 -2.976 437 HG23 THR 56 2HG2 THR 56 -4.147 7.638 -2.922 438 H LEU 57 H LEU 57 -5.547 5.654 1.649 439 HA LEU 57 HA LEU 57 -4.694 3.073 0.810 440 HB2 LEU 57 2HB LEU 57 -5.677 4.266 3.169 441 HB3 LEU 57 3HB LEU 57 -6.756 2.925 2.788 442 HG LEU 57 HG LEU 57 -3.782 2.788 3.268 443 HD11 LEU 57 1HD1 LEU 57 -4.703 1.143 5.048 444 HD12 LEU 57 2HD1 LEU 57 -6.215 2.023 4.825 445 HD13 LEU 57 3HD1 LEU 57 -4.767 2.879 5.355 446 HD21 LEU 57 3HD2 LEU 57 -5.718 0.649 2.394 447 HD22 LEU 57 1HD2 LEU 57 -4.095 0.337 3.010 448 HD23 LEU 57 2HD2 LEU 57 -4.309 1.240 1.511 449 H ASP 58 H ASP 58 -7.620 4.904 0.438 450 HA ASP 58 HA ASP 58 -9.351 2.734 -0.167 451 HB2 ASP 58 2HB ASP 58 -10.046 5.077 0.509 452 HB3 ASP 58 3HB ASP 58 -9.651 5.580 -1.132 453 H GLN 59 H GLN 59 -7.876 5.181 -2.308 454 HA GLN 59 HA GLN 59 -8.607 3.988 -4.719 455 HB2 GLN 59 2HB GLN 59 -7.358 6.291 -4.049 456 HB3 GLN 59 3HB GLN 59 -5.993 5.370 -4.668 457 HG2 GLN 59 2HG GLN 59 -8.073 5.007 -6.510 458 HG3 GLN 59 3HG GLN 59 -8.074 6.721 -6.095 459 HE21 GLN 59 1HE2 GLN 59 -6.814 7.940 -7.289 460 HE22 GLN 59 2HE2 GLN 59 -5.392 7.431 -8.128 461 H LEU 60 H LEU 60 -5.708 3.545 -2.740 462 HA LEU 60 HA LEU 60 -4.261 1.918 -4.489 463 HB2 LEU 60 2HB LEU 60 -3.254 2.879 -2.521 464 HB3 LEU 60 3HB LEU 60 -4.330 1.954 -1.477 465 HG LEU 60 HG LEU 60 -3.130 -0.070 -2.756 466 HD11 LEU 60 1HD1 LEU 60 -0.613 0.769 -2.609 467 HD12 LEU 60 2HD1 LEU 60 -1.369 2.289 -3.085 468 HD13 LEU 60 3HD1 LEU 60 -1.553 0.858 -4.098 469 HD21 LEU 60 3HD2 LEU 60 -3.309 0.404 -0.298 470 HD22 LEU 60 1HD2 LEU 60 -1.831 1.356 -0.443 471 HD23 LEU 60 2HD2 LEU 60 -1.806 -0.371 -0.802 472 H ARG 61 H ARG 61 -6.509 1.000 -1.887 473 HA ARG 61 HA ARG 61 -6.335 -1.757 -2.147 474 HB2 ARG 61 2HB ARG 61 -7.503 -0.787 -0.284 475 HB3 ARG 61 3HB ARG 61 -8.672 -0.019 -1.350 476 HG2 ARG 61 2HG ARG 61 -9.629 -2.131 -1.932 477 HG3 ARG 61 3HG ARG 61 -8.354 -2.998 -1.073 478 HD2 ARG 61 2HD ARG 61 -9.219 -2.497 0.993 479 HD3 ARG 61 3HD ARG 61 -9.997 -1.020 0.427 480 HE ARG 61 HE ARG 61 -11.262 -3.158 -0.823 481 HH11 ARG 61 1HH1 ARG 61 -10.817 -1.912 2.397 482 HH12 ARG 61 2HH1 ARG 61 -12.323 -2.534 2.987 483 HH21 ARG 61 1HH2 ARG 61 -13.247 -3.982 -0.059 484 HH22 ARG 61 2HH2 ARG 61 -13.704 -3.712 1.589 485 H LEU 62 H LEU 62 -8.401 0.535 -3.884 486 HA LEU 62 HA LEU 62 -9.873 -1.386 -5.334 487 HB2 LEU 62 2HB LEU 62 -10.653 0.886 -5.108 488 HB3 LEU 62 3HB LEU 62 -9.232 1.492 -5.956 489 HG LEU 62 HG LEU 62 -10.008 0.447 -8.021 490 HD11 LEU 62 1HD1 LEU 62 -11.202 -1.443 -7.483 491 HD12 LEU 62 2HD1 LEU 62 -12.497 -0.325 -7.908 492 HD13 LEU 62 3HD1 LEU 62 -12.120 -0.635 -6.213 493 HD21 LEU 62 3HD2 LEU 62 -11.132 2.312 -8.453 494 HD22 LEU 62 1HD2 LEU 62 -11.135 2.658 -6.723 495 HD23 LEU 62 2HD2 LEU 62 -12.486 1.787 -7.451 496 H VAL 63 H VAL 63 -6.858 0.320 -6.006 497 HA VAL 63 HA VAL 63 -6.507 -0.407 -8.672 498 HB VAL 63 HB VAL 63 -4.376 -0.043 -6.560 499 HG11 VAL 63 1HG1 VAL 63 -2.956 0.554 -8.550 500 HG12 VAL 63 2HG1 VAL 63 -3.388 -1.151 -8.415 501 HG13 VAL 63 3HG1 VAL 63 -4.232 -0.115 -9.567 502 HG21 VAL 63 3HG2 VAL 63 -4.660 2.131 -8.414 503 HG22 VAL 63 1HG2 VAL 63 -6.203 1.799 -7.626 504 HG23 VAL 63 2HG2 VAL 63 -4.772 2.143 -6.654 505 H ILE 64 H ILE 64 -5.481 -2.098 -5.720 506 HA ILE 64 HA ILE 64 -4.172 -4.238 -6.971 507 HB ILE 64 HB ILE 64 -5.619 -4.235 -4.319 508 HG12 ILE 64 2HG1 ILE 64 -2.658 -3.915 -4.766 509 HG13 ILE 64 3HG1 ILE 64 -3.739 -2.526 -4.751 510 HG21 ILE 64 1HG2 ILE 64 -5.277 -6.477 -4.730 511 HG22 ILE 64 2HG2 ILE 64 -3.801 -6.192 -5.650 512 HG23 ILE 64 3HG2 ILE 64 -3.787 -6.041 -3.893 513 HD11 ILE 64 3HD1 ILE 64 -4.498 -3.337 -2.472 514 HD12 ILE 64 1HD1 ILE 64 -3.105 -4.417 -2.515 515 HD13 ILE 64 2HD1 ILE 64 -2.869 -2.671 -2.585 516 H CYS 65 H CYS 65 -7.504 -4.035 -5.722 517 HA CYS 65 HA CYS 65 -8.311 -6.592 -6.531 518 HB2 CYS 65 2HB CYS 65 -9.473 -4.488 -5.172 519 HB3 CYS 65 3HB CYS 65 -10.429 -4.578 -6.646 520 HG CYS 65 HG CYS 65 -10.002 -7.041 -4.316 521 H ASP 66 H ASP 66 -8.295 -3.509 -8.229 522 HA ASP 66 HA ASP 66 -9.777 -4.389 -10.486 523 HB2 ASP 66 2HB ASP 66 -9.176 -1.967 -9.667 524 HB3 ASP 66 3HB ASP 66 -7.749 -2.193 -10.674 525 H LEU 67 H LEU 67 -6.293 -3.667 -10.182 526 HA LEU 67 HA LEU 67 -5.482 -4.680 -12.623 527 HB2 LEU 67 2HB LEU 67 -3.968 -3.405 -11.305 528 HB3 LEU 67 3HB LEU 67 -4.056 -4.560 -9.977 529 HG LEU 67 HG LEU 67 -3.096 -5.944 -12.260 530 HD11 LEU 67 1HD1 LEU 67 -2.082 -3.180 -11.985 531 HD12 LEU 67 2HD1 LEU 67 -2.184 -4.219 -13.406 532 HD13 LEU 67 3HD1 LEU 67 -0.885 -4.451 -12.236 533 HD21 LEU 67 3HD2 LEU 67 -2.687 -6.036 -9.638 534 HD22 LEU 67 1HD2 LEU 67 -1.272 -5.084 -10.085 535 HD23 LEU 67 2HD2 LEU 67 -1.521 -6.680 -10.794 536 H GLN 68 H GLN 68 -5.938 -6.373 -9.555 537 HA GLN 68 HA GLN 68 -4.899 -8.862 -10.372 538 HB2 GLN 68 2HB GLN 68 -5.414 -8.089 -8.003 539 HB3 GLN 68 3HB GLN 68 -7.096 -8.477 -8.343 540 HG2 GLN 68 2HG GLN 68 -5.606 -10.728 -9.102 541 HG3 GLN 68 3HG GLN 68 -4.956 -10.202 -7.550 542 HE21 GLN 68 1HE2 GLN 68 -5.953 -10.910 -5.807 543 HE22 GLN 68 2HE2 GLN 68 -7.568 -11.518 -5.736 544 H GLU 69 H GLU 69 -8.129 -7.457 -10.562 545 HA GLU 69 HA GLU 69 -9.444 -9.807 -11.444 546 HB2 GLU 69 2HB GLU 69 -10.503 -7.699 -10.477 547 HB3 GLU 69 3HB GLU 69 -10.298 -6.985 -12.070 548 HG2 GLU 69 2HG GLU 69 -11.530 -9.360 -12.643 549 HG3 GLU 69 3HG GLU 69 -12.273 -8.898 -11.113 550 H ARG 70 H ARG 70 -8.046 -7.039 -13.164 551 HA ARG 70 HA ARG 70 -8.788 -7.895 -15.755 552 HB2 ARG 70 2HB ARG 70 -6.682 -5.992 -14.746 553 HB3 ARG 70 3HB ARG 70 -6.898 -6.319 -16.460 554 HG2 ARG 70 2HG ARG 70 -9.251 -5.571 -16.258 555 HG3 ARG 70 3HG ARG 70 -8.926 -5.133 -14.579 556 HD2 ARG 70 2HD ARG 70 -7.221 -3.556 -15.304 557 HD3 ARG 70 3HD ARG 70 -7.484 -4.022 -16.984 558 HE ARG 70 HE ARG 70 -9.856 -3.073 -15.672 559 HH11 ARG 70 1HH1 ARG 70 -6.987 -2.144 -17.411 560 HH12 ARG 70 2HH1 ARG 70 -7.652 -0.644 -17.967 561 HH21 ARG 70 1HH2 ARG 70 -10.743 -1.101 -16.397 562 HH22 ARG 70 2HH2 ARG 70 -9.788 -0.051 -17.389 563 H ARG 71 H ARG 71 -5.595 -7.960 -14.158 564 HA ARG 71 HA ARG 71 -4.221 -9.398 -16.073 565 HB2 ARG 71 2HB ARG 71 -3.910 -8.971 -13.153 566 HB3 ARG 71 3HB ARG 71 -3.002 -10.302 -13.857 567 HG2 ARG 71 2HG ARG 71 -1.702 -8.227 -13.748 568 HG3 ARG 71 3HG ARG 71 -1.919 -8.798 -15.404 569 HD2 ARG 71 2HD ARG 71 -3.954 -6.915 -14.388 570 HD3 ARG 71 3HD ARG 71 -2.339 -6.255 -14.637 571 HE ARG 71 HE ARG 71 -4.221 -6.931 -16.647 572 HH11 ARG 71 1HH1 ARG 71 -0.812 -6.950 -15.942 573 HH12 ARG 71 2HH1 ARG 71 -0.335 -6.833 -17.604 574 HH21 ARG 71 1HH2 ARG 71 -3.606 -6.776 -18.838 575 HH22 ARG 71 2HH2 ARG 71 -1.925 -6.733 -19.250 576 H GLU 72 H GLU 72 -6.271 -10.583 -13.455 577 HA GLU 72 HA GLU 72 -5.686 -13.311 -13.678 578 HB2 GLU 72 2HB GLU 72 -6.905 -12.489 -11.775 579 HB3 GLU 72 3HB GLU 72 -8.206 -11.900 -12.800 580 HG2 GLU 72 2HG GLU 72 -7.532 -14.802 -12.815 581 HG3 GLU 72 3HG GLU 72 -8.462 -14.130 -11.477 582 H LYS 73 H LYS 73 -8.320 -11.432 -15.165 583 HA LYS 73 HA LYS 73 -9.462 -13.524 -16.627 584 HB2 LYS 73 2HB LYS 73 -10.205 -11.016 -16.208 585 HB3 LYS 73 3HB LYS 73 -9.433 -10.766 -17.768 586 HG2 LYS 73 2HG LYS 73 -11.163 -13.059 -17.862 587 HG3 LYS 73 3HG LYS 73 -12.036 -11.641 -17.278 588 HD2 LYS 73 2HD LYS 73 -11.400 -10.380 -19.222 589 HD3 LYS 73 3HD LYS 73 -10.338 -11.679 -19.771 590 HE2 LYS 73 2HE LYS 73 -12.047 -12.904 -20.595 591 HE3 LYS 73 3HE LYS 73 -13.146 -12.436 -19.298 592 HZ1 LYS 73 3HZ LYS 73 -12.544 -11.021 -21.811 593 HZ2 LYS 73 1HZ LYS 73 -13.120 -10.162 -20.472 594 HZ3 LYS 73 2HZ LYS 73 -14.047 -11.409 -21.139 595 H PHE 74 H PHE 74 -6.648 -11.569 -17.238 596 HA PHE 74 HA PHE 74 -6.417 -12.349 -20.004 597 HB2 PHE 74 2HB PHE 74 -5.559 -10.170 -18.929 598 HB3 PHE 74 3HB PHE 74 -4.213 -11.143 -18.345 599 HD1 PHE 74 HD1 PHE 74 -5.870 -9.784 -21.324 600 HD2 PHE 74 HD2 PHE 74 -2.501 -11.911 -19.825 601 HE1 PHE 74 HE1 PHE 74 -4.723 -9.480 -23.479 602 HE2 PHE 74 HE2 PHE 74 -1.349 -11.609 -21.977 603 HZ PHE 74 HZ PHE 74 -2.459 -10.392 -23.808 604 H GLY 75 H GLY 75 -5.321 -13.515 -16.927 605 HA2 GLY 75 2HA GLY 75 -4.774 -16.038 -17.343 606 HA3 GLY 75 3HA GLY 75 -3.409 -15.338 -18.200 607 H SER 76 H SER 76 -2.289 -16.730 -16.548 608 HA SER 76 HA SER 76 -1.766 -15.109 -14.149 609 HB2 SER 76 2HB SER 76 -3.100 -17.005 -13.427 610 HB3 SER 76 3HB SER 76 -2.027 -18.123 -14.271 611 HG SER 76 HG SER 76 -1.537 -18.018 -12.049 612 H SER 77 H SER 77 0.361 -15.122 -13.387 613 HA SER 77 HA SER 77 2.402 -16.725 -14.583 614 HB2 SER 77 2HB SER 77 3.419 -15.257 -16.029 615 HB3 SER 77 3HB SER 77 1.748 -14.731 -16.227 616 HG SER 77 HG SER 77 3.781 -13.275 -15.459 617 H LYS 78 H LYS 78 4.501 -16.337 -13.658 618 HA LYS 78 HA LYS 78 4.508 -15.882 -10.935 619 HB2 LYS 78 2HB LYS 78 6.670 -15.854 -13.013 620 HB3 LYS 78 3HB LYS 78 7.049 -15.432 -11.349 621 HG2 LYS 78 2HG LYS 78 5.574 -17.960 -11.910 622 HG3 LYS 78 3HG LYS 78 7.316 -17.885 -12.191 623 HD2 LYS 78 2HD LYS 78 6.122 -16.973 -9.594 624 HD3 LYS 78 3HD LYS 78 6.472 -18.678 -9.887 625 HE2 LYS 78 2HE LYS 78 8.818 -17.975 -10.477 626 HE3 LYS 78 3HE LYS 78 8.406 -16.369 -9.879 627 HZ1 LYS 78 3HZ LYS 78 9.218 -17.240 -7.977 628 HZ2 LYS 78 1HZ LYS 78 8.866 -18.838 -8.406 629 HZ3 LYS 78 2HZ LYS 78 7.641 -17.832 -7.817 630 H GLU 79 H GLU 79 5.124 -13.609 -13.562 631 HA GLU 79 HA GLU 79 5.986 -11.452 -11.958 632 HB2 GLU 79 2HB GLU 79 4.776 -11.591 -14.714 633 HB3 GLU 79 3HB GLU 79 5.246 -10.067 -13.975 634 HG2 GLU 79 2HG GLU 79 7.408 -11.906 -13.739 635 HG3 GLU 79 3HG GLU 79 6.849 -11.885 -15.411 636 H ILE 80 H ILE 80 2.796 -12.325 -13.244 637 HA ILE 80 HA ILE 80 1.422 -10.090 -12.200 638 HB ILE 80 HB ILE 80 0.336 -12.830 -12.861 639 HG12 ILE 80 2HG1 ILE 80 1.422 -11.804 -14.785 640 HG13 ILE 80 3HG1 ILE 80 -0.325 -11.776 -15.002 641 HG21 ILE 80 1HG2 ILE 80 -1.168 -11.567 -11.419 642 HG22 ILE 80 2HG2 ILE 80 -1.088 -10.194 -12.522 643 HG23 ILE 80 3HG2 ILE 80 -1.829 -11.705 -13.048 644 HD11 ILE 80 3HD1 ILE 80 1.566 -9.596 -14.907 645 HD12 ILE 80 1HD1 ILE 80 -0.099 -9.626 -15.486 646 HD13 ILE 80 2HD1 ILE 80 0.235 -9.365 -13.774 647 H ASP 81 H ASP 81 1.512 -13.465 -11.043 648 HA ASP 81 HA ASP 81 0.064 -13.144 -8.715 649 HB2 ASP 81 2HB ASP 81 2.407 -14.973 -9.270 650 HB3 ASP 81 3HB ASP 81 1.370 -15.107 -7.852 651 H MET 82 H MET 82 3.421 -12.361 -9.359 652 HA MET 82 HA MET 82 4.171 -11.912 -6.654 653 HB2 MET 82 2HB MET 82 5.352 -11.362 -9.325 654 HB3 MET 82 3HB MET 82 5.955 -10.416 -7.972 655 HG2 MET 82 2HG MET 82 6.644 -12.380 -6.810 656 HG3 MET 82 3HG MET 82 5.846 -13.419 -7.989 657 HE1 MET 82 3HE MET 82 9.325 -14.454 -8.897 658 HE2 MET 82 1HE MET 82 9.255 -13.750 -7.281 659 HE3 MET 82 2HE MET 82 7.915 -14.731 -7.873 660 H ALA 83 H ALA 83 3.304 -9.695 -9.304 661 HA ALA 83 HA ALA 83 3.522 -7.292 -7.958 662 HB1 ALA 83 1HB ALA 83 1.521 -6.655 -9.553 663 HB2 ALA 83 2HB ALA 83 3.134 -6.983 -10.188 664 HB3 ALA 83 3HB ALA 83 1.888 -8.229 -10.259 665 H ILE 84 H ILE 84 0.955 -9.677 -7.838 666 HA ILE 84 HA ILE 84 -0.914 -8.025 -6.448 667 HB ILE 84 HB ILE 84 -0.790 -11.037 -6.639 668 HG12 ILE 84 2HG1 ILE 84 -0.986 -9.894 -8.825 669 HG13 ILE 84 3HG1 ILE 84 -2.437 -10.805 -8.420 670 HG21 ILE 84 1HG2 ILE 84 -3.028 -9.210 -5.777 671 HG22 ILE 84 2HG2 ILE 84 -3.175 -10.948 -6.035 672 HG23 ILE 84 3HG2 ILE 84 -2.133 -10.332 -4.752 673 HD11 ILE 84 3HD1 ILE 84 -3.518 -8.724 -7.703 674 HD12 ILE 84 1HD1 ILE 84 -2.072 -7.829 -8.170 675 HD13 ILE 84 2HD1 ILE 84 -3.018 -8.677 -9.394 676 H VAL 85 H VAL 85 0.849 -10.922 -5.331 677 HA VAL 85 HA VAL 85 0.335 -10.674 -2.633 678 HB VAL 85 HB VAL 85 2.370 -11.995 -2.231 679 HG11 VAL 85 1HG1 VAL 85 1.259 -13.807 -2.889 680 HG12 VAL 85 2HG1 VAL 85 0.135 -12.728 -3.718 681 HG13 VAL 85 3HG1 VAL 85 1.504 -13.417 -4.591 682 HG21 VAL 85 3HG2 VAL 85 2.915 -11.493 -5.155 683 HG22 VAL 85 1HG2 VAL 85 3.878 -10.928 -3.790 684 HG23 VAL 85 2HG2 VAL 85 3.784 -12.652 -4.149 685 H THR 86 H THR 86 2.741 -9.026 -4.580 686 HA THR 86 HA THR 86 4.232 -7.938 -2.421 687 HB THR 86 HB THR 86 5.080 -6.313 -4.144 688 HG1 THR 86 HG1 THR 86 3.488 -6.123 -5.625 689 HG21 THR 86 3HG2 THR 86 6.439 -8.176 -3.945 690 HG22 THR 86 1HG2 THR 86 6.006 -8.230 -5.653 691 HG23 THR 86 2HG2 THR 86 5.182 -9.281 -4.501 692 H LEU 87 H LEU 87 1.643 -6.630 -4.474 693 HA LEU 87 HA LEU 87 1.542 -4.058 -3.420 694 HB2 LEU 87 2HB LEU 87 -0.028 -5.672 -5.152 695 HB3 LEU 87 3HB LEU 87 -1.109 -4.912 -3.985 696 HG LEU 87 HG LEU 87 -0.837 -3.662 -6.127 697 HD11 LEU 87 1HD1 LEU 87 0.260 -1.739 -4.251 698 HD12 LEU 87 2HD1 LEU 87 -1.011 -2.729 -3.535 699 HD13 LEU 87 3HD1 LEU 87 -1.334 -1.807 -5.003 700 HD21 LEU 87 3HD2 LEU 87 1.145 -2.865 -6.869 701 HD22 LEU 87 1HD2 LEU 87 1.774 -4.242 -5.965 702 HD23 LEU 87 2HD2 LEU 87 1.788 -2.633 -5.243 703 H LYS 88 H LYS 88 0.127 -7.054 -2.245 704 HA LYS 88 HA LYS 88 -1.465 -5.840 -0.214 705 HB2 LYS 88 2HB LYS 88 -0.740 -8.580 -1.036 706 HB3 LYS 88 3HB LYS 88 -1.105 -8.385 0.674 707 HG2 LYS 88 2HG LYS 88 -3.220 -8.722 0.041 708 HG3 LYS 88 3HG LYS 88 -3.166 -7.033 -0.468 709 HD2 LYS 88 2HD LYS 88 -2.646 -7.668 -2.724 710 HD3 LYS 88 3HD LYS 88 -2.463 -9.360 -2.254 711 HE2 LYS 88 2HE LYS 88 -4.905 -9.186 -1.469 712 HE3 LYS 88 3HE LYS 88 -4.965 -7.713 -2.435 713 HZ1 LYS 88 3HZ LYS 88 -4.484 -8.927 -4.390 714 HZ2 LYS 88 1HZ LYS 88 -5.707 -9.782 -3.592 715 HZ3 LYS 88 2HZ LYS 88 -4.109 -10.333 -3.527 716 H VAL 89 H VAL 89 1.427 -7.914 0.085 717 HA VAL 89 HA VAL 89 1.953 -7.455 2.756 718 HB VAL 89 HB VAL 89 3.122 -9.148 1.392 719 HG11 VAL 89 1HG1 VAL 89 3.512 -7.645 -0.564 720 HG12 VAL 89 2HG1 VAL 89 4.799 -6.866 0.358 721 HG13 VAL 89 3HG1 VAL 89 4.927 -8.573 -0.069 722 HG21 VAL 89 3HG2 VAL 89 5.521 -7.961 2.308 723 HG22 VAL 89 1HG2 VAL 89 4.236 -7.483 3.418 724 HG23 VAL 89 2HG2 VAL 89 4.538 -9.191 3.102 725 H PHE 90 H PHE 90 2.699 -5.455 -0.019 726 HA PHE 90 HA PHE 90 4.489 -3.699 1.329 727 HB2 PHE 90 2HB PHE 90 4.627 -3.797 -1.052 728 HB3 PHE 90 3HB PHE 90 2.912 -3.441 -1.231 729 HD1 PHE 90 HD2 PHE 90 5.502 -1.777 0.857 730 HD2 PHE 90 HD1 PHE 90 2.796 -1.459 -2.413 731 HE1 PHE 90 HE2 PHE 90 6.025 0.620 0.661 732 HE2 PHE 90 HE1 PHE 90 3.315 0.938 -2.615 733 HZ PHE 90 HZ PHE 90 4.931 1.980 -1.075 734 H ALA 91 H ALA 91 1.025 -3.624 0.626 735 HA ALA 91 HA ALA 91 0.545 -1.024 1.629 736 HB1 ALA 91 1HB ALA 91 -1.065 -1.997 0.171 737 HB2 ALA 91 2HB ALA 91 -1.283 -3.385 1.238 738 HB3 ALA 91 3HB ALA 91 -1.839 -1.789 1.742 739 H VAL 92 H VAL 92 0.483 -4.224 3.120 740 HA VAL 92 HA VAL 92 -0.472 -3.237 5.649 741 HB VAL 92 HB VAL 92 0.797 -5.915 5.069 742 HG11 VAL 92 1HG1 VAL 92 -1.119 -6.225 7.021 743 HG12 VAL 92 2HG1 VAL 92 0.622 -6.119 7.287 744 HG13 VAL 92 3HG1 VAL 92 -0.382 -4.675 7.424 745 HG21 VAL 92 3HG2 VAL 92 -1.453 -6.768 4.725 746 HG22 VAL 92 1HG2 VAL 92 -2.121 -5.153 4.967 747 HG23 VAL 92 2HG2 VAL 92 -1.102 -5.485 3.566 748 H ALA 93 H ALA 93 2.573 -4.850 4.709 749 HA ALA 93 HA ALA 93 3.967 -4.196 7.054 750 HB1 ALA 93 1HB ALA 93 5.154 -4.711 4.331 751 HB2 ALA 93 2HB ALA 93 5.956 -4.891 5.892 752 HB3 ALA 93 3HB ALA 93 4.630 -5.967 5.452 753 H GLY 94 H GLY 94 3.107 -2.275 4.362 754 HA2 GLY 94 2HA GLY 94 5.225 -0.318 4.880 755 HA3 GLY 94 3HA GLY 94 4.102 -0.293 3.529 756 H LEU 95 H LEU 95 1.764 0.075 4.161 757 HA LEU 95 HA LEU 95 1.537 2.537 5.480 758 HB2 LEU 95 2HB LEU 95 -0.732 0.606 5.105 759 HB3 LEU 95 3HB LEU 95 -0.791 2.367 5.138 760 HG LEU 95 HG LEU 95 0.361 0.652 2.938 761 HD11 LEU 95 1HD1 LEU 95 -1.867 2.550 2.508 762 HD12 LEU 95 2HD1 LEU 95 -2.235 1.063 3.382 763 HD13 LEU 95 3HD1 LEU 95 -1.544 0.985 1.761 764 HD21 LEU 95 3HD2 LEU 95 0.029 3.317 2.112 765 HD22 LEU 95 1HD2 LEU 95 1.538 2.430 2.325 766 HD23 LEU 95 2HD2 LEU 95 0.877 3.377 3.657 767 H LEU 96 H LEU 96 0.671 -0.740 6.550 768 HA LEU 96 HA LEU 96 -0.048 0.202 9.187 769 HB2 LEU 96 2HB LEU 96 -0.822 -1.928 7.692 770 HB3 LEU 96 3HB LEU 96 0.350 -2.680 8.772 771 HG LEU 96 HG LEU 96 -1.516 -1.002 10.221 772 HD11 LEU 96 1HD1 LEU 96 -3.016 -1.606 8.375 773 HD12 LEU 96 2HD1 LEU 96 -3.500 -2.357 9.895 774 HD13 LEU 96 3HD1 LEU 96 -2.672 -3.312 8.666 775 HD21 LEU 96 3HD2 LEU 96 -1.113 -3.976 10.392 776 HD22 LEU 96 1HD2 LEU 96 -1.617 -2.862 11.663 777 HD23 LEU 96 2HD2 LEU 96 0.040 -2.819 11.060 778 H ASN 97 H ASN 97 2.824 -0.201 7.726 779 HA ASN 97 HA ASN 97 4.967 -0.591 8.395 780 HB2 ASN 97 2HB ASN 97 3.759 0.281 11.028 781 HB3 ASN 97 3HB ASN 97 5.488 0.130 10.733 782 HD21 ASN 97 1HD2 ASN 97 5.989 1.234 8.433 783 HD22 ASN 97 2HD2 ASN 97 5.463 2.878 8.357 784 H MET 98 H MET 98 3.109 -2.850 8.457 785 HA MET 98 HA MET 98 3.820 -4.441 10.752 786 HB2 MET 98 2HB MET 98 1.804 -4.518 8.805 787 HB3 MET 98 3HB MET 98 2.760 -5.969 8.538 788 HG2 MET 98 2HG MET 98 2.525 -6.220 11.136 789 HG3 MET 98 3HG MET 98 1.126 -5.178 10.891 790 HE1 MET 98 3HE MET 98 0.369 -9.232 11.249 791 HE2 MET 98 1HE MET 98 2.095 -8.878 11.165 792 HE3 MET 98 2HE MET 98 1.046 -7.906 12.197 793 H THR 99 H THR 99 4.395 -6.895 9.916 794 HA THR 99 HA THR 99 6.454 -6.935 7.907 795 HB THR 99 HB THR 99 8.088 -7.906 9.757 796 HG1 THR 99 HG1 THR 99 7.145 -7.577 11.649 797 HG21 THR 99 3HG2 THR 99 8.145 -4.988 9.902 798 HG22 THR 99 1HG2 THR 99 7.972 -5.604 8.259 799 HG23 THR 99 2HG2 THR 99 9.338 -6.112 9.252 800 H VAL 100 H VAL 100 4.601 -8.472 7.409 801 HA VAL 100 HA VAL 100 4.151 -10.825 8.840 802 HB VAL 100 HB VAL 100 3.449 -11.785 6.598 803 HG11 VAL 100 1HG1 VAL 100 2.212 -10.002 8.289 804 HG12 VAL 100 2HG1 VAL 100 1.987 -9.269 6.700 805 HG13 VAL 100 3HG1 VAL 100 1.431 -10.916 7.000 806 HG21 VAL 100 3HG2 VAL 100 3.770 -10.686 4.659 807 HG22 VAL 100 1HG2 VAL 100 3.507 -9.104 5.394 808 HG23 VAL 100 2HG2 VAL 100 5.077 -9.894 5.539 809 H SER 101 H SER 101 4.725 -13.053 8.076 810 HA SER 101 HA SER 101 7.614 -13.201 7.737 811 HB2 SER 101 2HB SER 101 5.747 -15.531 8.170 812 HB3 SER 101 3HB SER 101 7.469 -15.429 8.537 813 HG SER 101 HG SER 101 5.911 -15.182 10.344 814 H THR 102 H THR 102 4.696 -13.801 5.976 815 HA THR 102 HA THR 102 6.278 -14.505 3.623 816 HB THR 102 HB THR 102 4.995 -16.413 3.031 817 HG1 THR 102 HG1 THR 102 3.379 -15.912 5.328 818 HG21 THR 102 3HG2 THR 102 6.754 -16.827 4.704 819 HG22 THR 102 1HG2 THR 102 5.413 -17.960 4.865 820 HG23 THR 102 2HG2 THR 102 5.567 -16.610 5.990 821 H ALA 103 H ALA 103 5.307 -13.975 1.655 822 HA ALA 103 HA ALA 103 3.715 -11.722 1.562 823 HB1 ALA 103 1HB ALA 103 3.403 -13.524 -0.738 824 HB2 ALA 103 2HB ALA 103 3.964 -11.853 -0.669 825 HB3 ALA 103 3HB ALA 103 5.070 -13.171 -0.282 826 H ALA 104 H ALA 104 2.760 -15.110 1.554 827 HA ALA 104 HA ALA 104 0.053 -14.760 0.875 828 HB1 ALA 104 1HB ALA 104 1.238 -16.918 2.616 829 HB2 ALA 104 2HB ALA 104 -0.291 -16.986 1.739 830 HB3 ALA 104 3HB ALA 104 1.232 -16.931 0.853 831 H ALA 105 H ALA 105 1.622 -15.030 4.061 832 HA ALA 105 HA ALA 105 -0.665 -14.772 5.635 833 HB1 ALA 105 1HB ALA 105 2.009 -13.659 6.428 834 HB2 ALA 105 2HB ALA 105 0.766 -14.378 7.454 835 HB3 ALA 105 3HB ALA 105 1.697 -15.394 6.353 836 H ALA 106 H ALA 106 1.346 -12.327 4.104 837 HA ALA 106 HA ALA 106 0.320 -10.070 5.432 838 HB1 ALA 106 1HB ALA 106 2.192 -10.567 3.409 839 HB2 ALA 106 2HB ALA 106 1.011 -9.456 2.714 840 HB3 ALA 106 3HB ALA 106 1.850 -9.031 4.206 841 H GLU 107 H GLU 107 -0.534 -11.411 2.237 842 HA GLU 107 HA GLU 107 -2.706 -9.644 1.818 843 HB2 GLU 107 2HB GLU 107 -1.689 -10.693 -0.080 844 HB3 GLU 107 3HB GLU 107 -1.992 -12.298 0.572 845 HG2 GLU 107 2HG GLU 107 -4.330 -10.543 0.087 846 HG3 GLU 107 3HG GLU 107 -3.506 -11.228 -1.312 847 H ASN 108 H ASN 108 -2.414 -12.791 3.326 848 HA ASN 108 HA ASN 108 -5.129 -13.490 3.410 849 HB2 ASN 108 2HB ASN 108 -2.700 -14.263 4.965 850 HB3 ASN 108 3HB ASN 108 -4.277 -14.724 5.599 851 HD21 ASN 108 1HD2 ASN 108 -5.749 -15.551 3.675 852 HD22 ASN 108 2HD2 ASN 108 -5.015 -16.800 2.732 853 H MET 109 H MET 109 -3.116 -11.869 5.864 854 HA MET 109 HA MET 109 -5.295 -11.385 7.630 855 HB2 MET 109 2HB MET 109 -2.536 -11.230 7.800 856 HB3 MET 109 3HB MET 109 -3.044 -9.549 7.906 857 HG2 MET 109 2HG MET 109 -4.060 -11.784 9.647 858 HG3 MET 109 3HG MET 109 -2.823 -10.614 10.101 859 HE1 MET 109 3HE MET 109 -4.408 -7.858 8.606 860 HE2 MET 109 1HE MET 109 -4.722 -7.279 10.242 861 HE3 MET 109 2HE MET 109 -3.199 -8.088 9.870 862 H TYR 110 H TYR 110 -4.002 -9.737 4.880 863 HA TYR 110 HA TYR 110 -4.972 -7.140 5.429 864 HB2 TYR 110 2HB TYR 110 -3.288 -7.428 3.741 865 HB3 TYR 110 3HB TYR 110 -4.314 -8.527 2.827 866 HD1 TYR 110 HD2 TYR 110 -6.228 -7.662 1.546 867 HD2 TYR 110 HD1 TYR 110 -3.564 -5.045 3.586 868 HE1 TYR 110 HE2 TYR 110 -7.092 -5.770 0.235 869 HE2 TYR 110 HE1 TYR 110 -4.421 -3.145 2.280 870 HH TYR 110 HH TYR 110 -5.576 -2.895 -0.065 871 H SER 111 H SER 111 -6.373 -9.929 3.777 872 HA SER 111 HA SER 111 -8.836 -8.461 3.253 873 HB2 SER 111 2HB SER 111 -9.504 -10.342 1.921 874 HB3 SER 111 3HB SER 111 -7.813 -10.012 1.546 875 HG SER 111 HG SER 111 -8.939 -12.237 2.607 876 H GLN 112 H GLN 112 -7.598 -11.027 5.295 877 HA GLN 112 HA GLN 112 -9.989 -12.071 6.269 878 HB2 GLN 112 2HB GLN 112 -7.203 -11.890 7.327 879 HB3 GLN 112 3HB GLN 112 -8.482 -12.415 8.414 880 HG2 GLN 112 2HG GLN 112 -9.033 -14.248 6.948 881 HG3 GLN 112 3HG GLN 112 -7.852 -13.693 5.764 882 HE21 GLN 112 1HE2 GLN 112 -7.007 -15.871 5.988 883 HE22 GLN 112 2HE2 GLN 112 -5.909 -16.220 7.275 884 H MET 113 H MET 113 -8.033 -9.378 7.518 885 HA MET 113 HA MET 113 -10.210 -8.686 9.354 886 HB2 MET 113 2HB MET 113 -7.288 -8.226 9.307 887 HB3 MET 113 3HB MET 113 -8.260 -6.910 9.952 888 HG2 MET 113 2HG MET 113 -8.873 -9.618 10.953 889 HG3 MET 113 3HG MET 113 -7.330 -8.921 11.440 890 HE1 MET 113 3HE MET 113 -10.514 -8.992 13.853 891 HE2 MET 113 1HE MET 113 -11.458 -8.359 12.504 892 HE3 MET 113 2HE MET 113 -10.404 -9.753 12.265 893 H GLY 114 H GLY 114 -9.807 -8.150 6.300 894 HA2 GLY 114 2HA GLY 114 -10.302 -6.467 4.815 895 HA3 GLY 114 3HA GLY 114 -11.361 -5.876 6.087 896 H LEU 115 H LEU 115 -7.890 -6.108 6.461 897 HA LEU 115 HA LEU 115 -6.307 -4.536 6.906 898 HB2 LEU 115 2HB LEU 115 -6.833 -4.110 4.471 899 HB3 LEU 115 3HB LEU 115 -7.846 -2.775 5.014 900 HG LEU 115 HG LEU 115 -5.821 -1.750 6.048 901 HD11 LEU 115 1HD1 LEU 115 -3.980 -2.957 6.289 902 HD12 LEU 115 2HD1 LEU 115 -3.817 -3.028 4.535 903 HD13 LEU 115 3HD1 LEU 115 -4.703 -4.291 5.390 904 HD21 LEU 115 3HD2 LEU 115 -6.288 -2.144 3.166 905 HD22 LEU 115 1HD2 LEU 115 -4.710 -1.493 3.608 906 HD23 LEU 115 2HD2 LEU 115 -6.180 -0.657 4.109 907 H ASP 116 H ASP 116 -8.286 -4.624 8.799 908 HA ASP 116 HA ASP 116 -9.599 -2.248 9.406 909 HB2 ASP 116 2HB ASP 116 -9.268 -4.725 10.629 910 HB3 ASP 116 3HB ASP 116 -8.583 -3.584 11.784 911 H THR 117 H THR 117 -9.105 -0.575 10.919 912 HA THR 117 HA THR 117 -6.239 -0.164 11.433 913 HB THR 117 HB THR 117 -7.669 2.322 10.873 914 HG1 THR 117 HG1 THR 117 -8.052 1.991 8.746 915 HG21 THR 117 3HG2 THR 117 -5.656 2.946 9.892 916 HG22 THR 117 1HG2 THR 117 -5.246 1.291 9.442 917 HG23 THR 117 2HG2 THR 117 -5.140 1.799 11.127 918 H ARG 118 H ARG 118 -6.227 2.166 12.736 919 HA ARG 118 HA ARG 118 -8.077 1.747 14.992 920 HB2 ARG 118 2HB ARG 118 -6.178 2.877 16.331 921 HB3 ARG 118 3HB ARG 118 -5.986 1.193 15.862 922 HG2 ARG 118 2HG ARG 118 -4.938 3.129 13.925 923 HG3 ARG 118 3HG ARG 118 -4.125 3.124 15.491 924 HD2 ARG 118 2HD ARG 118 -4.682 0.496 14.239 925 HD3 ARG 118 3HD ARG 118 -3.431 1.493 13.497 926 HE ARG 118 HE ARG 118 -3.287 0.123 16.016 927 HH11 ARG 118 1HH1 ARG 118 -2.073 2.798 14.148 928 HH12 ARG 118 2HH1 ARG 118 -0.579 2.898 15.019 929 HH21 ARG 118 1HH2 ARG 118 -1.323 0.243 17.170 930 HH22 ARG 118 2HH2 ARG 118 -0.153 1.443 16.737 931 HA PRO 119 HA PRO 119 -9.471 5.892 14.634 932 HB2 PRO 119 2HB PRO 119 -9.822 6.590 17.234 933 HB3 PRO 119 3HB PRO 119 -10.884 5.456 16.392 934 HG2 PRO 119 2HG PRO 119 -8.608 4.894 18.254 935 HG3 PRO 119 3HG PRO 119 -10.206 4.128 18.176 936 HD2 PRO 119 2HD PRO 119 -7.990 2.987 17.117 937 HD3 PRO 119 3HD PRO 119 -9.606 2.765 16.416 938 H SER 120 H SER 120 -6.706 5.272 16.698 939 HA SER 120 HA SER 120 -5.965 8.029 16.976 940 HB2 SER 120 2HB SER 120 -3.799 7.028 17.845 941 HB3 SER 120 3HB SER 120 -5.258 6.560 18.719 942 HG SER 120 HG SER 120 -3.585 5.043 17.095 943 H MET 121 H MET 121 -6.018 8.643 14.725 944 HA MET 121 HA MET 121 -3.416 8.419 13.507 945 HB2 MET 121 2HB MET 121 -4.309 7.639 11.315 946 HB3 MET 121 3HB MET 121 -4.388 6.422 12.582 947 HG2 MET 121 2HG MET 121 -6.741 6.810 12.879 948 HG3 MET 121 3HG MET 121 -6.699 8.151 11.736 949 HE1 MET 121 3HE MET 121 -8.499 7.310 9.929 950 HE2 MET 121 1HE MET 121 -6.988 8.029 9.371 951 HE3 MET 121 2HE MET 121 -7.639 6.606 8.559 952 H LYS 122 H LYS 122 -4.893 10.562 14.605 953 HA LYS 122 HA LYS 122 -5.203 12.233 12.207 954 HB2 LYS 122 2HB LYS 122 -7.184 11.676 14.290 955 HB3 LYS 122 3HB LYS 122 -6.920 13.394 14.023 956 HG2 LYS 122 2HG LYS 122 -8.257 13.301 12.266 957 HG3 LYS 122 3HG LYS 122 -7.124 12.198 11.480 958 HD2 LYS 122 2HD LYS 122 -8.991 10.884 11.471 959 HD3 LYS 122 3HD LYS 122 -8.333 10.433 13.046 960 HE2 LYS 122 2HE LYS 122 -9.778 12.313 13.991 961 HE3 LYS 122 3HE LYS 122 -10.593 12.316 12.428 962 HZ1 LYS 122 3HZ LYS 122 -11.058 10.631 14.597 963 HZ2 LYS 122 1HZ LYS 122 -10.413 9.673 13.361 964 HZ3 LYS 122 2HZ LYS 122 -11.800 10.597 13.078 965 H GLU 123 H GLU 123 -4.615 14.415 12.449 966 HA GLU 123 HA GLU 123 -3.322 15.141 14.982 967 HB2 GLU 123 2HB GLU 123 -2.075 14.904 12.306 968 HB3 GLU 123 3HB GLU 123 -1.644 16.330 13.238 969 HG2 GLU 123 2HG GLU 123 -0.845 14.968 15.050 970 HG3 GLU 123 3HG GLU 123 -1.402 13.504 14.241 971 H ALA 124 H ALA 124 -4.162 16.394 11.752 972 HA ALA 124 HA ALA 124 -5.812 18.453 12.808 973 HB1 ALA 124 1HB ALA 124 -3.350 19.202 13.219 974 HB2 ALA 124 2HB ALA 124 -3.381 19.585 11.497 975 HB3 ALA 124 3HB ALA 124 -4.529 20.355 12.592 976 H GLY 125 H GLY 125 -6.721 19.833 11.119 977 HA2 GLY 125 2HA GLY 125 -7.026 20.377 8.809 978 HA3 GLY 125 3HA GLY 125 -6.266 18.850 8.385 979 H GLY 126 H GLY 126 -8.539 19.431 7.107 980 HA2 GLY 126 2HA GLY 126 -10.350 18.003 6.557 981 HA3 GLY 126 3HA GLY 126 -10.384 17.447 8.224 982 H LYS 127 H LYS 127 -12.755 17.991 7.227 983 HA LYS 127 HA LYS 127 -13.724 20.088 8.874 984 HB2 LYS 127 2HB LYS 127 -12.755 21.152 6.633 985 HB3 LYS 127 3HB LYS 127 -14.330 20.671 6.016 986 HG2 LYS 127 2HG LYS 127 -15.212 21.899 8.148 987 HG3 LYS 127 3HG LYS 127 -13.642 22.704 8.081 988 HD2 LYS 127 2HD LYS 127 -14.955 24.121 6.815 989 HD3 LYS 127 3HD LYS 127 -14.252 23.079 5.574 990 HE2 LYS 127 2HE LYS 127 -16.232 22.087 5.099 991 HE3 LYS 127 3HE LYS 127 -16.791 22.159 6.770 992 HZ1 LYS 127 3HZ LYS 127 -18.138 23.734 5.934 993 HZ2 LYS 127 1HZ LYS 127 -17.131 24.078 4.618 994 HZ3 LYS 127 2HZ LYS 127 -16.794 24.741 6.137 995 H GLU 128 H GLU 128 -14.257 17.345 8.568 996 HA GLU 128 HA GLU 128 -16.965 17.334 7.416 997 HB2 GLU 128 2HB GLU 128 -15.118 15.022 8.032 998 HB3 GLU 128 3HB GLU 128 -16.750 14.866 7.397 999 HG2 GLU 128 2HG GLU 128 -16.098 15.296 5.314 1000 HG3 GLU 128 3HG GLU 128 -15.086 16.649 5.814 1001 H GLU 129 H GLU 129 -15.068 16.319 10.232 1002 HA GLU 129 HA GLU 129 -17.422 16.663 11.907 1003 HB2 GLU 129 2HB GLU 129 -16.605 14.102 11.064 1004 HB3 GLU 129 3HB GLU 129 -16.086 14.252 12.737 1005 HG2 GLU 129 2HG GLU 129 -18.529 15.142 13.081 1006 HG3 GLU 129 3HG GLU 129 -18.830 14.245 11.594 1007 H GLY 130 H GLY 130 -16.697 18.118 13.322 1008 HA2 GLY 130 2HA GLY 130 -14.382 17.449 14.951 1009 HA3 GLY 130 3HA GLY 130 -14.241 18.921 14.001 1010 HA PRO 131 HA PRO 131 -16.344 21.247 17.057 1011 HB2 PRO 131 2HB PRO 131 -17.995 22.851 15.617 1012 HB3 PRO 131 3HB PRO 131 -16.240 23.062 15.651 1013 HG2 PRO 131 2HG PRO 131 -17.947 21.726 13.587 1014 HG3 PRO 131 3HG PRO 131 -16.575 22.827 13.362 1015 HD2 PRO 131 2HD PRO 131 -16.343 20.141 13.110 1016 HD3 PRO 131 3HD PRO 131 -15.020 21.161 13.709 1017 HA PRO 132 HA PRO 132 -20.262 19.597 18.179 1018 HB2 PRO 132 2HB PRO 132 -21.477 21.703 19.388 1019 HB3 PRO 132 3HB PRO 132 -20.128 20.825 20.117 1020 HG2 PRO 132 2HG PRO 132 -20.114 23.421 18.627 1021 HG3 PRO 132 3HG PRO 132 -19.254 22.980 20.114 1022 HD2 PRO 132 2HD PRO 132 -18.048 23.012 17.690 1023 HD3 PRO 132 3HD PRO 132 -17.586 21.874 18.971 1024 H GLN 133 H GLN 133 -22.655 19.903 17.989 1025 HA GLN 133 HA GLN 133 -23.377 21.521 15.640 1026 HB2 GLN 133 2HB GLN 133 -23.822 18.613 16.142 1027 HB3 GLN 133 3HB GLN 133 -25.059 19.510 15.270 1028 HG2 GLN 133 2HG GLN 133 -23.702 19.897 13.461 1029 HG3 GLN 133 3HG GLN 133 -22.220 19.737 14.402 1030 HE21 GLN 133 1HE2 GLN 133 -21.750 17.540 15.226 1031 HE22 GLN 133 2HE2 GLN 133 -22.135 16.196 14.211 1032 H ALA 134 H ALA 134 -24.493 19.857 18.550 1033 HA ALA 134 HA ALA 134 -26.209 21.989 19.285 1034 HB1 ALA 134 1HB ALA 134 -28.357 21.062 18.948 1035 HB2 ALA 134 2HB ALA 134 -27.508 20.902 17.410 1036 HB3 ALA 134 3HB ALA 134 -27.689 19.502 18.467 1037 H TYR 135 H TYR 135 -26.835 21.841 21.406 1038 HA TYR 135 HA TYR 135 -26.822 21.125 23.564 1039 HB2 TYR 135 2HB TYR 135 -28.313 19.355 22.474 1040 HB3 TYR 135 3HB TYR 135 -26.903 18.303 22.504 1041 HD1 TYR 135 HD1 TYR 135 -25.810 17.850 24.774 1042 HD2 TYR 135 HD2 TYR 135 -29.686 19.554 24.359 1043 HE1 TYR 135 HE1 TYR 135 -26.336 17.203 27.088 1044 HE2 TYR 135 HE2 TYR 135 -30.222 18.913 26.672 1045 HH TYR 135 HH TYR 135 -27.931 17.063 28.644 Start of MODEL 10 1 H21 MYR 1 1H2 MYR 1 1.868 12.607 5.476 2 H22 MYR 1 2H2 MYR 1 3.317 13.587 5.577 3 H31 MYR 1 1H3 MYR 1 4.023 11.725 6.859 4 H32 MYR 1 2H3 MYR 1 4.585 11.197 5.271 5 H41 MYR 1 1H4 MYR 1 1.767 10.415 5.552 6 H42 MYR 1 2H4 MYR 1 2.624 9.915 7.012 7 H51 MYR 1 1H5 MYR 1 3.787 8.253 5.907 8 H52 MYR 1 2H5 MYR 1 4.231 9.321 4.574 9 H61 MYR 1 1H6 MYR 1 1.692 9.058 3.798 10 H62 MYR 1 2H6 MYR 1 1.644 7.684 4.906 11 H71 MYR 1 1H7 MYR 1 4.091 7.495 3.278 12 H72 MYR 1 2H7 MYR 1 2.719 7.777 2.204 13 H81 MYR 1 1H8 MYR 1 1.582 5.859 3.829 14 H82 MYR 1 2H8 MYR 1 3.276 5.407 4.033 15 H91 MYR 1 1H9 MYR 1 3.094 4.244 2.068 16 H92 MYR 1 2H9 MYR 1 3.103 5.798 1.236 17 H101 MYR 1 1H10 MYR 1 1.023 5.317 0.450 18 H102 MYR 1 2H10 MYR 1 0.391 5.562 2.071 19 H111 MYR 1 1H11 MYR 1 -0.367 3.374 1.175 20 H112 MYR 1 2H11 MYR 1 0.662 3.133 2.577 21 H121 MYR 1 1H12 MYR 1 1.949 1.700 1.368 22 H122 MYR 1 2H12 MYR 1 2.511 3.064 0.402 23 H131 MYR 1 1H13 MYR 1 1.384 2.308 -1.445 24 H132 MYR 1 2H13 MYR 1 -0.151 2.314 -0.574 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 4.966 12.913 3.604 29 HA2 GLY 2 2HA GLY 2 4.382 11.813 1.253 30 HA3 GLY 2 3HA GLY 2 3.339 13.227 1.206 31 H ASN 3 H ASN 3 6.728 12.430 1.990 32 HA ASN 3 HA ASN 3 7.547 14.675 0.280 33 HB2 ASN 3 2HB ASN 3 7.881 14.467 3.131 34 HB3 ASN 3 3HB ASN 3 9.458 14.474 2.348 35 HD21 ASN 3 1HD2 ASN 3 6.374 16.188 2.455 36 HD22 ASN 3 2HD2 ASN 3 7.029 17.751 2.116 37 H GLY 4 H GLY 4 9.056 12.104 2.251 38 HA2 GLY 4 2HA GLY 4 9.889 10.394 0.299 39 HA3 GLY 4 3HA GLY 4 11.096 11.671 0.267 40 H ALA 5 H ALA 5 10.898 12.163 3.149 41 HA ALA 5 HA ALA 5 12.320 9.756 4.083 42 HB1 ALA 5 1HB ALA 5 12.793 12.668 4.620 43 HB2 ALA 5 2HB ALA 5 13.410 11.421 5.704 44 HB3 ALA 5 3HB ALA 5 13.920 11.453 4.016 45 H SER 6 H SER 6 9.714 9.508 4.390 46 HA SER 6 HA SER 6 8.902 10.558 6.983 47 HB2 SER 6 2HB SER 6 7.448 8.914 4.903 48 HB3 SER 6 3HB SER 6 6.741 9.365 6.454 49 HG SER 6 HG SER 6 6.972 10.825 4.205 50 H ARG 7 H ARG 7 7.947 9.073 8.590 51 HA ARG 7 HA ARG 7 9.760 6.937 9.160 52 HB2 ARG 7 2HB ARG 7 7.241 7.875 10.537 53 HB3 ARG 7 3HB ARG 7 8.260 6.580 11.148 54 HG2 ARG 7 2HG ARG 7 9.847 7.994 11.890 55 HG3 ARG 7 3HG ARG 7 9.635 9.112 10.541 56 HD2 ARG 7 2HD ARG 7 7.501 9.860 11.583 57 HD3 ARG 7 3HD ARG 7 7.876 8.843 12.974 58 HE ARG 7 HE ARG 7 10.058 10.518 12.536 59 HH11 ARG 7 1HH1 ARG 7 6.709 10.761 13.454 60 HH12 ARG 7 2HH1 ARG 7 6.937 12.195 14.401 61 HH21 ARG 7 1HH2 ARG 7 10.372 12.405 13.779 62 HH22 ARG 7 2HH2 ARG 7 9.021 13.129 14.584 63 H ASP 8 H ASP 8 6.236 7.030 8.617 64 HA ASP 8 HA ASP 8 5.813 4.275 8.601 65 HB2 ASP 8 2HB ASP 8 4.341 6.652 7.623 66 HB3 ASP 8 3HB ASP 8 3.885 5.110 6.904 67 H TRP 9 H TRP 9 7.059 6.394 6.138 68 HA TRP 9 HA TRP 9 6.732 4.533 3.979 69 HB2 TRP 9 2HB TRP 9 6.797 6.890 3.466 70 HB3 TRP 9 3HB TRP 9 8.370 7.061 4.240 71 HD1 TRP 9 HD1 TRP 9 10.457 6.713 2.751 72 HE1 TRP 9 HE1 TRP 9 10.841 6.012 0.305 73 HE3 TRP 9 HE3 TRP 9 5.700 5.264 1.566 74 HZ2 TRP 9 HZ2 TRP 9 9.328 4.981 -1.843 75 HZ3 TRP 9 HZ3 TRP 9 5.252 4.432 -0.706 76 HH2 TRP 9 HH2 TRP 9 7.029 4.295 -2.374 77 H LYS 10 H LYS 10 9.573 5.746 5.763 78 HA LYS 10 HA LYS 10 11.487 4.106 4.601 79 HB2 LYS 10 2HB LYS 10 11.737 6.065 6.286 80 HB3 LYS 10 3HB LYS 10 11.593 4.818 7.517 81 HG2 LYS 10 2HG LYS 10 13.484 3.676 6.062 82 HG3 LYS 10 3HG LYS 10 13.791 5.352 5.601 83 HD2 LYS 10 2HD LYS 10 13.407 4.853 8.485 84 HD3 LYS 10 3HD LYS 10 14.871 4.172 7.771 85 HE2 LYS 10 2HE LYS 10 15.577 6.320 7.001 86 HE3 LYS 10 3HE LYS 10 14.030 7.045 7.434 87 HZ1 LYS 10 3HZ LYS 10 15.937 7.436 9.013 88 HZ2 LYS 10 1HZ LYS 10 15.813 5.805 9.445 89 HZ3 LYS 10 2HZ LYS 10 14.510 6.851 9.709 90 H MET 11 H MET 11 9.279 3.456 7.269 91 HA MET 11 HA MET 11 10.440 0.944 7.966 92 HB2 MET 11 2HB MET 11 9.048 2.348 9.502 93 HB3 MET 11 3HB MET 11 7.639 1.923 8.540 94 HG2 MET 11 2HG MET 11 7.369 0.193 9.892 95 HG3 MET 11 3HG MET 11 8.796 -0.514 9.140 96 HE1 MET 11 3HE MET 11 7.746 -1.386 11.569 97 HE2 MET 11 1HE MET 11 9.366 -1.827 12.110 98 HE3 MET 11 2HE MET 11 8.354 -0.790 13.115 99 H ALA 12 H ALA 12 7.519 1.871 6.156 100 HA ALA 12 HA ALA 12 6.556 -0.643 5.537 101 HB1 ALA 12 1HB ALA 12 6.495 1.810 3.784 102 HB2 ALA 12 2HB ALA 12 5.453 0.396 3.622 103 HB3 ALA 12 3HB ALA 12 5.339 1.417 5.056 104 H ILE 13 H ILE 13 9.098 1.213 3.938 105 HA ILE 13 HA ILE 13 9.452 -0.728 1.843 106 HB ILE 13 HB ILE 13 11.212 1.589 2.653 107 HG12 ILE 13 2HG1 ILE 13 8.940 2.244 1.916 108 HG13 ILE 13 3HG1 ILE 13 10.185 2.777 0.793 109 HG21 ILE 13 1HG2 ILE 13 11.249 -0.183 0.217 110 HG22 ILE 13 2HG2 ILE 13 12.143 1.330 0.358 111 HG23 ILE 13 3HG2 ILE 13 12.511 -0.015 1.437 112 HD11 ILE 13 3HD1 ILE 13 8.500 0.313 0.425 113 HD12 ILE 13 1HD1 ILE 13 8.166 1.882 -0.307 114 HD13 ILE 13 2HD1 ILE 13 9.638 1.006 -0.729 115 H LYS 14 H LYS 14 11.014 0.070 4.894 116 HA LYS 14 HA LYS 14 13.314 -1.500 4.634 117 HB2 LYS 14 2HB LYS 14 13.122 0.105 6.422 118 HB3 LYS 14 3HB LYS 14 11.725 -0.732 7.087 119 HG2 LYS 14 2HG LYS 14 13.038 -2.543 7.830 120 HG3 LYS 14 3HG LYS 14 14.429 -2.022 6.876 121 HD2 LYS 14 2HD LYS 14 14.757 -0.110 8.283 122 HD3 LYS 14 3HD LYS 14 13.248 -0.423 9.143 123 HE2 LYS 14 2HE LYS 14 14.891 -2.759 9.243 124 HE3 LYS 14 3HE LYS 14 15.841 -1.364 9.753 125 HZ1 LYS 14 3HZ LYS 14 13.140 -1.742 10.847 126 HZ2 LYS 14 1HZ LYS 14 14.479 -0.972 11.537 127 HZ3 LYS 14 2HZ LYS 14 14.417 -2.661 11.468 128 H ARG 15 H ARG 15 10.020 -2.368 5.291 129 HA ARG 15 HA ARG 15 10.735 -5.055 6.150 130 HB2 ARG 15 2HB ARG 15 8.258 -3.421 6.101 131 HB3 ARG 15 3HB ARG 15 8.060 -5.162 5.945 132 HG2 ARG 15 2HG ARG 15 9.631 -3.881 8.164 133 HG3 ARG 15 3HG ARG 15 7.908 -4.245 8.277 134 HD2 ARG 15 2HD ARG 15 8.482 -6.279 8.973 135 HD3 ARG 15 3HD ARG 15 9.060 -6.592 7.337 136 HE ARG 15 HE ARG 15 11.218 -6.432 8.099 137 HH11 ARG 15 1HH1 ARG 15 9.041 -5.188 10.514 138 HH12 ARG 15 2HH1 ARG 15 10.263 -5.055 11.735 139 HH21 ARG 15 1HH2 ARG 15 12.836 -6.261 9.697 140 HH22 ARG 15 2HH2 ARG 15 12.422 -5.665 11.269 141 H CYS 16 H CYS 16 8.687 -3.636 3.594 142 HA CYS 16 HA CYS 16 8.290 -5.978 2.138 143 HB2 CYS 16 2HB CYS 16 7.099 -3.760 1.850 144 HB3 CYS 16 3HB CYS 16 8.498 -3.219 0.930 145 HG CYS 16 HG CYS 16 6.054 -5.367 0.048 146 H SER 17 H SER 17 11.057 -3.932 2.367 147 HA SER 17 HA SER 17 12.361 -4.350 -0.028 148 HB2 SER 17 2HB SER 17 13.472 -2.866 1.364 149 HB3 SER 17 3HB SER 17 13.307 -3.907 2.779 150 HG SER 17 HG SER 17 15.227 -3.915 0.774 151 H ASN 18 H ASN 18 11.881 -6.553 2.629 152 HA ASN 18 HA ASN 18 13.701 -8.516 1.461 153 HB2 ASN 18 2HB ASN 18 12.248 -8.305 4.082 154 HB3 ASN 18 3HB ASN 18 12.893 -9.853 3.544 155 HD21 ASN 18 1HD2 ASN 18 13.576 -6.864 4.986 156 HD22 ASN 18 2HD2 ASN 18 15.287 -7.053 5.130 157 H VAL 19 H VAL 19 11.424 -7.866 -0.071 158 HA VAL 19 HA VAL 19 9.548 -10.067 0.296 159 HB VAL 19 HB VAL 19 8.668 -7.834 -0.271 160 HG11 VAL 19 1HG1 VAL 19 10.584 -7.132 -1.677 161 HG12 VAL 19 2HG1 VAL 19 10.016 -8.226 -2.940 162 HG13 VAL 19 3HG1 VAL 19 9.020 -6.857 -2.444 163 HG21 VAL 19 3HG2 VAL 19 8.215 -9.818 -2.497 164 HG22 VAL 19 1HG2 VAL 19 7.471 -9.918 -0.901 165 HG23 VAL 19 2HG2 VAL 19 7.111 -8.553 -1.959 166 H ALA 20 H ALA 20 9.245 -11.729 -1.160 167 HA ALA 20 HA ALA 20 11.262 -11.976 -3.295 168 HB1 ALA 20 1HB ALA 20 10.260 -14.447 -2.003 169 HB2 ALA 20 2HB ALA 20 11.850 -14.079 -2.672 170 HB3 ALA 20 3HB ALA 20 11.396 -13.456 -1.087 171 H VAL 21 H VAL 21 10.620 -12.978 -5.202 172 HA VAL 21 HA VAL 21 7.999 -12.576 -6.051 173 HB VAL 21 HB VAL 21 9.934 -14.559 -7.251 174 HG11 VAL 21 1HG1 VAL 21 7.494 -13.138 -8.257 175 HG12 VAL 21 2HG1 VAL 21 8.730 -13.733 -9.367 176 HG13 VAL 21 3HG1 VAL 21 7.877 -14.858 -8.309 177 HG21 VAL 21 3HG2 VAL 21 10.188 -11.728 -6.943 178 HG22 VAL 21 1HG2 VAL 21 11.289 -12.865 -7.722 179 HG23 VAL 21 2HG2 VAL 21 9.992 -12.115 -8.652 180 H GLY 22 H GLY 22 9.427 -15.259 -4.388 181 HA2 GLY 22 2HA GLY 22 6.838 -16.463 -4.012 182 HA3 GLY 22 3HA GLY 22 7.904 -17.421 -5.029 183 H VAL 23 H VAL 23 7.087 -18.643 -2.836 184 HA VAL 23 HA VAL 23 8.850 -18.182 -0.601 185 HB VAL 23 HB VAL 23 6.566 -19.001 -0.229 186 HG11 VAL 23 1HG1 VAL 23 6.050 -21.380 -0.753 187 HG12 VAL 23 2HG1 VAL 23 6.232 -20.357 -2.180 188 HG13 VAL 23 3HG1 VAL 23 7.535 -21.446 -1.702 189 HG21 VAL 23 3HG2 VAL 23 8.027 -21.344 0.717 190 HG22 VAL 23 1HG2 VAL 23 8.857 -19.821 1.035 191 HG23 VAL 23 2HG2 VAL 23 7.215 -20.071 1.627 192 H GLY 24 H GLY 24 8.791 -20.195 -3.429 193 HA2 GLY 24 2HA GLY 24 10.447 -22.295 -2.682 194 HA3 GLY 24 3HA GLY 24 10.353 -21.630 -4.306 195 H GLY 25 H GLY 25 12.696 -22.693 -3.068 196 HA2 GLY 25 2HA GLY 25 14.368 -20.627 -2.068 197 HA3 GLY 25 3HA GLY 25 14.905 -22.182 -2.686 198 H LYS 26 H LYS 26 13.797 -21.901 -5.307 199 HA LYS 26 HA LYS 26 15.862 -20.220 -6.455 200 HB2 LYS 26 2HB LYS 26 13.814 -22.003 -7.788 201 HB3 LYS 26 3HB LYS 26 15.158 -21.208 -8.598 202 HG2 LYS 26 2HG LYS 26 15.662 -23.061 -6.308 203 HG3 LYS 26 3HG LYS 26 15.366 -23.694 -7.929 204 HD2 LYS 26 2HD LYS 26 17.191 -21.881 -8.568 205 HD3 LYS 26 3HD LYS 26 17.667 -22.125 -6.886 206 HE2 LYS 26 2HE LYS 26 17.160 -24.606 -8.348 207 HE3 LYS 26 3HE LYS 26 18.483 -23.648 -9.011 208 HZ1 LYS 26 3HZ LYS 26 18.642 -25.348 -6.888 209 HZ2 LYS 26 1HZ LYS 26 18.583 -23.822 -6.158 210 HZ3 LYS 26 2HZ LYS 26 19.782 -24.168 -7.300 211 H SER 27 H SER 27 14.864 -18.217 -5.653 212 HA SER 27 HA SER 27 13.081 -17.116 -7.675 213 HB2 SER 27 2HB SER 27 11.302 -16.680 -6.339 214 HB3 SER 27 3HB SER 27 11.949 -17.990 -5.352 215 HG SER 27 HG SER 27 11.578 -16.156 -4.081 216 H LYS 28 H LYS 28 12.699 -14.660 -7.037 217 HA LYS 28 HA LYS 28 15.301 -13.571 -6.181 218 HB2 LYS 28 2HB LYS 28 13.785 -13.161 -8.637 219 HB3 LYS 28 3HB LYS 28 14.174 -11.648 -7.832 220 HG2 LYS 28 2HG LYS 28 16.544 -12.287 -7.806 221 HG3 LYS 28 3HG LYS 28 16.136 -13.778 -8.658 222 HD2 LYS 28 2HD LYS 28 15.986 -12.734 -10.635 223 HD3 LYS 28 3HD LYS 28 15.086 -11.379 -9.949 224 HE2 LYS 28 2HE LYS 28 17.137 -10.508 -10.773 225 HE3 LYS 28 3HE LYS 28 17.259 -10.539 -9.015 226 HZ1 LYS 28 3HZ LYS 28 19.022 -11.851 -9.151 227 HZ2 LYS 28 1HZ LYS 28 19.001 -11.674 -10.833 228 HZ3 LYS 28 2HZ LYS 28 18.197 -12.974 -10.110 229 H LYS 29 H LYS 29 15.097 -11.171 -5.599 230 HA LYS 29 HA LYS 29 12.585 -10.717 -4.127 231 HB2 LYS 29 2HB LYS 29 14.057 -9.500 -2.436 232 HB3 LYS 29 3HB LYS 29 14.145 -11.257 -2.443 233 HG2 LYS 29 2HG LYS 29 16.096 -10.021 -4.212 234 HG3 LYS 29 3HG LYS 29 16.275 -9.527 -2.527 235 HD2 LYS 29 2HD LYS 29 15.947 -12.414 -3.276 236 HD3 LYS 29 3HD LYS 29 17.528 -11.630 -3.328 237 HE2 LYS 29 2HE LYS 29 17.680 -11.492 -1.073 238 HE3 LYS 29 3HE LYS 29 15.950 -11.226 -0.865 239 HZ1 LYS 29 3HZ LYS 29 16.005 -13.317 -0.091 240 HZ2 LYS 29 1HZ LYS 29 17.453 -13.702 -0.877 241 HZ3 LYS 29 2HZ LYS 29 15.991 -13.753 -1.725 242 H PHE 30 H PHE 30 12.202 -8.411 -3.593 243 HA PHE 30 HA PHE 30 13.128 -6.698 -5.799 244 HB2 PHE 30 2HB PHE 30 10.657 -6.266 -4.120 245 HB3 PHE 30 3HB PHE 30 11.069 -5.501 -5.652 246 HD1 PHE 30 HD2 PHE 30 11.875 -7.765 -7.300 247 HD2 PHE 30 HD1 PHE 30 8.697 -7.426 -4.489 248 HE1 PHE 30 HE2 PHE 30 10.627 -9.508 -8.506 249 HE2 PHE 30 HE1 PHE 30 7.444 -9.170 -5.690 250 HZ PHE 30 HZ PHE 30 8.408 -10.212 -7.702 251 H GLY 31 H GLY 31 12.753 -4.238 -5.076 252 HA2 GLY 31 2HA GLY 31 13.767 -3.826 -2.359 253 HA3 GLY 31 3HA GLY 31 14.758 -3.260 -3.696 254 H GLU 32 H GLU 32 14.285 -1.272 -2.226 255 HA GLU 32 HA GLU 32 11.817 0.004 -2.212 256 HB2 GLU 32 2HB GLU 32 13.674 0.776 -0.847 257 HB3 GLU 32 3HB GLU 32 14.586 1.213 -2.285 258 HG2 GLU 32 2HG GLU 32 13.169 3.018 -2.770 259 HG3 GLU 32 3HG GLU 32 11.928 2.449 -1.655 260 H GLY 33 H GLY 33 14.437 0.211 -4.601 261 HA2 GLY 33 2HA GLY 33 13.232 2.139 -6.261 262 HA3 GLY 33 3HA GLY 33 14.464 0.989 -6.760 263 H ASN 34 H ASN 34 12.918 -1.366 -6.152 264 HA ASN 34 HA ASN 34 11.579 -1.680 -8.614 265 HB2 ASN 34 2HB ASN 34 12.625 -3.438 -6.937 266 HB3 ASN 34 3HB ASN 34 10.979 -3.492 -6.313 267 HD21 ASN 34 1HD2 ASN 34 9.574 -4.774 -7.289 268 HD22 ASN 34 2HD2 ASN 34 9.798 -5.523 -8.830 269 H PHE 35 H PHE 35 10.391 -1.185 -5.313 270 HA PHE 35 HA PHE 35 7.648 -1.418 -5.905 271 HB2 PHE 35 2HB PHE 35 8.813 0.302 -3.717 272 HB3 PHE 35 3HB PHE 35 7.247 -0.502 -3.740 273 HD1 PHE 35 HD2 PHE 35 7.961 -3.201 -4.620 274 HD2 PHE 35 HD1 PHE 35 9.933 -0.587 -1.901 275 HE1 PHE 35 HE2 PHE 35 8.941 -5.143 -3.469 276 HE2 PHE 35 HE1 PHE 35 10.917 -2.525 -0.746 277 HZ PHE 35 HZ PHE 35 10.421 -4.806 -1.530 278 H ARG 36 H ARG 36 9.845 1.345 -5.890 279 HA ARG 36 HA ARG 36 7.955 3.377 -6.246 280 HB2 ARG 36 2HB ARG 36 10.761 3.327 -7.364 281 HB3 ARG 36 3HB ARG 36 9.790 4.750 -7.012 282 HG2 ARG 36 2HG ARG 36 10.036 3.116 -4.665 283 HG3 ARG 36 3HG ARG 36 11.627 3.477 -5.336 284 HD2 ARG 36 2HD ARG 36 10.643 5.906 -5.513 285 HD3 ARG 36 3HD ARG 36 9.552 5.324 -4.257 286 HE ARG 36 HE ARG 36 11.276 5.470 -2.773 287 HH11 ARG 36 1HH1 ARG 36 12.590 5.344 -5.994 288 HH12 ARG 36 2HH1 ARG 36 14.223 5.607 -5.478 289 HH21 ARG 36 1HH2 ARG 36 13.422 5.816 -2.081 290 HH22 ARG 36 2HH2 ARG 36 14.695 5.874 -3.253 291 H TRP 37 H TRP 37 9.801 1.529 -8.659 292 HA TRP 37 HA TRP 37 8.775 2.791 -10.936 293 HB2 TRP 37 2HB TRP 37 10.714 1.385 -11.127 294 HB3 TRP 37 3HB TRP 37 9.824 -0.014 -10.533 295 HD1 TRP 37 HD1 TRP 37 10.503 1.979 -13.683 296 HE1 TRP 37 HE1 TRP 37 9.463 0.758 -15.696 297 HE3 TRP 37 HE3 TRP 37 7.810 -1.571 -11.176 298 HZ2 TRP 37 HZ2 TRP 37 7.731 -1.422 -16.160 299 HZ3 TRP 37 HZ3 TRP 37 6.488 -3.186 -12.479 300 HH2 TRP 37 HH2 TRP 37 6.450 -3.111 -14.919 301 H ALA 38 H ALA 38 7.609 -0.023 -9.132 302 HA ALA 38 HA ALA 38 5.488 -0.660 -10.896 303 HB1 ALA 38 1HB ALA 38 4.584 -1.907 -8.886 304 HB2 ALA 38 2HB ALA 38 6.203 -2.359 -9.423 305 HB3 ALA 38 3HB ALA 38 6.000 -1.325 -8.009 306 H ILE 39 H ILE 39 5.420 0.935 -7.701 307 HA ILE 39 HA ILE 39 2.730 1.632 -7.703 308 HB ILE 39 HB ILE 39 5.014 3.160 -6.449 309 HG12 ILE 39 2HG1 ILE 39 3.192 1.185 -5.089 310 HG13 ILE 39 3HG1 ILE 39 4.680 0.672 -5.876 311 HG21 ILE 39 1HG2 ILE 39 3.502 4.636 -5.777 312 HG22 ILE 39 2HG2 ILE 39 2.231 3.743 -6.611 313 HG23 ILE 39 3HG2 ILE 39 2.634 3.350 -4.940 314 HD11 ILE 39 3HD1 ILE 39 5.862 2.366 -4.412 315 HD12 ILE 39 1HD1 ILE 39 4.356 2.472 -3.502 316 HD13 ILE 39 2HD1 ILE 39 5.213 0.935 -3.612 317 H ARG 40 H ARG 40 5.507 3.664 -8.645 318 HA ARG 40 HA ARG 40 4.131 5.921 -9.439 319 HB2 ARG 40 2HB ARG 40 6.679 4.700 -10.490 320 HB3 ARG 40 3HB ARG 40 6.079 6.256 -11.049 321 HG2 ARG 40 2HG ARG 40 6.461 7.285 -9.015 322 HG3 ARG 40 3HG ARG 40 6.460 5.758 -8.130 323 HD2 ARG 40 2HD ARG 40 8.635 5.332 -8.597 324 HD3 ARG 40 3HD ARG 40 8.547 6.073 -10.194 325 HE ARG 40 HE ARG 40 8.353 8.036 -8.159 326 HH11 ARG 40 1HH1 ARG 40 10.628 5.954 -9.773 327 HH12 ARG 40 2HH1 ARG 40 11.983 6.995 -9.487 328 HH21 ARG 40 1HH2 ARG 40 10.128 9.416 -7.777 329 HH22 ARG 40 2HH2 ARG 40 11.698 8.964 -8.351 330 H MET 41 H MET 41 5.214 3.281 -11.586 331 HA MET 41 HA MET 41 4.004 4.137 -13.915 332 HB2 MET 41 2HB MET 41 5.587 2.195 -13.646 333 HB3 MET 41 3HB MET 41 4.224 1.247 -13.067 334 HG2 MET 41 2HG MET 41 3.706 0.734 -15.148 335 HG3 MET 41 3HG MET 41 3.436 2.440 -15.498 336 HE1 MET 41 3HE MET 41 5.999 0.043 -17.874 337 HE2 MET 41 1HE MET 41 4.602 -0.356 -16.874 338 HE3 MET 41 2HE MET 41 4.458 0.856 -18.147 339 H ALA 42 H ALA 42 2.586 2.576 -11.136 340 HA ALA 42 HA ALA 42 0.128 1.842 -12.373 341 HB1 ALA 42 1HB ALA 42 1.331 1.592 -9.795 342 HB2 ALA 42 2HB ALA 42 -0.306 2.226 -9.615 343 HB3 ALA 42 3HB ALA 42 -0.037 0.709 -10.474 344 H ASN 43 H ASN 43 1.098 4.579 -10.318 345 HA ASN 43 HA ASN 43 -1.383 5.860 -10.215 346 HB2 ASN 43 2HB ASN 43 1.387 7.079 -10.139 347 HB3 ASN 43 3HB ASN 43 -0.095 7.899 -9.655 348 HD21 ASN 43 1HD2 ASN 43 1.319 8.081 -7.680 349 HD22 ASN 43 2HD2 ASN 43 1.163 6.831 -6.497 350 H VAL 44 H VAL 44 1.090 5.830 -12.682 351 HA VAL 44 HA VAL 44 -0.061 8.012 -14.178 352 HB VAL 44 HB VAL 44 2.058 6.010 -14.974 353 HG11 VAL 44 1HG1 VAL 44 0.859 8.363 -16.359 354 HG12 VAL 44 2HG1 VAL 44 2.567 7.996 -16.606 355 HG13 VAL 44 3HG1 VAL 44 1.339 6.796 -17.011 356 HG21 VAL 44 3HG2 VAL 44 3.655 7.749 -14.473 357 HG22 VAL 44 1HG2 VAL 44 2.356 8.870 -14.063 358 HG23 VAL 44 2HG2 VAL 44 2.653 7.456 -13.052 359 H SER 45 H SER 45 0.226 4.492 -14.633 360 HA SER 45 HA SER 45 -1.150 4.272 -17.031 361 HB2 SER 45 2HB SER 45 -1.205 1.985 -16.645 362 HB3 SER 45 3HB SER 45 0.100 2.480 -15.569 363 HG SER 45 HG SER 45 -1.549 2.591 -13.896 364 H THR 46 H THR 46 -2.345 4.848 -13.829 365 HA THR 46 HA THR 46 -5.101 4.287 -14.590 366 HB THR 46 HB THR 46 -5.561 5.085 -12.198 367 HG1 THR 46 HG1 THR 46 -3.769 6.096 -11.525 368 HG21 THR 46 3HG2 THR 46 -3.812 2.813 -11.775 369 HG22 THR 46 1HG2 THR 46 -4.785 2.622 -13.233 370 HG23 THR 46 2HG2 THR 46 -5.570 2.911 -11.680 371 H GLY 47 H GLY 47 -2.936 6.965 -14.243 372 HA2 GLY 47 2HA GLY 47 -4.685 8.763 -15.537 373 HA3 GLY 47 3HA GLY 47 -4.735 9.061 -13.806 374 H ARG 48 H ARG 48 -2.559 9.345 -12.748 375 HA ARG 48 HA ARG 48 -0.250 10.000 -14.173 376 HB2 ARG 48 2HB ARG 48 -2.196 11.923 -14.586 377 HB3 ARG 48 3HB ARG 48 -1.221 12.608 -13.292 378 HG2 ARG 48 2HG ARG 48 0.789 12.027 -14.795 379 HG3 ARG 48 3HG ARG 48 -0.413 11.890 -16.080 380 HD2 ARG 48 2HD ARG 48 -0.148 14.092 -16.346 381 HD3 ARG 48 3HD ARG 48 -1.086 14.259 -14.862 382 HE ARG 48 HE ARG 48 1.637 13.879 -14.236 383 HH11 ARG 48 1HH1 ARG 48 -0.541 16.256 -15.549 384 HH12 ARG 48 2HH1 ARG 48 0.408 17.607 -15.024 385 HH21 ARG 48 1HH2 ARG 48 2.896 15.649 -13.539 386 HH22 ARG 48 2HH2 ARG 48 2.363 17.260 -13.881 387 H GLU 49 H GLU 49 0.903 11.971 -12.704 388 HA GLU 49 HA GLU 49 1.930 12.406 -10.721 389 HB2 GLU 49 2HB GLU 49 -0.482 11.224 -9.353 390 HB3 GLU 49 3HB GLU 49 0.635 12.428 -8.724 391 HG2 GLU 49 2HG GLU 49 -0.177 13.925 -10.618 392 HG3 GLU 49 3HG GLU 49 -1.487 12.762 -10.813 393 HA PRO 50 HA PRO 50 3.172 7.942 -10.484 394 HB2 PRO 50 2HB PRO 50 5.783 8.400 -11.071 395 HB3 PRO 50 3HB PRO 50 4.547 8.159 -12.312 396 HG2 PRO 50 2HG PRO 50 5.728 10.711 -11.285 397 HG3 PRO 50 3HG PRO 50 5.368 10.237 -12.956 398 HD2 PRO 50 2HD PRO 50 3.748 11.865 -11.522 399 HD3 PRO 50 3HD PRO 50 3.129 10.742 -12.749 400 H GLY 51 H GLY 51 4.995 10.802 -9.378 401 HA2 GLY 51 2HA GLY 51 6.076 9.334 -7.122 402 HA3 GLY 51 3HA GLY 51 6.384 11.018 -7.518 403 H ASP 52 H ASP 52 3.430 9.157 -6.798 404 HA ASP 52 HA ASP 52 2.871 11.084 -4.641 405 HB2 ASP 52 2HB ASP 52 1.397 10.757 -6.988 406 HB3 ASP 52 3HB ASP 52 0.476 9.886 -5.765 407 H ILE 53 H ILE 53 2.854 10.130 -2.726 408 HA ILE 53 HA ILE 53 2.101 7.286 -2.573 409 HB ILE 53 HB ILE 53 3.349 7.339 -0.365 410 HG12 ILE 53 2HG1 ILE 53 4.905 9.655 -1.388 411 HG13 ILE 53 3HG1 ILE 53 3.356 10.009 -0.631 412 HG21 ILE 53 1HG2 ILE 53 4.763 7.719 -2.991 413 HG22 ILE 53 2HG2 ILE 53 5.598 7.241 -1.514 414 HG23 ILE 53 3HG2 ILE 53 4.339 6.207 -2.189 415 HD11 ILE 53 3HD1 ILE 53 5.019 8.157 0.892 416 HD12 ILE 53 1HD1 ILE 53 5.729 9.756 0.673 417 HD13 ILE 53 2HD1 ILE 53 4.137 9.591 1.415 418 HA PRO 54 HA PRO 54 -1.288 9.566 -0.418 419 HB2 PRO 54 2HB PRO 54 -3.253 7.917 -1.307 420 HB3 PRO 54 3HB PRO 54 -2.664 9.299 -2.238 421 HG2 PRO 54 2HG PRO 54 -1.968 6.400 -2.506 422 HG3 PRO 54 3HG PRO 54 -2.304 7.592 -3.775 423 HD2 PRO 54 2HD PRO 54 0.212 6.853 -3.100 424 HD3 PRO 54 3HD PRO 54 -0.183 8.487 -3.672 425 H GLU 55 H GLU 55 -2.183 9.036 1.524 426 HA GLU 55 HA GLU 55 -1.506 6.393 2.593 427 HB2 GLU 55 2HB GLU 55 -0.804 8.573 3.739 428 HB3 GLU 55 3HB GLU 55 -2.496 8.755 4.179 429 HG2 GLU 55 2HG GLU 55 -2.131 6.282 5.070 430 HG3 GLU 55 3HG GLU 55 -0.466 6.849 5.180 431 H THR 56 H THR 56 -3.414 5.729 1.139 432 HA THR 56 HA THR 56 -5.751 5.492 2.867 433 HB THR 56 HB THR 56 -6.494 7.330 1.584 434 HG1 THR 56 HG1 THR 56 -8.288 6.309 1.157 435 HG21 THR 56 3HG2 THR 56 -5.541 5.887 -0.892 436 HG22 THR 56 1HG2 THR 56 -4.729 7.255 -0.132 437 HG23 THR 56 2HG2 THR 56 -6.329 7.464 -0.843 438 H LEU 57 H LEU 57 -6.147 3.392 3.024 439 HA LEU 57 HA LEU 57 -5.082 1.475 1.216 440 HB2 LEU 57 2HB LEU 57 -5.850 1.360 3.771 441 HB3 LEU 57 3HB LEU 57 -7.311 0.725 3.018 442 HG LEU 57 HG LEU 57 -5.823 -1.064 3.758 443 HD11 LEU 57 1HD1 LEU 57 -6.152 -2.389 1.927 444 HD12 LEU 57 2HD1 LEU 57 -5.613 -1.151 0.793 445 HD13 LEU 57 3HD1 LEU 57 -7.214 -1.040 1.524 446 HD21 LEU 57 3HD2 LEU 57 -3.815 0.620 2.653 447 HD22 LEU 57 1HD2 LEU 57 -3.776 -0.926 1.805 448 HD23 LEU 57 2HD2 LEU 57 -3.622 -0.880 3.561 449 H ASP 58 H ASP 58 -8.141 3.112 1.497 450 HA ASP 58 HA ASP 58 -9.681 1.356 -0.101 451 HB2 ASP 58 2HB ASP 58 -10.015 3.959 1.145 452 HB3 ASP 58 3HB ASP 58 -10.762 3.904 -0.450 453 H GLN 59 H GLN 59 -8.154 4.481 -0.897 454 HA GLN 59 HA GLN 59 -8.730 4.401 -3.642 455 HB2 GLN 59 2HB GLN 59 -7.622 6.237 -1.953 456 HB3 GLN 59 3HB GLN 59 -6.219 5.742 -2.891 457 HG2 GLN 59 2HG GLN 59 -6.851 7.153 -4.468 458 HG3 GLN 59 3HG GLN 59 -8.259 6.131 -4.756 459 HE21 GLN 59 1HE2 GLN 59 -8.075 8.970 -5.081 460 HE22 GLN 59 2HE2 GLN 59 -9.224 9.680 -4.004 461 H LEU 60 H LEU 60 -5.707 3.592 -1.934 462 HA LEU 60 HA LEU 60 -4.218 2.769 -4.121 463 HB2 LEU 60 2HB LEU 60 -3.216 3.067 -1.957 464 HB3 LEU 60 3HB LEU 60 -4.191 1.763 -1.281 465 HG LEU 60 HG LEU 60 -2.838 0.475 -3.273 466 HD11 LEU 60 1HD1 LEU 60 -1.153 2.732 -2.260 467 HD12 LEU 60 2HD1 LEU 60 -1.355 2.143 -3.910 468 HD13 LEU 60 3HD1 LEU 60 -0.423 1.202 -2.745 469 HD21 LEU 60 3HD2 LEU 60 -3.166 -0.312 -0.990 470 HD22 LEU 60 1HD2 LEU 60 -1.985 0.860 -0.404 471 HD23 LEU 60 2HD2 LEU 60 -1.472 -0.452 -1.465 472 H ARG 61 H ARG 61 -6.554 0.961 -2.190 473 HA ARG 61 HA ARG 61 -6.083 -1.586 -3.249 474 HB2 ARG 61 2HB ARG 61 -7.437 -1.309 -1.272 475 HB3 ARG 61 3HB ARG 61 -8.615 -0.352 -2.160 476 HG2 ARG 61 2HG ARG 61 -8.218 -2.953 -3.366 477 HG3 ARG 61 3HG ARG 61 -8.716 -3.071 -1.677 478 HD2 ARG 61 2HD ARG 61 -10.606 -1.572 -2.148 479 HD3 ARG 61 3HD ARG 61 -10.115 -1.503 -3.840 480 HE ARG 61 HE ARG 61 -10.423 -4.174 -3.270 481 HH11 ARG 61 1HH1 ARG 61 -12.431 -1.332 -3.173 482 HH12 ARG 61 2HH1 ARG 61 -13.897 -2.197 -3.498 483 HH21 ARG 61 1HH2 ARG 61 -12.346 -5.324 -3.699 484 HH22 ARG 61 2HH2 ARG 61 -13.847 -4.468 -3.796 485 H LEU 62 H LEU 62 -8.403 0.914 -4.261 486 HA LEU 62 HA LEU 62 -9.465 -0.552 -6.431 487 HB2 LEU 62 2HB LEU 62 -9.933 1.917 -5.202 488 HB3 LEU 62 3HB LEU 62 -9.531 2.294 -6.876 489 HG LEU 62 HG LEU 62 -11.958 2.087 -6.479 490 HD11 LEU 62 1HD1 LEU 62 -11.102 -0.194 -8.219 491 HD12 LEU 62 2HD1 LEU 62 -10.734 1.473 -8.657 492 HD13 LEU 62 3HD1 LEU 62 -12.411 0.963 -8.461 493 HD21 LEU 62 3HD2 LEU 62 -11.539 -0.861 -6.122 494 HD22 LEU 62 1HD2 LEU 62 -12.987 0.101 -5.822 495 HD23 LEU 62 2HD2 LEU 62 -11.602 0.232 -4.738 496 H VAL 63 H VAL 63 -6.568 1.274 -6.034 497 HA VAL 63 HA VAL 63 -6.082 1.845 -8.782 498 HB VAL 63 HB VAL 63 -4.126 1.648 -6.487 499 HG11 VAL 63 1HG1 VAL 63 -2.699 1.586 -8.262 500 HG12 VAL 63 2HG1 VAL 63 -3.833 2.394 -9.346 501 HG13 VAL 63 3HG1 VAL 63 -2.933 3.330 -8.152 502 HG21 VAL 63 3HG2 VAL 63 -6.169 3.493 -6.926 503 HG22 VAL 63 1HG2 VAL 63 -4.799 3.664 -5.828 504 HG23 VAL 63 2HG2 VAL 63 -4.699 4.302 -7.469 505 H ILE 64 H ILE 64 -4.460 -0.468 -6.598 506 HA ILE 64 HA ILE 64 -3.015 -1.847 -8.507 507 HB ILE 64 HB ILE 64 -2.615 -2.219 -6.158 508 HG12 ILE 64 2HG1 ILE 64 -3.604 -4.758 -7.475 509 HG13 ILE 64 3HG1 ILE 64 -2.021 -4.029 -7.724 510 HG21 ILE 64 1HG2 ILE 64 -4.152 -3.371 -4.710 511 HG22 ILE 64 2HG2 ILE 64 -4.977 -1.995 -5.440 512 HG23 ILE 64 3HG2 ILE 64 -5.279 -3.624 -6.043 513 HD11 ILE 64 3HD1 ILE 64 -1.237 -5.176 -6.012 514 HD12 ILE 64 1HD1 ILE 64 -2.382 -4.369 -4.941 515 HD13 ILE 64 2HD1 ILE 64 -2.832 -5.876 -5.739 516 H CYS 65 H CYS 65 -6.353 -2.342 -7.466 517 HA CYS 65 HA CYS 65 -6.778 -4.714 -8.970 518 HB2 CYS 65 2HB CYS 65 -8.149 -3.797 -6.989 519 HB3 CYS 65 3HB CYS 65 -8.951 -2.785 -8.184 520 HG CYS 65 HG CYS 65 -8.988 -6.198 -8.016 521 H ASP 66 H ASP 66 -7.964 -1.391 -9.507 522 HA ASP 66 HA ASP 66 -9.071 -1.766 -12.010 523 HB2 ASP 66 2HB ASP 66 -9.298 0.298 -10.651 524 HB3 ASP 66 3HB ASP 66 -7.634 0.716 -11.050 525 H LEU 67 H LEU 67 -5.714 -1.154 -11.138 526 HA LEU 67 HA LEU 67 -4.722 -0.708 -13.733 527 HB2 LEU 67 2HB LEU 67 -3.329 -0.080 -11.962 528 HB3 LEU 67 3HB LEU 67 -3.478 -1.649 -11.173 529 HG LEU 67 HG LEU 67 -2.233 -1.879 -13.779 530 HD11 LEU 67 1HD1 LEU 67 -1.030 0.010 -13.739 531 HD12 LEU 67 2HD1 LEU 67 -0.078 -0.813 -12.504 532 HD13 LEU 67 3HD1 LEU 67 -1.360 0.302 -12.031 533 HD21 LEU 67 3HD2 LEU 67 -0.442 -2.898 -12.255 534 HD22 LEU 67 1HD2 LEU 67 -2.023 -3.678 -12.305 535 HD23 LEU 67 2HD2 LEU 67 -1.596 -2.637 -10.947 536 H GLN 68 H GLN 68 -4.835 -3.674 -11.769 537 HA GLN 68 HA GLN 68 -3.671 -5.373 -13.673 538 HB2 GLN 68 2HB GLN 68 -3.946 -5.960 -11.294 539 HB3 GLN 68 3HB GLN 68 -5.686 -6.063 -11.528 540 HG2 GLN 68 2HG GLN 68 -4.025 -7.718 -13.317 541 HG3 GLN 68 3HG GLN 68 -4.052 -8.178 -11.615 542 HE21 GLN 68 1HE2 GLN 68 -5.455 -8.750 -14.489 543 HE22 GLN 68 2HE2 GLN 68 -7.012 -9.286 -13.969 544 H GLU 69 H GLU 69 -6.933 -4.194 -13.292 545 HA GLU 69 HA GLU 69 -8.206 -6.080 -14.983 546 HB2 GLU 69 2HB GLU 69 -8.988 -3.883 -13.401 547 HB3 GLU 69 3HB GLU 69 -9.516 -3.516 -15.037 548 HG2 GLU 69 2HG GLU 69 -10.083 -6.223 -13.964 549 HG3 GLU 69 3HG GLU 69 -11.026 -4.866 -13.350 550 H ARG 70 H ARG 70 -7.379 -2.660 -15.591 551 HA ARG 70 HA ARG 70 -7.908 -2.734 -18.346 552 HB2 ARG 70 2HB ARG 70 -7.736 -0.649 -17.044 553 HB3 ARG 70 3HB ARG 70 -6.011 -0.924 -16.841 554 HG2 ARG 70 2HG ARG 70 -5.692 0.263 -18.682 555 HG3 ARG 70 3HG ARG 70 -6.434 -1.057 -19.588 556 HD2 ARG 70 2HD ARG 70 -7.506 1.073 -20.101 557 HD3 ARG 70 3HD ARG 70 -8.628 -0.027 -19.302 558 HE ARG 70 HE ARG 70 -7.363 1.646 -17.403 559 HH11 ARG 70 1HH1 ARG 70 -9.794 1.676 -19.896 560 HH12 ARG 70 2HH1 ARG 70 -10.698 2.968 -19.180 561 HH21 ARG 70 1HH2 ARG 70 -8.546 3.348 -16.451 562 HH22 ARG 70 2HH2 ARG 70 -9.987 3.920 -17.221 563 H ARG 71 H ARG 71 -4.844 -3.052 -16.571 564 HA ARG 71 HA ARG 71 -3.129 -3.295 -18.742 565 HB2 ARG 71 2HB ARG 71 -3.012 -4.454 -15.963 566 HB3 ARG 71 3HB ARG 71 -1.714 -4.684 -17.126 567 HG2 ARG 71 2HG ARG 71 -2.726 -1.978 -16.293 568 HG3 ARG 71 3HG ARG 71 -1.386 -2.809 -15.501 569 HD2 ARG 71 2HD ARG 71 -0.104 -1.752 -17.005 570 HD3 ARG 71 3HD ARG 71 -0.676 -2.986 -18.127 571 HE ARG 71 HE ARG 71 -2.542 -0.938 -18.167 572 HH11 ARG 71 1HH1 ARG 71 0.826 -1.374 -18.934 573 HH12 ARG 71 2HH1 ARG 71 0.838 -0.156 -20.166 574 HH21 ARG 71 1HH2 ARG 71 -2.539 0.668 -19.787 575 HH22 ARG 71 2HH2 ARG 71 -1.077 1.006 -20.649 576 H GLU 72 H GLU 72 -4.947 -5.813 -17.026 577 HA GLU 72 HA GLU 72 -3.943 -8.031 -18.385 578 HB2 GLU 72 2HB GLU 72 -5.269 -8.339 -16.410 579 HB3 GLU 72 3HB GLU 72 -6.651 -7.540 -17.147 580 HG2 GLU 72 2HG GLU 72 -6.925 -9.966 -17.053 581 HG3 GLU 72 3HG GLU 72 -6.920 -9.362 -18.709 582 H LYS 73 H LYS 73 -6.794 -6.039 -19.119 583 HA LYS 73 HA LYS 73 -7.695 -7.415 -21.358 584 HB2 LYS 73 2HB LYS 73 -8.138 -4.824 -20.145 585 HB3 LYS 73 3HB LYS 73 -8.160 -4.707 -21.900 586 HG2 LYS 73 2HG LYS 73 -9.791 -6.699 -20.345 587 HG3 LYS 73 3HG LYS 73 -10.382 -5.108 -20.831 588 HD2 LYS 73 2HD LYS 73 -9.210 -6.413 -23.091 589 HD3 LYS 73 3HD LYS 73 -10.377 -7.498 -22.332 590 HE2 LYS 73 2HE LYS 73 -10.891 -4.660 -23.217 591 HE3 LYS 73 3HE LYS 73 -11.445 -6.120 -24.034 592 HZ1 LYS 73 3HZ LYS 73 -12.466 -4.838 -21.634 593 HZ2 LYS 73 1HZ LYS 73 -12.429 -6.530 -21.607 594 HZ3 LYS 73 2HZ LYS 73 -13.284 -5.722 -22.822 595 H PHE 74 H PHE 74 -5.193 -4.947 -21.073 596 HA PHE 74 HA PHE 74 -4.761 -4.729 -23.894 597 HB2 PHE 74 2HB PHE 74 -4.029 -3.244 -21.672 598 HB3 PHE 74 3HB PHE 74 -2.507 -3.939 -22.219 599 HD1 PHE 74 HD2 PHE 74 -2.112 -3.763 -24.828 600 HD2 PHE 74 HD1 PHE 74 -4.697 -1.245 -22.571 601 HE1 PHE 74 HE2 PHE 74 -1.954 -2.039 -26.577 602 HE2 PHE 74 HE1 PHE 74 -4.544 0.483 -24.317 603 HZ PHE 74 HZ PHE 74 -3.170 0.087 -26.322 604 H GLY 75 H GLY 75 -3.587 -6.780 -21.358 605 HA2 GLY 75 2HA GLY 75 -2.705 -8.911 -22.573 606 HA3 GLY 75 3HA GLY 75 -1.435 -7.803 -23.072 607 H SER 76 H SER 76 -0.719 -10.026 -21.717 608 HA SER 76 HA SER 76 -0.271 -9.143 -18.948 609 HB2 SER 76 2HB SER 76 -1.123 -11.598 -19.933 610 HB3 SER 76 3HB SER 76 0.580 -11.864 -19.558 611 HG SER 76 HG SER 76 -1.302 -10.719 -17.769 612 H SER 77 H SER 77 1.805 -9.185 -18.052 613 HA SER 77 HA SER 77 4.105 -9.928 -19.584 614 HB2 SER 77 2HB SER 77 4.827 -7.942 -20.394 615 HB3 SER 77 3HB SER 77 3.143 -7.446 -20.227 616 HG SER 77 HG SER 77 4.934 -6.134 -19.195 617 H LYS 78 H LYS 78 5.970 -10.019 -18.348 618 HA LYS 78 HA LYS 78 5.736 -10.455 -15.633 619 HB2 LYS 78 2HB LYS 78 8.143 -10.476 -15.540 620 HB3 LYS 78 3HB LYS 78 7.634 -11.198 -17.061 621 HG2 LYS 78 2HG LYS 78 8.126 -9.102 -18.220 622 HG3 LYS 78 3HG LYS 78 8.647 -8.385 -16.693 623 HD2 LYS 78 2HD LYS 78 10.388 -10.135 -16.513 624 HD3 LYS 78 3HD LYS 78 9.897 -10.751 -18.092 625 HE2 LYS 78 2HE LYS 78 10.292 -8.002 -18.441 626 HE3 LYS 78 3HE LYS 78 11.637 -8.549 -17.441 627 HZ1 LYS 78 3HZ LYS 78 12.107 -10.262 -19.088 628 HZ2 LYS 78 1HZ LYS 78 12.172 -8.721 -19.781 629 HZ3 LYS 78 2HZ LYS 78 10.829 -9.713 -20.051 630 H GLU 79 H GLU 79 6.447 -7.473 -17.344 631 HA GLU 79 HA GLU 79 7.281 -5.940 -15.133 632 HB2 GLU 79 2HB GLU 79 6.464 -5.438 -17.904 633 HB3 GLU 79 3HB GLU 79 6.082 -4.119 -16.806 634 HG2 GLU 79 2HG GLU 79 8.378 -3.925 -16.145 635 HG3 GLU 79 3HG GLU 79 8.809 -5.359 -17.075 636 H ILE 80 H ILE 80 4.087 -6.316 -16.647 637 HA ILE 80 HA ILE 80 2.739 -4.601 -14.834 638 HB ILE 80 HB ILE 80 1.547 -6.842 -16.470 639 HG12 ILE 80 2HG1 ILE 80 2.817 -5.341 -17.910 640 HG13 ILE 80 3HG1 ILE 80 1.092 -5.093 -18.159 641 HG21 ILE 80 1HG2 ILE 80 -0.047 -4.452 -16.039 642 HG22 ILE 80 2HG2 ILE 80 -0.465 -6.148 -15.804 643 HG23 ILE 80 3HG2 ILE 80 0.380 -5.264 -14.534 644 HD11 ILE 80 3HD1 ILE 80 1.554 -2.930 -17.940 645 HD12 ILE 80 1HD1 ILE 80 1.682 -3.262 -16.213 646 HD13 ILE 80 2HD1 ILE 80 3.131 -3.249 -17.218 647 H ASP 81 H ASP 81 2.912 -8.151 -15.065 648 HA ASP 81 HA ASP 81 1.351 -8.782 -12.861 649 HB2 ASP 81 2HB ASP 81 2.520 -10.295 -14.664 650 HB3 ASP 81 3HB ASP 81 3.801 -10.397 -13.458 651 H MET 82 H MET 82 4.819 -8.072 -13.017 652 HA MET 82 HA MET 82 5.375 -8.580 -10.299 653 HB2 MET 82 2HB MET 82 6.746 -7.064 -12.484 654 HB3 MET 82 3HB MET 82 7.323 -6.896 -10.832 655 HG2 MET 82 2HG MET 82 7.412 -9.449 -10.797 656 HG3 MET 82 3HG MET 82 7.252 -9.347 -12.549 657 HE1 MET 82 3HE MET 82 10.008 -10.741 -12.437 658 HE2 MET 82 1HE MET 82 9.024 -9.968 -13.680 659 HE3 MET 82 2HE MET 82 10.721 -9.524 -13.497 660 H ALA 83 H ALA 83 4.364 -5.672 -12.024 661 HA ALA 83 HA ALA 83 4.715 -3.793 -9.999 662 HB1 ALA 83 1HB ALA 83 4.095 -3.373 -12.413 663 HB2 ALA 83 2HB ALA 83 2.432 -3.744 -11.955 664 HB3 ALA 83 3HB ALA 83 3.266 -2.378 -11.215 665 H ILE 84 H ILE 84 1.890 -5.825 -10.722 666 HA ILE 84 HA ILE 84 0.265 -4.820 -8.640 667 HB ILE 84 HB ILE 84 0.148 -7.521 -9.988 668 HG12 ILE 84 2HG1 ILE 84 -1.568 -5.119 -10.585 669 HG13 ILE 84 3HG1 ILE 84 -0.036 -5.384 -11.410 670 HG21 ILE 84 1HG2 ILE 84 -1.282 -6.488 -7.764 671 HG22 ILE 84 2HG2 ILE 84 -2.391 -6.597 -9.129 672 HG23 ILE 84 3HG2 ILE 84 -1.505 -8.025 -8.598 673 HD11 ILE 84 3HD1 ILE 84 -2.181 -7.474 -11.364 674 HD12 ILE 84 1HD1 ILE 84 -2.158 -6.180 -12.562 675 HD13 ILE 84 2HD1 ILE 84 -0.811 -7.316 -12.464 676 H VAL 85 H VAL 85 2.531 -7.521 -8.820 677 HA VAL 85 HA VAL 85 1.941 -8.724 -6.361 678 HB VAL 85 HB VAL 85 4.603 -8.595 -7.784 679 HG11 VAL 85 1HG1 VAL 85 3.741 -9.865 -5.297 680 HG12 VAL 85 2HG1 VAL 85 4.518 -10.971 -6.432 681 HG13 VAL 85 3HG1 VAL 85 5.365 -9.521 -5.893 682 HG21 VAL 85 3HG2 VAL 85 3.870 -10.158 -9.203 683 HG22 VAL 85 1HG2 VAL 85 3.094 -11.080 -7.915 684 HG23 VAL 85 2HG2 VAL 85 2.248 -9.725 -8.663 685 H THR 86 H THR 86 4.278 -6.181 -7.179 686 HA THR 86 HA THR 86 5.379 -5.911 -4.598 687 HB THR 86 HB THR 86 6.172 -3.689 -5.368 688 HG1 THR 86 HG1 THR 86 4.840 -2.807 -6.779 689 HG21 THR 86 3HG2 THR 86 7.832 -4.892 -6.238 690 HG22 THR 86 1HG2 THR 86 6.939 -4.982 -7.755 691 HG23 THR 86 2HG2 THR 86 6.739 -6.243 -6.538 692 H LEU 87 H LEU 87 2.669 -4.302 -6.202 693 HA LEU 87 HA LEU 87 2.146 -2.357 -4.261 694 HB2 LEU 87 2HB LEU 87 0.916 -3.346 -6.624 695 HB3 LEU 87 3HB LEU 87 -0.313 -3.254 -5.364 696 HG LEU 87 HG LEU 87 -0.159 -1.237 -6.825 697 HD11 LEU 87 1HD1 LEU 87 0.368 0.212 -4.535 698 HD12 LEU 87 2HD1 LEU 87 -0.173 -1.353 -3.928 699 HD13 LEU 87 3HD1 LEU 87 -1.197 -0.432 -5.029 700 HD21 LEU 87 3HD2 LEU 87 1.677 0.264 -6.641 701 HD22 LEU 87 1HD2 LEU 87 2.340 -1.326 -7.019 702 HD23 LEU 87 2HD2 LEU 87 2.424 -0.705 -5.370 703 H LYS 88 H LYS 88 1.122 -5.719 -4.509 704 HA LYS 88 HA LYS 88 -0.709 -5.649 -2.341 705 HB2 LYS 88 2HB LYS 88 0.487 -7.687 -4.084 706 HB3 LYS 88 3HB LYS 88 0.124 -8.260 -2.462 707 HG2 LYS 88 2HG LYS 88 -2.093 -8.207 -2.800 708 HG3 LYS 88 3HG LYS 88 -2.020 -6.710 -3.733 709 HD2 LYS 88 2HD LYS 88 -1.368 -7.885 -5.705 710 HD3 LYS 88 3HD LYS 88 -1.133 -9.384 -4.803 711 HE2 LYS 88 2HE LYS 88 -3.486 -9.573 -4.388 712 HE3 LYS 88 3HE LYS 88 -3.784 -7.973 -5.065 713 HZ1 LYS 88 3HZ LYS 88 -2.541 -10.065 -6.723 714 HZ2 LYS 88 1HZ LYS 88 -3.447 -8.719 -7.203 715 HZ3 LYS 88 2HZ LYS 88 -4.218 -10.051 -6.501 716 H VAL 89 H VAL 89 2.537 -7.123 -2.544 717 HA VAL 89 HA VAL 89 2.840 -7.704 0.153 718 HB VAL 89 HB VAL 89 5.071 -6.874 -1.705 719 HG11 VAL 89 1HG1 VAL 89 6.503 -7.556 -0.135 720 HG12 VAL 89 2HG1 VAL 89 5.138 -7.495 0.982 721 HG13 VAL 89 3HG1 VAL 89 5.570 -9.015 0.198 722 HG21 VAL 89 3HG2 VAL 89 4.992 -9.636 -1.642 723 HG22 VAL 89 1HG2 VAL 89 3.296 -9.171 -1.772 724 HG23 VAL 89 2HG2 VAL 89 4.459 -8.607 -2.971 725 H PHE 90 H PHE 90 3.732 -4.759 -1.614 726 HA PHE 90 HA PHE 90 4.919 -3.422 0.563 727 HB2 PHE 90 2HB PHE 90 5.361 -2.627 -1.650 728 HB3 PHE 90 3HB PHE 90 3.646 -2.397 -1.975 729 HD1 PHE 90 HD1 PHE 90 5.681 -1.387 0.970 730 HD2 PHE 90 HD2 PHE 90 3.378 -0.138 -2.385 731 HE1 PHE 90 HE1 PHE 90 5.856 0.948 1.723 732 HE2 PHE 90 HE2 PHE 90 3.550 2.199 -1.638 733 HZ PHE 90 HZ PHE 90 4.791 2.745 0.419 734 H ALA 91 H ALA 91 1.602 -3.738 -0.497 735 HA ALA 91 HA ALA 91 0.484 -1.645 1.028 736 HB1 ALA 91 1HB ALA 91 -0.785 -4.211 0.079 737 HB2 ALA 91 2HB ALA 91 -1.653 -2.803 0.692 738 HB3 ALA 91 3HB ALA 91 -0.726 -2.685 -0.803 739 H VAL 92 H VAL 92 0.526 -5.155 1.680 740 HA VAL 92 HA VAL 92 -0.448 -4.877 4.335 741 HB VAL 92 HB VAL 92 1.087 -7.222 3.215 742 HG11 VAL 92 1HG1 VAL 92 -1.110 -7.349 5.241 743 HG12 VAL 92 2HG1 VAL 92 0.200 -8.492 4.937 744 HG13 VAL 92 3HG1 VAL 92 0.536 -6.955 5.735 745 HG21 VAL 92 3HG2 VAL 92 -0.569 -7.461 1.742 746 HG22 VAL 92 1HG2 VAL 92 -1.622 -7.815 3.112 747 HG23 VAL 92 2HG2 VAL 92 -1.511 -6.169 2.487 748 H ALA 93 H ALA 93 2.783 -5.726 3.083 749 HA ALA 93 HA ALA 93 4.085 -5.724 5.569 750 HB1 ALA 93 1HB ALA 93 5.289 -5.124 2.871 751 HB2 ALA 93 2HB ALA 93 6.150 -5.659 4.315 752 HB3 ALA 93 3HB ALA 93 5.005 -6.739 3.519 753 H GLY 94 H GLY 94 2.954 -3.141 3.625 754 HA2 GLY 94 2HA GLY 94 4.753 -1.199 4.874 755 HA3 GLY 94 3HA GLY 94 3.627 -0.875 3.564 756 H LEU 95 H LEU 95 1.269 -1.063 4.178 757 HA LEU 95 HA LEU 95 0.685 0.744 6.230 758 HB2 LEU 95 2HB LEU 95 -0.993 -1.193 4.674 759 HB3 LEU 95 3HB LEU 95 -1.693 -0.180 5.935 760 HG LEU 95 HG LEU 95 -2.106 0.838 3.807 761 HD11 LEU 95 1HD1 LEU 95 -0.871 2.103 5.921 762 HD12 LEU 95 2HD1 LEU 95 -1.694 2.888 4.573 763 HD13 LEU 95 3HD1 LEU 95 0.052 2.647 4.519 764 HD21 LEU 95 3HD2 LEU 95 -0.059 -0.349 2.767 765 HD22 LEU 95 1HD2 LEU 95 0.830 1.086 3.277 766 HD23 LEU 95 2HD2 LEU 95 -0.524 1.240 2.157 767 H LEU 96 H LEU 96 0.348 -2.792 6.134 768 HA LEU 96 HA LEU 96 -0.444 -2.880 8.917 769 HB2 LEU 96 2HB LEU 96 -0.621 -4.606 6.655 770 HB3 LEU 96 3HB LEU 96 0.208 -5.461 7.954 771 HG LEU 96 HG LEU 96 -1.752 -4.839 9.434 772 HD11 LEU 96 1HD1 LEU 96 -3.062 -4.246 6.786 773 HD12 LEU 96 2HD1 LEU 96 -2.601 -3.031 7.977 774 HD13 LEU 96 3HD1 LEU 96 -3.827 -4.235 8.375 775 HD21 LEU 96 3HD2 LEU 96 -2.995 -6.728 8.775 776 HD22 LEU 96 1HD2 LEU 96 -1.334 -7.066 8.291 777 HD23 LEU 96 2HD2 LEU 96 -2.516 -6.555 7.086 778 H ASN 97 H ASN 97 2.428 -2.456 7.416 779 HA ASN 97 HA ASN 97 4.618 -2.780 7.956 780 HB2 ASN 97 2HB ASN 97 3.318 -2.798 10.680 781 HB3 ASN 97 3HB ASN 97 5.065 -2.840 10.463 782 HD21 ASN 97 1HD2 ASN 97 5.603 -1.122 8.540 783 HD22 ASN 97 2HD2 ASN 97 5.060 0.471 8.931 784 H MET 98 H MET 98 3.024 -5.151 7.317 785 HA MET 98 HA MET 98 3.785 -7.298 9.016 786 HB2 MET 98 2HB MET 98 2.424 -6.978 6.430 787 HB3 MET 98 3HB MET 98 3.325 -8.479 6.591 788 HG2 MET 98 2HG MET 98 1.495 -7.641 8.785 789 HG3 MET 98 3HG MET 98 0.821 -8.333 7.311 790 HE1 MET 98 3HE MET 98 2.613 -9.097 10.708 791 HE2 MET 98 1HE MET 98 0.869 -9.238 10.479 792 HE3 MET 98 2HE MET 98 1.836 -10.679 10.797 793 H THR 99 H THR 99 5.210 -9.083 8.397 794 HA THR 99 HA THR 99 7.592 -8.093 6.974 795 HB THR 99 HB THR 99 8.035 -8.545 9.329 796 HG1 THR 99 HG1 THR 99 9.897 -9.424 8.804 797 HG21 THR 99 3HG2 THR 99 7.988 -11.247 9.693 798 HG22 THR 99 1HG2 THR 99 6.530 -10.995 8.734 799 HG23 THR 99 2HG2 THR 99 6.741 -10.136 10.260 800 H VAL 100 H VAL 100 5.650 -9.078 5.364 801 HA VAL 100 HA VAL 100 5.995 -11.895 4.884 802 HB VAL 100 HB VAL 100 4.628 -11.463 2.838 803 HG11 VAL 100 1HG1 VAL 100 3.612 -10.533 5.514 804 HG12 VAL 100 2HG1 VAL 100 2.563 -10.779 4.116 805 HG13 VAL 100 3HG1 VAL 100 3.466 -12.135 4.792 806 HG21 VAL 100 3HG2 VAL 100 5.410 -8.786 3.348 807 HG22 VAL 100 1HG2 VAL 100 4.436 -9.410 2.017 808 HG23 VAL 100 2HG2 VAL 100 3.656 -8.875 3.506 809 H SER 101 H SER 101 7.601 -12.787 3.784 810 HA SER 101 HA SER 101 9.207 -11.089 2.002 811 HB2 SER 101 2HB SER 101 9.846 -13.609 3.530 812 HB3 SER 101 3HB SER 101 10.884 -13.017 2.233 813 HG SER 101 HG SER 101 11.326 -12.320 4.507 814 H THR 102 H THR 102 6.624 -12.720 1.534 815 HA THR 102 HA THR 102 7.475 -13.766 -1.053 816 HB THR 102 HB THR 102 6.422 -15.888 -0.825 817 HG1 THR 102 HG1 THR 102 4.962 -16.306 0.679 818 HG21 THR 102 3HG2 THR 102 8.017 -15.304 1.672 819 HG22 THR 102 1HG2 THR 102 8.661 -15.816 0.113 820 HG23 THR 102 2HG2 THR 102 7.653 -16.915 1.055 821 H ALA 103 H ALA 103 6.098 -13.197 -2.613 822 HA ALA 103 HA ALA 103 3.966 -11.485 -2.247 823 HB1 ALA 103 1HB ALA 103 3.345 -11.962 -4.550 824 HB2 ALA 103 2HB ALA 103 5.097 -11.821 -4.394 825 HB3 ALA 103 3HB ALA 103 4.349 -13.412 -4.535 826 H ALA 104 H ALA 104 4.034 -14.969 -2.110 827 HA ALA 104 HA ALA 104 1.251 -15.427 -2.353 828 HB1 ALA 104 1HB ALA 104 3.535 -17.031 -1.268 829 HB2 ALA 104 2HB ALA 104 1.873 -17.602 -1.115 830 HB3 ALA 104 3HB ALA 104 2.562 -17.311 -2.712 831 H ALA 105 H ALA 105 3.374 -14.931 0.439 832 HA ALA 105 HA ALA 105 1.397 -15.371 2.415 833 HB1 ALA 105 1HB ALA 105 3.932 -15.351 2.696 834 HB2 ALA 105 2HB ALA 105 3.790 -13.595 2.784 835 HB3 ALA 105 3HB ALA 105 2.971 -14.607 3.974 836 H ALA 106 H ALA 106 2.455 -12.505 0.663 837 HA ALA 106 HA ALA 106 1.113 -10.575 2.203 838 HB1 ALA 106 1HB ALA 106 1.217 -9.217 0.051 839 HB2 ALA 106 2HB ALA 106 2.749 -9.783 0.716 840 HB3 ALA 106 3HB ALA 106 2.024 -10.615 -0.659 841 H GLU 107 H GLU 107 0.124 -12.142 -0.846 842 HA GLU 107 HA GLU 107 -2.449 -10.979 -0.908 843 HB2 GLU 107 2HB GLU 107 -1.397 -13.494 -2.212 844 HB3 GLU 107 3HB GLU 107 -2.960 -12.774 -2.568 845 HG2 GLU 107 2HG GLU 107 -1.911 -10.791 -3.427 846 HG3 GLU 107 3HG GLU 107 -0.322 -11.376 -2.939 847 H ASN 108 H ASN 108 -1.180 -13.898 0.556 848 HA ASN 108 HA ASN 108 -3.569 -15.245 1.077 849 HB2 ASN 108 2HB ASN 108 -1.389 -16.297 1.387 850 HB3 ASN 108 3HB ASN 108 -1.019 -15.189 2.705 851 HD21 ASN 108 1HD2 ASN 108 -0.809 -16.662 4.307 852 HD22 ASN 108 2HD2 ASN 108 -2.102 -17.654 4.881 853 H MET 109 H MET 109 -1.811 -12.889 3.078 854 HA MET 109 HA MET 109 -3.797 -12.888 5.139 855 HB2 MET 109 2HB MET 109 -1.194 -12.121 5.042 856 HB3 MET 109 3HB MET 109 -1.994 -10.560 4.925 857 HG2 MET 109 2HG MET 109 -3.252 -12.068 6.981 858 HG3 MET 109 3HG MET 109 -1.507 -12.122 7.224 859 HE1 MET 109 3HE MET 109 -4.351 -9.142 8.507 860 HE2 MET 109 1HE MET 109 -4.465 -9.041 6.750 861 HE3 MET 109 2HE MET 109 -4.638 -10.600 7.555 862 H TYR 110 H TYR 110 -3.081 -10.892 2.334 863 HA TYR 110 HA TYR 110 -4.815 -8.756 2.924 864 HB2 TYR 110 2HB TYR 110 -2.978 -8.985 1.090 865 HB3 TYR 110 3HB TYR 110 -4.278 -9.652 0.109 866 HD1 TYR 110 HD2 TYR 110 -3.659 -6.703 2.327 867 HD2 TYR 110 HD1 TYR 110 -5.426 -8.187 -1.248 868 HE1 TYR 110 HE2 TYR 110 -4.382 -4.425 1.745 869 HE2 TYR 110 HE1 TYR 110 -6.152 -5.913 -1.840 870 HH TYR 110 HH TYR 110 -4.947 -3.186 -0.479 871 H SER 111 H SER 111 -5.316 -11.803 1.207 872 HA SER 111 HA SER 111 -8.007 -11.202 0.447 873 HB2 SER 111 2HB SER 111 -7.199 -12.802 -0.975 874 HB3 SER 111 3HB SER 111 -6.195 -13.550 0.266 875 HG SER 111 HG SER 111 -8.749 -14.141 -0.508 876 H GLN 112 H GLN 112 -6.534 -13.231 2.963 877 HA GLN 112 HA GLN 112 -8.862 -14.261 4.080 878 HB2 GLN 112 2HB GLN 112 -6.096 -13.777 5.062 879 HB3 GLN 112 3HB GLN 112 -7.333 -14.115 6.265 880 HG2 GLN 112 2HG GLN 112 -6.892 -15.881 3.881 881 HG3 GLN 112 3HG GLN 112 -5.999 -16.082 5.387 882 HE21 GLN 112 1HE2 GLN 112 -7.300 -16.385 7.348 883 HE22 GLN 112 2HE2 GLN 112 -8.778 -17.273 7.227 884 H MET 113 H MET 113 -7.378 -11.119 4.443 885 HA MET 113 HA MET 113 -8.977 -10.336 6.694 886 HB2 MET 113 2HB MET 113 -6.753 -9.358 6.254 887 HB3 MET 113 3HB MET 113 -7.374 -8.634 4.777 888 HG2 MET 113 2HG MET 113 -8.503 -7.009 5.877 889 HG3 MET 113 3HG MET 113 -8.817 -8.024 7.282 890 HE1 MET 113 3HE MET 113 -6.842 -4.922 8.705 891 HE2 MET 113 1HE MET 113 -8.147 -5.037 7.524 892 HE3 MET 113 2HE MET 113 -8.219 -5.982 9.011 893 H GLY 114 H GLY 114 -9.302 -10.251 3.238 894 HA2 GLY 114 2HA GLY 114 -11.458 -10.060 2.223 895 HA3 GLY 114 3HA GLY 114 -11.970 -9.064 3.577 896 H LEU 115 H LEU 115 -8.918 -8.572 1.951 897 HA LEU 115 HA LEU 115 -9.945 -6.003 0.950 898 HB2 LEU 115 2HB LEU 115 -7.047 -6.692 1.300 899 HB3 LEU 115 3HB LEU 115 -7.793 -5.099 1.178 900 HG LEU 115 HG LEU 115 -8.146 -6.955 3.529 901 HD11 LEU 115 1HD1 LEU 115 -5.837 -6.360 3.449 902 HD12 LEU 115 2HD1 LEU 115 -6.609 -5.364 4.682 903 HD13 LEU 115 3HD1 LEU 115 -6.226 -4.674 3.105 904 HD21 LEU 115 3HD2 LEU 115 -9.515 -5.417 4.407 905 HD22 LEU 115 1HD2 LEU 115 -9.676 -4.826 2.753 906 HD23 LEU 115 2HD2 LEU 115 -8.518 -4.073 3.849 907 H ASP 116 H ASP 116 -8.350 -8.964 0.068 908 HA ASP 116 HA ASP 116 -7.528 -8.112 -2.536 909 HB2 ASP 116 2HB ASP 116 -6.806 -10.187 -0.990 910 HB3 ASP 116 3HB ASP 116 -7.990 -10.997 -2.011 911 H THR 117 H THR 117 -8.395 -8.839 -4.552 912 HA THR 117 HA THR 117 -11.262 -9.512 -4.440 913 HB THR 117 HB THR 117 -10.365 -8.013 -6.812 914 HG1 THR 117 HG1 THR 117 -10.641 -6.668 -4.314 915 HG21 THR 117 3HG2 THR 117 -12.702 -7.747 -4.916 916 HG22 THR 117 1HG2 THR 117 -12.701 -8.599 -6.460 917 HG23 THR 117 2HG2 THR 117 -12.502 -6.847 -6.419 918 H ARG 118 H ARG 118 -8.982 -11.299 -4.728 919 HA ARG 118 HA ARG 118 -9.922 -12.837 -6.925 920 HB2 ARG 118 2HB ARG 118 -8.511 -11.103 -8.085 921 HB3 ARG 118 3HB ARG 118 -7.120 -11.752 -7.226 922 HG2 ARG 118 2HG ARG 118 -7.414 -13.898 -8.308 923 HG3 ARG 118 3HG ARG 118 -8.869 -13.311 -9.117 924 HD2 ARG 118 2HD ARG 118 -7.655 -11.837 -10.475 925 HD3 ARG 118 3HD ARG 118 -6.223 -11.937 -9.451 926 HE ARG 118 HE ARG 118 -6.730 -14.487 -10.453 927 HH11 ARG 118 1HH1 ARG 118 -5.817 -11.339 -11.628 928 HH12 ARG 118 2HH1 ARG 118 -4.928 -11.958 -12.980 929 HH21 ARG 118 1HH2 ARG 118 -5.562 -15.313 -12.230 930 HH22 ARG 118 2HH2 ARG 118 -4.784 -14.218 -13.322 931 HA PRO 119 HA PRO 119 -7.728 -15.023 -3.440 932 HB2 PRO 119 2HB PRO 119 -9.806 -16.659 -2.828 933 HB3 PRO 119 3HB PRO 119 -9.615 -15.048 -2.129 934 HG2 PRO 119 2HG PRO 119 -11.345 -15.931 -4.406 935 HG3 PRO 119 3HG PRO 119 -11.731 -14.833 -3.068 936 HD2 PRO 119 2HD PRO 119 -11.077 -13.942 -5.540 937 HD3 PRO 119 3HD PRO 119 -10.672 -13.044 -4.064 938 H SER 120 H SER 120 -6.361 -16.487 -4.230 939 HA SER 120 HA SER 120 -7.396 -18.520 -6.095 940 HB2 SER 120 2HB SER 120 -5.182 -16.752 -6.338 941 HB3 SER 120 3HB SER 120 -4.540 -18.387 -6.180 942 HG SER 120 HG SER 120 -6.302 -17.357 -8.128 943 H MET 121 H MET 121 -5.770 -20.499 -6.086 944 HA MET 121 HA MET 121 -5.835 -21.509 -3.362 945 HB2 MET 121 2HB MET 121 -5.062 -22.953 -5.901 946 HB3 MET 121 3HB MET 121 -5.435 -23.686 -4.347 947 HG2 MET 121 2HG MET 121 -7.680 -22.186 -4.913 948 HG3 MET 121 3HG MET 121 -7.203 -22.838 -6.479 949 HE1 MET 121 3HE MET 121 -6.699 -26.215 -6.226 950 HE2 MET 121 1HE MET 121 -8.379 -26.058 -6.741 951 HE3 MET 121 2HE MET 121 -7.189 -24.853 -7.234 952 H LYS 122 H LYS 122 -3.989 -19.621 -3.341 953 HA LYS 122 HA LYS 122 -1.392 -20.952 -3.708 954 HB2 LYS 122 2HB LYS 122 -2.037 -18.022 -3.326 955 HB3 LYS 122 3HB LYS 122 -0.420 -18.684 -3.527 956 HG2 LYS 122 2HG LYS 122 -1.373 -19.647 -5.742 957 HG3 LYS 122 3HG LYS 122 -2.617 -18.413 -5.529 958 HD2 LYS 122 2HD LYS 122 -0.091 -17.207 -5.045 959 HD3 LYS 122 3HD LYS 122 0.021 -18.121 -6.552 960 HE2 LYS 122 2HE LYS 122 -2.311 -16.316 -6.023 961 HE3 LYS 122 3HE LYS 122 -0.787 -15.663 -6.623 962 HZ1 LYS 122 3HZ LYS 122 -2.532 -16.313 -8.328 963 HZ2 LYS 122 1HZ LYS 122 -2.141 -17.920 -7.969 964 HZ3 LYS 122 2HZ LYS 122 -0.959 -16.880 -8.589 965 H GLU 123 H GLU 123 -0.039 -21.308 -2.017 966 HA GLU 123 HA GLU 123 -0.847 -20.309 0.626 967 HB2 GLU 123 2HB GLU 123 -0.506 -23.121 -0.259 968 HB3 GLU 123 3HB GLU 123 0.138 -22.708 1.323 969 HG2 GLU 123 2HG GLU 123 -2.198 -21.659 1.721 970 HG3 GLU 123 3HG GLU 123 -2.688 -22.678 0.369 971 H ALA 124 H ALA 124 0.960 -20.755 2.272 972 HA ALA 124 HA ALA 124 3.631 -21.044 1.369 973 HB1 ALA 124 1HB ALA 124 3.968 -18.465 2.237 974 HB2 ALA 124 2HB ALA 124 3.960 -18.991 0.553 975 HB3 ALA 124 3HB ALA 124 2.485 -18.364 1.287 976 H GLY 125 H GLY 125 5.134 -21.072 3.073 977 HA2 GLY 125 2HA GLY 125 4.410 -20.265 5.729 978 HA3 GLY 125 3HA GLY 125 4.311 -22.006 5.512 979 H GLY 126 H GLY 126 6.191 -19.894 6.892 980 HA2 GLY 126 2HA GLY 126 8.383 -21.254 7.432 981 HA3 GLY 126 3HA GLY 126 8.746 -20.781 5.779 982 H LYS 127 H LYS 127 9.914 -19.002 5.569 983 HA LYS 127 HA LYS 127 10.905 -17.000 5.994 984 HB2 LYS 127 2HB LYS 127 8.529 -16.234 5.956 985 HB3 LYS 127 3HB LYS 127 8.469 -16.456 7.700 986 HG2 LYS 127 2HG LYS 127 10.723 -14.826 6.963 987 HG3 LYS 127 3HG LYS 127 9.224 -14.164 6.308 988 HD2 LYS 127 2HD LYS 127 8.356 -13.730 8.369 989 HD3 LYS 127 3HD LYS 127 9.187 -15.091 9.125 990 HE2 LYS 127 2HE LYS 127 11.275 -13.491 8.404 991 HE3 LYS 127 3HE LYS 127 10.034 -12.303 8.800 992 HZ1 LYS 127 3HZ LYS 127 11.026 -14.473 10.567 993 HZ2 LYS 127 1HZ LYS 127 9.744 -13.437 10.947 994 HZ3 LYS 127 2HZ LYS 127 11.304 -12.815 10.751 995 H GLU 128 H GLU 128 12.705 -17.507 7.131 996 HA GLU 128 HA GLU 128 12.481 -17.407 10.065 997 HB2 GLU 128 2HB GLU 128 14.316 -19.184 8.449 998 HB3 GLU 128 3HB GLU 128 14.339 -19.031 10.200 999 HG2 GLU 128 2HG GLU 128 11.687 -19.647 9.406 1000 HG3 GLU 128 3HG GLU 128 12.781 -20.764 8.593 1001 H GLU 129 H GLU 129 12.962 -15.141 9.836 1002 HA GLU 129 HA GLU 129 15.705 -14.556 10.170 1003 HB2 GLU 129 2HB GLU 129 15.051 -14.729 7.513 1004 HB3 GLU 129 3HB GLU 129 14.835 -13.013 7.829 1005 HG2 GLU 129 2HG GLU 129 17.255 -13.705 9.046 1006 HG3 GLU 129 3HG GLU 129 17.252 -14.514 7.480 1007 H GLY 130 H GLY 130 15.727 -12.952 11.594 1008 HA2 GLY 130 2HA GLY 130 14.214 -10.553 11.241 1009 HA3 GLY 130 3HA GLY 130 13.530 -11.566 12.504 1010 HA PRO 131 HA PRO 131 17.977 -10.334 13.981 1011 HB2 PRO 131 2HB PRO 131 19.219 -8.392 12.547 1012 HB3 PRO 131 3HB PRO 131 19.404 -10.113 12.193 1013 HG2 PRO 131 2HG PRO 131 17.644 -8.086 10.870 1014 HG3 PRO 131 3HG PRO 131 18.637 -9.356 10.133 1015 HD2 PRO 131 2HD PRO 131 15.965 -9.616 10.483 1016 HD3 PRO 131 3HD PRO 131 17.077 -10.998 10.557 1017 HA PRO 132 HA PRO 132 16.705 -6.752 16.192 1018 HB2 PRO 132 2HB PRO 132 19.057 -5.726 17.079 1019 HB3 PRO 132 3HB PRO 132 18.355 -7.216 17.722 1020 HG2 PRO 132 2HG PRO 132 20.522 -6.868 15.687 1021 HG3 PRO 132 3HG PRO 132 20.433 -8.007 17.042 1022 HD2 PRO 132 2HD PRO 132 19.869 -8.728 14.494 1023 HD3 PRO 132 3HD PRO 132 19.060 -9.460 15.895 1024 H GLN 133 H GLN 133 16.586 -4.465 16.172 1025 HA GLN 133 HA GLN 133 18.189 -2.844 14.483 1026 HB2 GLN 133 2HB GLN 133 15.968 -4.183 13.250 1027 HB3 GLN 133 3HB GLN 133 15.669 -2.450 13.266 1028 HG2 GLN 133 2HG GLN 133 18.137 -3.780 12.172 1029 HG3 GLN 133 3HG GLN 133 16.778 -3.194 11.214 1030 HE21 GLN 133 1HE2 GLN 133 19.719 -2.461 11.492 1031 HE22 GLN 133 2HE2 GLN 133 19.699 -0.741 11.652 1032 H ALA 134 H ALA 134 17.103 -0.610 14.194 1033 HA ALA 134 HA ALA 134 16.299 1.271 15.192 1034 HB1 ALA 134 1HB ALA 134 14.125 1.177 16.187 1035 HB2 ALA 134 2HB ALA 134 14.156 0.055 14.826 1036 HB3 ALA 134 3HB ALA 134 14.277 -0.557 16.476 1037 H TYR 135 H TYR 135 15.360 1.961 17.596 1038 HA TYR 135 HA TYR 135 17.416 0.983 19.467 1039 HB2 TYR 135 2HB TYR 135 16.276 3.732 19.031 1040 HB3 TYR 135 3HB TYR 135 17.060 3.301 20.546 1041 HD1 TYR 135 HD2 TYR 135 19.471 2.583 20.507 1042 HD2 TYR 135 HD1 TYR 135 17.544 4.270 17.109 1043 HE1 TYR 135 HE2 TYR 135 21.666 3.085 19.519 1044 HE2 TYR 135 HE1 TYR 135 19.734 4.775 16.111 1045 HH TYR 135 HH TYR 135 22.568 4.787 17.804 Start of MODEL 11 1 H21 MYR 1 1H2 MYR 1 -1.480 10.859 3.709 2 H22 MYR 1 2H2 MYR 1 -0.925 11.208 5.334 3 H31 MYR 1 1H3 MYR 1 1.158 10.085 5.015 4 H32 MYR 1 2H3 MYR 1 1.234 10.486 3.299 5 H41 MYR 1 1H4 MYR 1 -1.003 8.610 4.200 6 H42 MYR 1 2H4 MYR 1 0.641 7.966 4.200 7 H51 MYR 1 1H5 MYR 1 -0.655 9.353 1.755 8 H52 MYR 1 2H5 MYR 1 -0.680 7.607 2.014 9 H61 MYR 1 1H6 MYR 1 2.054 8.908 2.206 10 H62 MYR 1 2H6 MYR 1 1.307 8.954 0.607 11 H71 MYR 1 1H7 MYR 1 1.033 6.266 1.897 12 H72 MYR 1 2H7 MYR 1 2.721 6.763 1.755 13 H81 MYR 1 1H8 MYR 1 2.697 6.193 -0.459 14 H82 MYR 1 2H8 MYR 1 1.516 7.468 -0.771 15 H91 MYR 1 1H9 MYR 1 -0.373 5.888 -0.221 16 H92 MYR 1 2H9 MYR 1 0.779 4.611 0.167 17 H101 MYR 1 1H10 MYR 1 1.710 5.083 -2.316 18 H102 MYR 1 2H10 MYR 1 0.139 5.819 -2.588 19 H111 MYR 1 1H11 MYR 1 -0.296 3.607 -3.271 20 H112 MYR 1 2H11 MYR 1 -0.823 3.538 -1.597 21 H121 MYR 1 1H12 MYR 1 2.096 2.852 -2.095 22 H122 MYR 1 2H12 MYR 1 0.901 1.696 -2.683 23 H131 MYR 1 1H13 MYR 1 -0.049 2.317 -0.070 24 H132 MYR 1 2H13 MYR 1 1.705 2.318 0.131 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 -1.478 12.505 2.239 29 HA2 GLY 2 2HA GLY 2 -1.241 15.092 2.632 30 HA3 GLY 2 3HA GLY 2 0.464 14.672 2.560 31 H ASN 3 H ASN 3 -0.066 16.412 0.765 32 HA ASN 3 HA ASN 3 -0.101 14.918 -1.741 33 HB2 ASN 3 2HB ASN 3 -2.425 15.976 -1.072 34 HB3 ASN 3 3HB ASN 3 -1.677 17.459 -1.657 35 HD21 ASN 3 1HD2 ASN 3 -2.323 14.108 -2.571 36 HD22 ASN 3 2HD2 ASN 3 -2.524 14.422 -4.258 37 H GLY 4 H GLY 4 2.134 15.908 -0.536 38 HA2 GLY 4 2HA GLY 4 2.834 18.135 -2.337 39 HA3 GLY 4 3HA GLY 4 3.290 18.190 -0.640 40 H ALA 5 H ALA 5 4.158 15.657 -0.153 41 HA ALA 5 HA ALA 5 6.309 15.225 -2.116 42 HB1 ALA 5 1HB ALA 5 7.497 14.524 0.234 43 HB2 ALA 5 2HB ALA 5 7.704 16.074 -0.582 44 HB3 ALA 5 3HB ALA 5 6.525 15.914 0.720 45 H SER 6 H SER 6 7.440 13.068 -1.685 46 HA SER 6 HA SER 6 5.386 11.051 -1.057 47 HB2 SER 6 2HB SER 6 7.769 10.532 -2.821 48 HB3 SER 6 3HB SER 6 6.239 9.658 -2.749 49 HG SER 6 HG SER 6 6.156 10.932 -4.550 50 H ARG 7 H ARG 7 7.201 12.287 0.849 51 HA ARG 7 HA ARG 7 9.434 10.742 1.458 52 HB2 ARG 7 2HB ARG 7 9.104 11.563 3.801 53 HB3 ARG 7 3HB ARG 7 9.091 12.829 2.581 54 HG2 ARG 7 2HG ARG 7 6.601 12.766 2.642 55 HG3 ARG 7 3HG ARG 7 6.718 11.642 3.997 56 HD2 ARG 7 2HD ARG 7 8.388 13.950 4.431 57 HD3 ARG 7 3HD ARG 7 6.727 14.437 4.096 58 HE ARG 7 HE ARG 7 7.696 13.194 6.465 59 HH11 ARG 7 1HH1 ARG 7 4.931 13.399 4.360 60 HH12 ARG 7 2HH1 ARG 7 3.792 12.997 5.601 61 HH21 ARG 7 1HH2 ARG 7 6.206 12.663 8.109 62 HH22 ARG 7 2HH2 ARG 7 4.518 12.579 7.734 63 H ASP 8 H ASP 8 6.065 10.351 2.502 64 HA ASP 8 HA ASP 8 6.395 8.215 4.246 65 HB2 ASP 8 2HB ASP 8 4.159 9.306 2.640 66 HB3 ASP 8 3HB ASP 8 3.975 7.642 3.189 67 H TRP 9 H TRP 9 6.373 8.287 0.758 68 HA TRP 9 HA TRP 9 6.061 5.468 0.402 69 HB2 TRP 9 2HB TRP 9 5.455 7.053 -1.368 70 HB3 TRP 9 3HB TRP 9 7.134 7.572 -1.491 71 HD1 TRP 9 HD1 TRP 9 8.903 5.595 -2.357 72 HE1 TRP 9 HE1 TRP 9 8.511 3.745 -4.103 73 HE3 TRP 9 HE3 TRP 9 3.791 5.561 -2.371 74 HZ2 TRP 9 HZ2 TRP 9 6.325 2.444 -5.325 75 HZ3 TRP 9 HZ3 TRP 9 2.626 3.984 -3.858 76 HH2 TRP 9 HH2 TRP 9 3.869 2.459 -5.304 77 H LYS 10 H LYS 10 8.845 7.677 0.206 78 HA LYS 10 HA LYS 10 10.793 5.760 -0.370 79 HB2 LYS 10 2HB LYS 10 10.839 8.425 -0.181 80 HB3 LYS 10 3HB LYS 10 11.527 8.043 1.392 81 HG2 LYS 10 2HG LYS 10 13.094 6.484 -0.001 82 HG3 LYS 10 3HG LYS 10 12.626 7.545 -1.331 83 HD2 LYS 10 2HD LYS 10 14.204 8.959 -0.646 84 HD3 LYS 10 3HD LYS 10 13.223 9.257 0.790 85 HE2 LYS 10 2HE LYS 10 15.166 6.969 0.601 86 HE3 LYS 10 3HE LYS 10 15.640 8.568 1.171 87 HZ1 LYS 10 3HZ LYS 10 15.034 7.767 3.155 88 HZ2 LYS 10 1HZ LYS 10 14.096 6.521 2.499 89 HZ3 LYS 10 2HZ LYS 10 13.451 8.078 2.645 90 H MET 11 H MET 11 9.775 7.070 2.780 91 HA MET 11 HA MET 11 11.511 5.464 4.323 92 HB2 MET 11 2HB MET 11 10.240 6.186 6.227 93 HB3 MET 11 3HB MET 11 10.380 7.545 5.120 94 HG2 MET 11 2HG MET 11 8.123 7.162 4.324 95 HG3 MET 11 3HG MET 11 7.978 5.752 5.370 96 HE1 MET 11 3HE MET 11 8.066 10.145 6.420 97 HE2 MET 11 1HE MET 11 9.582 9.378 6.897 98 HE3 MET 11 2HE MET 11 9.043 9.298 5.219 99 H ALA 12 H ALA 12 8.272 4.966 3.072 100 HA ALA 12 HA ALA 12 7.497 2.765 4.597 101 HB1 ALA 12 1HB ALA 12 6.155 2.172 2.475 102 HB2 ALA 12 2HB ALA 12 5.815 3.697 3.294 103 HB3 ALA 12 3HB ALA 12 6.801 3.682 1.832 104 H ILE 13 H ILE 13 9.257 2.862 1.509 105 HA ILE 13 HA ILE 13 9.605 0.005 1.458 106 HB ILE 13 HB ILE 13 10.902 2.146 -0.234 107 HG12 ILE 13 2HG1 ILE 13 8.535 0.339 -0.775 108 HG13 ILE 13 3HG1 ILE 13 8.465 2.074 -0.488 109 HG21 ILE 13 1HG2 ILE 13 12.229 0.112 -0.200 110 HG22 ILE 13 2HG2 ILE 13 10.803 -0.845 -0.599 111 HG23 ILE 13 3HG2 ILE 13 11.446 0.308 -1.768 112 HD11 ILE 13 3HD1 ILE 13 8.255 1.636 -2.835 113 HD12 ILE 13 1HD1 ILE 13 9.802 2.425 -2.530 114 HD13 ILE 13 2HD1 ILE 13 9.742 0.687 -2.831 115 H LYS 14 H LYS 14 11.392 2.756 2.600 116 HA LYS 14 HA LYS 14 13.978 1.727 2.680 117 HB2 LYS 14 2HB LYS 14 13.542 4.058 3.152 118 HB3 LYS 14 3HB LYS 14 12.592 3.635 4.570 119 HG2 LYS 14 2HG LYS 14 14.400 3.417 5.866 120 HG3 LYS 14 3HG LYS 14 15.323 2.589 4.609 121 HD2 LYS 14 2HD LYS 14 15.349 4.987 3.519 122 HD3 LYS 14 3HD LYS 14 15.077 5.503 5.186 123 HE2 LYS 14 2HE LYS 14 17.361 5.489 5.150 124 HE3 LYS 14 3HE LYS 14 17.060 3.829 5.660 125 HZ1 LYS 14 3HZ LYS 14 18.433 3.367 3.960 126 HZ2 LYS 14 1HZ LYS 14 18.143 4.831 3.163 127 HZ3 LYS 14 2HZ LYS 14 17.045 3.554 3.011 128 H ARG 15 H ARG 15 11.397 1.522 5.116 129 HA ARG 15 HA ARG 15 13.005 -0.217 6.787 130 HB2 ARG 15 2HB ARG 15 10.201 0.867 7.039 131 HB3 ARG 15 3HB ARG 15 10.891 -0.269 8.190 132 HG2 ARG 15 2HG ARG 15 12.740 1.380 8.567 133 HG3 ARG 15 3HG ARG 15 11.819 2.527 7.592 134 HD2 ARG 15 2HD ARG 15 9.936 2.326 9.148 135 HD3 ARG 15 3HD ARG 15 10.867 1.189 10.123 136 HE ARG 15 HE ARG 15 12.304 3.598 9.813 137 HH11 ARG 15 1HH1 ARG 15 9.542 2.269 11.462 138 HH12 ARG 15 2HH1 ARG 15 9.639 3.375 12.792 139 HH21 ARG 15 1HH2 ARG 15 12.443 5.061 11.558 140 HH22 ARG 15 2HH2 ARG 15 11.289 4.964 12.845 141 H CYS 16 H CYS 16 10.267 -0.452 4.596 142 HA CYS 16 HA CYS 16 9.478 -3.077 5.210 143 HB2 CYS 16 2HB CYS 16 8.117 -1.511 3.869 144 HB3 CYS 16 3HB CYS 16 9.285 -1.633 2.558 145 HG CYS 16 HG CYS 16 8.820 -4.448 2.265 146 H SER 17 H SER 17 12.230 -1.873 3.577 147 HA SER 17 HA SER 17 12.848 -3.850 1.752 148 HB2 SER 17 2HB SER 17 14.151 -1.754 2.099 149 HB3 SER 17 3HB SER 17 14.823 -2.452 3.572 150 HG SER 17 HG SER 17 16.176 -2.723 1.710 151 H ASN 18 H ASN 18 12.990 -3.940 5.231 152 HA ASN 18 HA ASN 18 14.692 -6.124 5.605 153 HB2 ASN 18 2HB ASN 18 12.277 -5.404 7.280 154 HB3 ASN 18 3HB ASN 18 13.667 -6.355 7.796 155 HD21 ASN 18 1HD2 ASN 18 15.750 -4.912 6.805 156 HD22 ASN 18 2HD2 ASN 18 15.810 -3.364 7.569 157 H VAL 19 H VAL 19 11.323 -5.963 4.683 158 HA VAL 19 HA VAL 19 10.448 -8.524 5.213 159 HB VAL 19 HB VAL 19 9.813 -6.855 2.776 160 HG11 VAL 19 1HG1 VAL 19 9.193 -9.186 2.446 161 HG12 VAL 19 2HG1 VAL 19 8.323 -9.185 3.981 162 HG13 VAL 19 3HG1 VAL 19 7.757 -8.182 2.646 163 HG21 VAL 19 3HG2 VAL 19 7.913 -6.053 4.020 164 HG22 VAL 19 1HG2 VAL 19 8.312 -7.104 5.380 165 HG23 VAL 19 2HG2 VAL 19 9.376 -5.760 4.961 166 H ALA 20 H ALA 20 10.839 -10.503 4.425 167 HA ALA 20 HA ALA 20 12.691 -10.719 2.146 168 HB1 ALA 20 1HB ALA 20 12.452 -13.167 3.617 169 HB2 ALA 20 2HB ALA 20 13.875 -12.160 3.348 170 HB3 ALA 20 3HB ALA 20 12.813 -11.837 4.718 171 H VAL 21 H VAL 21 12.289 -12.198 0.503 172 HA VAL 21 HA VAL 21 9.646 -12.559 -0.293 173 HB VAL 21 HB VAL 21 12.000 -14.243 -1.157 174 HG11 VAL 21 1HG1 VAL 21 10.554 -14.109 -3.342 175 HG12 VAL 21 2HG1 VAL 21 10.189 -15.300 -2.092 176 HG13 VAL 21 3HG1 VAL 21 9.242 -13.817 -2.202 177 HG21 VAL 21 3HG2 VAL 21 12.876 -12.403 -2.043 178 HG22 VAL 21 1HG2 VAL 21 11.436 -12.235 -3.047 179 HG23 VAL 21 2HG2 VAL 21 11.513 -11.439 -1.475 180 H GLY 22 H GLY 22 11.630 -14.470 1.808 181 HA2 GLY 22 2HA GLY 22 9.398 -16.376 2.088 182 HA3 GLY 22 3HA GLY 22 11.052 -16.956 1.957 183 H VAL 23 H VAL 23 9.654 -17.734 4.111 184 HA VAL 23 HA VAL 23 10.215 -15.926 6.322 185 HB VAL 23 HB VAL 23 9.093 -17.576 7.730 186 HG11 VAL 23 1HG1 VAL 23 7.801 -16.532 5.270 187 HG12 VAL 23 2HG1 VAL 23 6.881 -17.656 6.273 188 HG13 VAL 23 3HG1 VAL 23 7.489 -16.150 6.962 189 HG21 VAL 23 3HG2 VAL 23 9.817 -19.618 6.665 190 HG22 VAL 23 1HG2 VAL 23 8.054 -19.571 6.697 191 HG23 VAL 23 2HG2 VAL 23 8.918 -19.213 5.202 192 H GLY 24 H GLY 24 11.402 -18.919 4.936 193 HA2 GLY 24 2HA GLY 24 13.764 -18.719 6.646 194 HA3 GLY 24 3HA GLY 24 12.844 -20.214 6.728 195 H GLY 25 H GLY 25 14.807 -21.263 6.008 196 HA2 GLY 25 2HA GLY 25 16.088 -22.277 4.397 197 HA3 GLY 25 3HA GLY 25 14.780 -21.902 3.285 198 H LYS 26 H LYS 26 15.049 -20.323 1.800 199 HA LYS 26 HA LYS 26 17.694 -19.319 1.379 200 HB2 LYS 26 2HB LYS 26 16.669 -18.165 -0.576 201 HB3 LYS 26 3HB LYS 26 16.354 -19.895 -0.536 202 HG2 LYS 26 2HG LYS 26 14.168 -19.556 -0.565 203 HG3 LYS 26 3HG LYS 26 14.265 -18.481 0.832 204 HD2 LYS 26 2HD LYS 26 13.351 -17.157 -0.876 205 HD3 LYS 26 3HD LYS 26 15.055 -16.696 -0.818 206 HE2 LYS 26 2HE LYS 26 15.537 -18.118 -2.716 207 HE3 LYS 26 3HE LYS 26 13.873 -18.701 -2.737 208 HZ1 LYS 26 3HZ LYS 26 14.526 -15.834 -3.057 209 HZ2 LYS 26 1HZ LYS 26 13.088 -16.634 -3.450 210 HZ3 LYS 26 2HZ LYS 26 14.478 -16.890 -4.377 211 H SER 27 H SER 27 18.492 -17.282 1.648 212 HA SER 27 HA SER 27 16.784 -15.414 3.152 213 HB2 SER 27 2HB SER 27 18.764 -16.235 4.380 214 HB3 SER 27 3HB SER 27 19.807 -15.601 3.106 215 HG SER 27 HG SER 27 19.645 -13.702 3.975 216 H LYS 28 H LYS 28 15.877 -14.313 1.431 217 HA LYS 28 HA LYS 28 17.708 -12.502 0.035 218 HB2 LYS 28 2HB LYS 28 16.549 -14.669 -1.241 219 HB3 LYS 28 3HB LYS 28 15.475 -13.338 -1.649 220 HG2 LYS 28 2HG LYS 28 16.916 -12.545 -3.132 221 HG3 LYS 28 3HG LYS 28 18.221 -12.538 -1.943 222 HD2 LYS 28 2HD LYS 28 19.082 -14.031 -3.442 223 HD3 LYS 28 3HD LYS 28 18.175 -15.143 -2.414 224 HE2 LYS 28 2HE LYS 28 17.197 -15.838 -4.299 225 HE3 LYS 28 3HE LYS 28 16.297 -14.323 -4.248 226 HZ1 LYS 28 3HZ LYS 28 17.341 -13.605 -6.052 227 HZ2 LYS 28 1HZ LYS 28 17.988 -15.157 -6.239 228 HZ3 LYS 28 2HZ LYS 28 18.867 -13.968 -5.418 229 H LYS 29 H LYS 29 17.103 -10.517 0.564 230 HA LYS 29 HA LYS 29 14.391 -9.962 1.415 231 HB2 LYS 29 2HB LYS 29 16.998 -8.538 1.495 232 HB3 LYS 29 3HB LYS 29 15.547 -7.544 1.475 233 HG2 LYS 29 2HG LYS 29 15.179 -7.931 3.623 234 HG3 LYS 29 3HG LYS 29 15.265 -9.677 3.378 235 HD2 LYS 29 2HD LYS 29 17.574 -9.732 3.768 236 HD3 LYS 29 3HD LYS 29 17.745 -7.991 3.527 237 HE2 LYS 29 2HE LYS 29 16.043 -7.993 5.601 238 HE3 LYS 29 3HE LYS 29 16.883 -9.511 5.914 239 HZ1 LYS 29 3HZ LYS 29 17.809 -7.318 6.881 240 HZ2 LYS 29 1HZ LYS 29 18.432 -7.079 5.326 241 HZ3 LYS 29 2HZ LYS 29 18.882 -8.444 6.217 242 H PHE 30 H PHE 30 13.213 -8.072 0.562 243 HA PHE 30 HA PHE 30 13.115 -8.191 -2.313 244 HB2 PHE 30 2HB PHE 30 11.467 -6.852 -0.192 245 HB3 PHE 30 3HB PHE 30 11.264 -6.405 -1.883 246 HD1 PHE 30 HD1 PHE 30 10.971 -8.463 -3.518 247 HD2 PHE 30 HD2 PHE 30 10.145 -8.521 0.657 248 HE1 PHE 30 HE1 PHE 30 9.469 -10.384 -3.846 249 HE2 PHE 30 HE2 PHE 30 8.642 -10.442 0.336 250 HZ PHE 30 HZ PHE 30 8.303 -11.377 -1.917 251 H GLY 31 H GLY 31 12.552 -5.843 -3.316 252 HA2 GLY 31 2HA GLY 31 14.450 -3.839 -2.373 253 HA3 GLY 31 3HA GLY 31 14.763 -4.527 -3.959 254 H GLU 32 H GLU 32 14.398 -1.854 -3.777 255 HA GLU 32 HA GLU 32 11.714 -1.004 -4.082 256 HB2 GLU 32 2HB GLU 32 12.608 1.106 -4.728 257 HB3 GLU 32 3HB GLU 32 13.679 0.458 -3.494 258 HG2 GLU 32 2HG GLU 32 14.873 -0.472 -5.733 259 HG3 GLU 32 3HG GLU 32 14.186 1.039 -6.325 260 H GLY 33 H GLY 33 14.020 -2.419 -6.245 261 HA2 GLY 33 2HA GLY 33 12.917 -1.536 -8.698 262 HA3 GLY 33 3HA GLY 33 13.929 -2.955 -8.476 263 H ASN 34 H ASN 34 12.561 -4.682 -7.051 264 HA ASN 34 HA ASN 34 10.587 -5.642 -8.829 265 HB2 ASN 34 2HB ASN 34 11.483 -6.472 -6.079 266 HB3 ASN 34 3HB ASN 34 10.130 -7.271 -6.875 267 HD21 ASN 34 1HD2 ASN 34 11.377 -9.199 -6.809 268 HD22 ASN 34 2HD2 ASN 34 12.620 -9.480 -7.976 269 H PHE 35 H PHE 35 10.431 -3.853 -5.812 270 HA PHE 35 HA PHE 35 7.721 -4.163 -5.228 271 HB2 PHE 35 2HB PHE 35 9.850 -2.257 -4.500 272 HB3 PHE 35 3HB PHE 35 8.212 -1.629 -4.359 273 HD1 PHE 35 HD1 PHE 35 9.444 -5.080 -3.759 274 HD2 PHE 35 HD2 PHE 35 7.843 -1.516 -2.070 275 HE1 PHE 35 HE1 PHE 35 9.198 -6.221 -1.594 276 HE2 PHE 35 HE2 PHE 35 7.594 -2.652 0.098 277 HZ PHE 35 HZ PHE 35 8.273 -5.007 0.339 278 H ARG 36 H ARG 36 9.346 -1.669 -7.170 279 HA ARG 36 HA ARG 36 6.996 -0.253 -7.843 280 HB2 ARG 36 2HB ARG 36 9.616 -0.404 -9.345 281 HB3 ARG 36 3HB ARG 36 8.367 0.812 -9.577 282 HG2 ARG 36 2HG ARG 36 9.149 0.671 -6.810 283 HG3 ARG 36 3HG ARG 36 10.549 0.934 -7.852 284 HD2 ARG 36 2HD ARG 36 8.073 2.535 -8.304 285 HD3 ARG 36 3HD ARG 36 9.135 2.957 -6.961 286 HE ARG 36 HE ARG 36 9.605 3.441 -9.727 287 HH11 ARG 36 1HH1 ARG 36 11.187 2.704 -6.715 288 HH12 ARG 36 2HH1 ARG 36 12.689 3.435 -7.175 289 HH21 ARG 36 1HH2 ARG 36 11.577 4.406 -10.344 290 HH22 ARG 36 2HH2 ARG 36 12.910 4.403 -9.239 291 H TRP 37 H TRP 37 8.775 -2.845 -9.463 292 HA TRP 37 HA TRP 37 7.331 -2.885 -11.859 293 HB2 TRP 37 2HB TRP 37 9.388 -4.110 -11.698 294 HB3 TRP 37 3HB TRP 37 8.765 -5.091 -10.374 295 HD1 TRP 37 HD1 TRP 37 8.927 -4.931 -14.128 296 HE1 TRP 37 HE1 TRP 37 7.752 -6.989 -15.130 297 HE3 TRP 37 HE3 TRP 37 6.703 -6.738 -9.894 298 HZ2 TRP 37 HZ2 TRP 37 6.100 -9.100 -14.244 299 HZ3 TRP 37 HZ3 TRP 37 5.342 -8.781 -10.057 300 HH2 TRP 37 HH2 TRP 37 5.047 -9.935 -12.188 301 H ALA 38 H ALA 38 6.576 -4.139 -8.697 302 HA ALA 38 HA ALA 38 4.418 -5.818 -9.578 303 HB1 ALA 38 1HB ALA 38 5.295 -4.862 -6.863 304 HB2 ALA 38 2HB ALA 38 3.883 -5.891 -7.111 305 HB3 ALA 38 3HB ALA 38 5.486 -6.467 -7.570 306 H ILE 39 H ILE 39 4.502 -2.823 -7.632 307 HA ILE 39 HA ILE 39 1.753 -2.344 -7.663 308 HB ILE 39 HB ILE 39 3.201 -1.164 -6.126 309 HG12 ILE 39 2HG1 ILE 39 2.330 1.175 -7.672 310 HG13 ILE 39 3HG1 ILE 39 1.087 -0.058 -7.488 311 HG21 ILE 39 1HG2 ILE 39 4.278 0.390 -8.468 312 HG22 ILE 39 2HG2 ILE 39 4.796 0.478 -6.786 313 HG23 ILE 39 3HG2 ILE 39 5.115 -0.975 -7.731 314 HD11 ILE 39 3HD1 ILE 39 2.375 0.365 -4.977 315 HD12 ILE 39 1HD1 ILE 39 1.862 1.913 -5.649 316 HD13 ILE 39 2HD1 ILE 39 0.688 0.616 -5.424 317 H ARG 40 H ARG 40 4.276 -1.404 -9.940 318 HA ARG 40 HA ARG 40 2.670 0.322 -11.510 319 HB2 ARG 40 2HB ARG 40 5.136 0.352 -11.558 320 HB3 ARG 40 3HB ARG 40 5.134 -1.240 -12.305 321 HG2 ARG 40 2HG ARG 40 3.998 -0.338 -14.260 322 HG3 ARG 40 3HG ARG 40 3.959 1.258 -13.508 323 HD2 ARG 40 2HD ARG 40 5.984 1.691 -14.306 324 HD3 ARG 40 3HD ARG 40 6.633 0.309 -13.424 325 HE ARG 40 HE ARG 40 5.477 -0.735 -15.689 326 HH11 ARG 40 1HH1 ARG 40 7.983 1.573 -14.974 327 HH12 ARG 40 2HH1 ARG 40 8.884 1.238 -16.416 328 HH21 ARG 40 1HH2 ARG 40 6.654 -1.185 -17.591 329 HH22 ARG 40 2HH2 ARG 40 8.126 -0.330 -17.904 330 H MET 41 H MET 41 3.693 -3.055 -12.021 331 HA MET 41 HA MET 41 2.368 -3.555 -14.390 332 HB2 MET 41 2HB MET 41 3.907 -5.164 -13.462 333 HB3 MET 41 3HB MET 41 2.878 -5.405 -12.057 334 HG2 MET 41 2HG MET 41 1.369 -5.923 -14.422 335 HG3 MET 41 3HG MET 41 2.881 -6.826 -14.483 336 HE1 MET 41 3HE MET 41 0.782 -9.732 -13.329 337 HE2 MET 41 1HE MET 41 1.206 -8.747 -14.729 338 HE3 MET 41 2HE MET 41 2.477 -9.452 -13.730 339 H ALA 42 H ALA 42 1.123 -3.794 -11.080 340 HA ALA 42 HA ALA 42 -1.433 -4.779 -11.783 341 HB1 ALA 42 1HB ALA 42 -0.192 -3.622 -9.356 342 HB2 ALA 42 2HB ALA 42 -1.953 -3.610 -9.447 343 HB3 ALA 42 3HB ALA 42 -1.075 -5.134 -9.571 344 H ASN 43 H ASN 43 -0.244 -1.498 -11.118 345 HA ASN 43 HA ASN 43 -2.632 -0.110 -11.302 346 HB2 ASN 43 2HB ASN 43 0.226 0.551 -11.632 347 HB3 ASN 43 3HB ASN 43 -0.893 1.663 -12.415 348 HD21 ASN 43 1HD2 ASN 43 -0.650 3.375 -11.085 349 HD22 ASN 43 2HD2 ASN 43 -1.079 3.371 -9.412 350 H VAL 44 H VAL 44 -0.611 -1.421 -13.836 351 HA VAL 44 HA VAL 44 -1.904 -0.036 -15.981 352 HB VAL 44 HB VAL 44 -0.287 -2.580 -16.151 353 HG11 VAL 44 1HG1 VAL 44 -1.202 -2.360 -18.238 354 HG12 VAL 44 2HG1 VAL 44 -1.316 -0.603 -18.124 355 HG13 VAL 44 3HG1 VAL 44 0.244 -1.368 -18.428 356 HG21 VAL 44 3HG2 VAL 44 0.519 0.097 -15.433 357 HG22 VAL 44 1HG2 VAL 44 1.463 -1.393 -15.460 358 HG23 VAL 44 2HG2 VAL 44 1.304 -0.423 -16.925 359 H SER 45 H SER 45 -1.850 -3.513 -15.170 360 HA SER 45 HA SER 45 -3.918 -4.293 -16.842 361 HB2 SER 45 2HB SER 45 -4.136 -5.967 -14.617 362 HB3 SER 45 3HB SER 45 -3.133 -6.239 -16.042 363 HG SER 45 HG SER 45 -2.411 -5.523 -13.496 364 H THR 46 H THR 46 -4.034 -2.697 -13.763 365 HA THR 46 HA THR 46 -6.979 -2.808 -13.848 366 HB THR 46 HB THR 46 -7.095 -2.760 -11.470 367 HG1 THR 46 HG1 THR 46 -5.219 -2.549 -10.190 368 HG21 THR 46 3HG2 THR 46 -6.355 -4.933 -12.708 369 HG22 THR 46 1HG2 THR 46 -6.319 -4.879 -10.947 370 HG23 THR 46 2HG2 THR 46 -4.828 -4.672 -11.865 371 H GLY 47 H GLY 47 -5.671 -0.866 -15.277 372 HA2 GLY 47 2HA GLY 47 -6.838 1.494 -14.336 373 HA3 GLY 47 3HA GLY 47 -5.146 1.519 -13.862 374 H ARG 48 H ARG 48 -3.731 0.633 -15.867 375 HA ARG 48 HA ARG 48 -2.856 1.139 -17.905 376 HB2 ARG 48 2HB ARG 48 -5.193 0.203 -18.551 377 HB3 ARG 48 3HB ARG 48 -5.594 1.882 -18.886 378 HG2 ARG 48 2HG ARG 48 -3.426 1.827 -20.324 379 HG3 ARG 48 3HG ARG 48 -3.670 0.080 -20.278 380 HD2 ARG 48 2HD ARG 48 -6.179 1.098 -20.863 381 HD3 ARG 48 3HD ARG 48 -5.078 2.118 -21.790 382 HE ARG 48 HE ARG 48 -4.209 -0.387 -22.331 383 HH11 ARG 48 1HH1 ARG 48 -7.326 1.155 -22.490 384 HH12 ARG 48 2HH1 ARG 48 -7.891 0.173 -23.800 385 HH21 ARG 48 1HH2 ARG 48 -4.941 -1.687 -24.057 386 HH22 ARG 48 2HH2 ARG 48 -6.533 -1.444 -24.691 387 H GLU 49 H GLU 49 -2.609 3.112 -16.082 388 HA GLU 49 HA GLU 49 -2.293 5.421 -17.704 389 HB2 GLU 49 2HB GLU 49 -4.723 5.196 -16.067 390 HB3 GLU 49 3HB GLU 49 -3.814 6.678 -15.804 391 HG2 GLU 49 2HG GLU 49 -3.820 6.659 -18.472 392 HG3 GLU 49 3HG GLU 49 -5.310 5.763 -18.179 393 HA PRO 50 HA PRO 50 0.713 6.392 -14.662 394 HB2 PRO 50 2HB PRO 50 0.716 9.107 -14.684 395 HB3 PRO 50 3HB PRO 50 1.373 8.134 -16.006 396 HG2 PRO 50 2HG PRO 50 -1.290 9.483 -15.790 397 HG3 PRO 50 3HG PRO 50 -0.184 9.405 -17.174 398 HD2 PRO 50 2HD PRO 50 -2.366 7.816 -16.962 399 HD3 PRO 50 3HD PRO 50 -0.875 7.288 -17.768 400 H GLY 51 H GLY 51 -2.143 8.513 -14.323 401 HA2 GLY 51 2HA GLY 51 -1.714 8.777 -11.476 402 HA3 GLY 51 3HA GLY 51 -3.034 9.473 -12.404 403 H ASP 52 H ASP 52 -1.837 6.421 -11.061 404 HA ASP 52 HA ASP 52 -4.605 5.690 -10.449 405 HB2 ASP 52 2HB ASP 52 -3.105 4.480 -12.513 406 HB3 ASP 52 3HB ASP 52 -3.148 3.322 -11.186 407 H ILE 53 H ILE 53 -2.254 6.657 -8.920 408 HA ILE 53 HA ILE 53 -1.858 4.342 -7.142 409 HB ILE 53 HB ILE 53 -0.168 6.839 -7.271 410 HG12 ILE 53 2HG1 ILE 53 0.424 4.096 -8.403 411 HG13 ILE 53 3HG1 ILE 53 -0.046 5.496 -9.361 412 HG21 ILE 53 1HG2 ILE 53 -0.318 4.600 -5.453 413 HG22 ILE 53 2HG2 ILE 53 1.281 4.730 -6.184 414 HG23 ILE 53 3HG2 ILE 53 0.595 6.103 -5.315 415 HD11 ILE 53 3HD1 ILE 53 2.129 6.323 -7.806 416 HD12 ILE 53 1HD1 ILE 53 2.542 4.723 -8.422 417 HD13 ILE 53 2HD1 ILE 53 2.094 6.011 -9.541 418 HA PRO 54 HA PRO 54 -4.642 7.201 -4.819 419 HB2 PRO 54 2HB PRO 54 -6.101 5.208 -3.691 420 HB3 PRO 54 3HB PRO 54 -6.453 5.869 -5.292 421 HG2 PRO 54 2HG PRO 54 -4.975 3.372 -4.556 422 HG3 PRO 54 3HG PRO 54 -6.182 3.623 -5.830 423 HD2 PRO 54 2HD PRO 54 -3.523 3.561 -6.335 424 HD3 PRO 54 3HD PRO 54 -4.650 4.564 -7.272 425 H GLU 55 H GLU 55 -3.828 7.977 -2.984 426 HA GLU 55 HA GLU 55 -2.184 6.309 -1.278 427 HB2 GLU 55 2HB GLU 55 -2.904 9.241 -1.138 428 HB3 GLU 55 3HB GLU 55 -1.817 8.435 -0.015 429 HG2 GLU 55 2HG GLU 55 -0.174 8.999 -1.388 430 HG3 GLU 55 3HG GLU 55 -0.797 7.775 -2.492 431 H THR 56 H THR 56 -4.480 5.135 -1.059 432 HA THR 56 HA THR 56 -5.415 5.858 1.614 433 HB THR 56 HB THR 56 -7.732 5.743 1.085 434 HG1 THR 56 HG1 THR 56 -8.493 5.078 -0.883 435 HG21 THR 56 3HG2 THR 56 -6.328 7.394 -1.019 436 HG22 THR 56 1HG2 THR 56 -6.727 7.910 0.618 437 HG23 THR 56 2HG2 THR 56 -8.015 7.577 -0.540 438 H LEU 57 H LEU 57 -5.914 4.132 2.881 439 HA LEU 57 HA LEU 57 -5.004 1.571 2.098 440 HB2 LEU 57 2HB LEU 57 -6.109 2.823 4.491 441 HB3 LEU 57 3HB LEU 57 -6.561 1.129 4.317 442 HG LEU 57 HG LEU 57 -3.718 2.135 4.286 443 HD11 LEU 57 1HD1 LEU 57 -3.765 2.239 6.497 444 HD12 LEU 57 2HD1 LEU 57 -4.331 0.571 6.579 445 HD13 LEU 57 3HD1 LEU 57 -5.494 1.893 6.477 446 HD21 LEU 57 3HD2 LEU 57 -4.979 -0.593 4.300 447 HD22 LEU 57 1HD2 LEU 57 -3.311 -0.319 4.804 448 HD23 LEU 57 2HD2 LEU 57 -3.811 0.074 3.158 449 H ASP 58 H ASP 58 -8.144 3.093 2.127 450 HA ASP 58 HA ASP 58 -9.714 0.752 1.883 451 HB2 ASP 58 2HB ASP 58 -10.283 3.593 1.013 452 HB3 ASP 58 3HB ASP 58 -11.479 2.301 1.056 453 H GLN 59 H GLN 59 -8.557 3.073 -0.559 454 HA GLN 59 HA GLN 59 -9.588 1.685 -2.783 455 HB2 GLN 59 2HB GLN 59 -8.712 4.106 -2.624 456 HB3 GLN 59 3HB GLN 59 -7.122 3.403 -2.890 457 HG2 GLN 59 2HG GLN 59 -8.160 4.252 -4.950 458 HG3 GLN 59 3HG GLN 59 -7.805 2.526 -5.018 459 HE21 GLN 59 1HE2 GLN 59 -9.335 2.394 -6.731 460 HE22 GLN 59 2HE2 GLN 59 -11.028 2.339 -6.392 461 H LEU 60 H LEU 60 -6.242 1.848 -1.553 462 HA LEU 60 HA LEU 60 -5.073 0.047 -3.286 463 HB2 LEU 60 2HB LEU 60 -4.063 1.506 -1.397 464 HB3 LEU 60 3HB LEU 60 -4.331 0.087 -0.387 465 HG LEU 60 HG LEU 60 -2.951 -0.708 -2.760 466 HD11 LEU 60 1HD1 LEU 60 -1.670 1.569 -1.256 467 HD12 LEU 60 2HD1 LEU 60 -2.208 1.600 -2.934 468 HD13 LEU 60 3HD1 LEU 60 -0.874 0.550 -2.455 469 HD21 LEU 60 3HD2 LEU 60 -1.296 -1.481 -1.131 470 HD22 LEU 60 1HD2 LEU 60 -2.936 -1.901 -0.636 471 HD23 LEU 60 2HD2 LEU 60 -2.103 -0.549 0.131 472 H ARG 61 H ARG 61 -6.936 -0.580 -0.365 473 HA ARG 61 HA ARG 61 -6.391 -3.331 -0.143 474 HB2 ARG 61 2HB ARG 61 -7.388 -2.113 1.694 475 HB3 ARG 61 3HB ARG 61 -8.801 -1.727 0.721 476 HG2 ARG 61 2HG ARG 61 -8.406 -4.568 0.801 477 HG3 ARG 61 3HG ARG 61 -8.447 -3.905 2.436 478 HD2 ARG 61 2HD ARG 61 -10.489 -2.876 0.575 479 HD3 ARG 61 3HD ARG 61 -10.645 -4.574 1.023 480 HE ARG 61 HE ARG 61 -10.230 -3.078 3.351 481 HH11 ARG 61 1HH1 ARG 61 -12.637 -3.525 0.875 482 HH12 ARG 61 2HH1 ARG 61 -13.966 -3.131 1.914 483 HH21 ARG 61 1HH2 ARG 61 -11.972 -2.557 4.728 484 HH22 ARG 61 2HH2 ARG 61 -13.587 -2.580 4.105 485 H LEU 62 H LEU 62 -9.086 -1.616 -1.710 486 HA LEU 62 HA LEU 62 -10.374 -3.941 -2.668 487 HB2 LEU 62 2HB LEU 62 -11.483 -1.764 -2.441 488 HB3 LEU 62 3HB LEU 62 -10.476 -1.123 -3.737 489 HG LEU 62 HG LEU 62 -11.533 -2.806 -5.267 490 HD11 LEU 62 1HD1 LEU 62 -13.740 -3.699 -4.491 491 HD12 LEU 62 2HD1 LEU 62 -13.279 -3.237 -2.854 492 HD13 LEU 62 3HD1 LEU 62 -12.330 -4.437 -3.731 493 HD21 LEU 62 3HD2 LEU 62 -13.843 -1.566 -5.127 494 HD22 LEU 62 1HD2 LEU 62 -12.381 -0.704 -5.609 495 HD23 LEU 62 2HD2 LEU 62 -12.987 -0.558 -3.959 496 H VAL 63 H VAL 63 -7.637 -2.165 -3.767 497 HA VAL 63 HA VAL 63 -7.711 -2.935 -6.503 498 HB VAL 63 HB VAL 63 -5.349 -2.111 -4.808 499 HG11 VAL 63 1HG1 VAL 63 -4.926 -1.420 -7.483 500 HG12 VAL 63 2HG1 VAL 63 -4.097 -2.673 -6.557 501 HG13 VAL 63 3HG1 VAL 63 -5.523 -3.079 -7.513 502 HG21 VAL 63 3HG2 VAL 63 -7.541 -0.608 -5.512 503 HG22 VAL 63 1HG2 VAL 63 -5.951 0.024 -5.083 504 HG23 VAL 63 2HG2 VAL 63 -6.375 -0.222 -6.777 505 H ILE 64 H ILE 64 -5.562 -4.044 -3.876 506 HA ILE 64 HA ILE 64 -4.426 -6.185 -5.223 507 HB ILE 64 HB ILE 64 -3.510 -5.434 -3.123 508 HG12 ILE 64 2HG1 ILE 64 -4.553 -8.252 -2.778 509 HG13 ILE 64 3HG1 ILE 64 -3.195 -7.817 -3.811 510 HG21 ILE 64 1HG2 ILE 64 -5.678 -4.831 -2.081 511 HG22 ILE 64 2HG2 ILE 64 -5.972 -6.544 -1.785 512 HG23 ILE 64 3HG2 ILE 64 -4.612 -5.735 -1.005 513 HD11 ILE 64 3HD1 ILE 64 -2.722 -6.732 -1.237 514 HD12 ILE 64 1HD1 ILE 64 -3.194 -8.421 -1.050 515 HD13 ILE 64 2HD1 ILE 64 -1.832 -7.995 -2.086 516 H CYS 65 H CYS 65 -7.420 -6.038 -3.358 517 HA CYS 65 HA CYS 65 -7.974 -8.813 -3.426 518 HB2 CYS 65 2HB CYS 65 -9.358 -6.366 -2.603 519 HB3 CYS 65 3HB CYS 65 -10.441 -7.598 -3.240 520 HG CYS 65 HG CYS 65 -8.218 -8.761 -1.024 521 H ASP 66 H ASP 66 -9.301 -6.116 -5.342 522 HA ASP 66 HA ASP 66 -10.897 -7.622 -7.051 523 HB2 ASP 66 2HB ASP 66 -10.850 -5.105 -6.829 524 HB3 ASP 66 3HB ASP 66 -9.411 -5.115 -7.845 525 H LEU 67 H LEU 67 -7.504 -6.646 -7.423 526 HA LEU 67 HA LEU 67 -7.135 -7.826 -9.964 527 HB2 LEU 67 2HB LEU 67 -5.622 -6.138 -9.191 528 HB3 LEU 67 3HB LEU 67 -5.186 -7.106 -7.784 529 HG LEU 67 HG LEU 67 -4.631 -8.361 -10.389 530 HD11 LEU 67 1HD1 LEU 67 -2.398 -6.795 -10.084 531 HD12 LEU 67 2HD1 LEU 67 -3.717 -5.661 -9.791 532 HD13 LEU 67 3HD1 LEU 67 -3.657 -6.573 -11.299 533 HD21 LEU 67 3HD2 LEU 67 -3.159 -7.994 -7.788 534 HD22 LEU 67 1HD2 LEU 67 -2.476 -8.820 -9.189 535 HD23 LEU 67 2HD2 LEU 67 -3.920 -9.462 -8.405 536 H GLN 68 H GLN 68 -6.047 -8.935 -6.750 537 HA GLN 68 HA GLN 68 -5.062 -11.408 -7.513 538 HB2 GLN 68 2HB GLN 68 -4.705 -10.482 -5.286 539 HB3 GLN 68 3HB GLN 68 -6.418 -10.644 -4.922 540 HG2 GLN 68 2HG GLN 68 -6.256 -13.046 -5.021 541 HG3 GLN 68 3HG GLN 68 -4.569 -12.941 -5.522 542 HE21 GLN 68 1HE2 GLN 68 -3.795 -14.091 -3.786 543 HE22 GLN 68 2HE2 GLN 68 -3.786 -13.469 -2.175 544 H GLU 69 H GLU 69 -8.350 -10.362 -7.106 545 HA GLU 69 HA GLU 69 -9.541 -12.932 -6.900 546 HB2 GLU 69 2HB GLU 69 -10.705 -10.887 -6.207 547 HB3 GLU 69 3HB GLU 69 -10.722 -10.324 -7.872 548 HG2 GLU 69 2HG GLU 69 -12.685 -11.304 -8.119 549 HG3 GLU 69 3HG GLU 69 -11.879 -12.862 -7.941 550 H ARG 70 H ARG 70 -9.378 -10.652 -9.642 551 HA ARG 70 HA ARG 70 -10.408 -12.460 -11.542 552 HB2 ARG 70 2HB ARG 70 -9.266 -9.784 -11.534 553 HB3 ARG 70 3HB ARG 70 -8.793 -10.696 -12.962 554 HG2 ARG 70 2HG ARG 70 -11.419 -11.247 -12.924 555 HG3 ARG 70 3HG ARG 70 -11.429 -9.655 -12.163 556 HD2 ARG 70 2HD ARG 70 -10.121 -8.778 -14.066 557 HD3 ARG 70 3HD ARG 70 -10.218 -10.363 -14.832 558 HE ARG 70 HE ARG 70 -12.815 -9.667 -14.335 559 HH11 ARG 70 1HH1 ARG 70 -10.153 -8.236 -16.063 560 HH12 ARG 70 2HH1 ARG 70 -11.164 -7.435 -17.219 561 HH21 ARG 70 1HH2 ARG 70 -14.157 -8.616 -15.852 562 HH22 ARG 70 2HH2 ARG 70 -13.441 -7.651 -17.097 563 H ARG 71 H ARG 71 -7.070 -11.523 -10.759 564 HA ARG 71 HA ARG 71 -5.756 -13.041 -12.683 565 HB2 ARG 71 2HB ARG 71 -4.805 -12.456 -9.873 566 HB3 ARG 71 3HB ARG 71 -3.794 -12.902 -11.240 567 HG2 ARG 71 2HG ARG 71 -5.488 -10.547 -11.677 568 HG3 ARG 71 3HG ARG 71 -4.253 -10.364 -10.429 569 HD2 ARG 71 2HD ARG 71 -2.546 -10.482 -11.912 570 HD3 ARG 71 3HD ARG 71 -3.385 -11.635 -12.947 571 HE ARG 71 HE ARG 71 -3.424 -8.762 -13.155 572 HH11 ARG 71 1HH1 ARG 71 -5.054 -11.733 -13.954 573 HH12 ARG 71 2HH1 ARG 71 -5.890 -11.060 -15.315 574 HH21 ARG 71 1HH2 ARG 71 -4.519 -7.865 -14.944 575 HH22 ARG 71 2HH2 ARG 71 -5.584 -8.861 -15.878 576 H GLU 72 H GLU 72 -6.732 -13.942 -9.390 577 HA GLU 72 HA GLU 72 -5.631 -16.513 -9.364 578 HB2 GLU 72 2HB GLU 72 -6.450 -15.424 -7.341 579 HB3 GLU 72 3HB GLU 72 -8.096 -15.473 -7.956 580 HG2 GLU 72 2HG GLU 72 -8.400 -17.498 -7.128 581 HG3 GLU 72 3HG GLU 72 -6.983 -18.108 -7.982 582 H LYS 73 H LYS 73 -8.865 -15.414 -10.330 583 HA LYS 73 HA LYS 73 -10.030 -17.870 -10.869 584 HB2 LYS 73 2HB LYS 73 -10.509 -15.085 -11.618 585 HB3 LYS 73 3HB LYS 73 -11.045 -16.225 -12.846 586 HG2 LYS 73 2HG LYS 73 -12.555 -17.262 -11.384 587 HG3 LYS 73 3HG LYS 73 -11.807 -16.533 -9.961 588 HD2 LYS 73 2HD LYS 73 -13.176 -14.787 -10.098 589 HD3 LYS 73 3HD LYS 73 -12.645 -14.465 -11.750 590 HE2 LYS 73 2HE LYS 73 -14.638 -16.626 -11.182 591 HE3 LYS 73 3HE LYS 73 -15.151 -14.943 -11.290 592 HZ1 LYS 73 3HZ LYS 73 -15.021 -15.009 -13.490 593 HZ2 LYS 73 1HZ LYS 73 -14.806 -16.683 -13.379 594 HZ3 LYS 73 2HZ LYS 73 -13.461 -15.663 -13.465 595 H PHE 74 H PHE 74 -8.002 -15.854 -12.957 596 HA PHE 74 HA PHE 74 -8.207 -17.574 -15.222 597 HB2 PHE 74 2HB PHE 74 -6.614 -15.173 -14.488 598 HB3 PHE 74 3HB PHE 74 -5.976 -16.198 -15.770 599 HD1 PHE 74 HD1 PHE 74 -8.033 -16.994 -17.425 600 HD2 PHE 74 HD2 PHE 74 -7.759 -13.349 -15.244 601 HE1 PHE 74 HE1 PHE 74 -9.546 -15.918 -19.039 602 HE2 PHE 74 HE2 PHE 74 -9.272 -12.268 -16.854 603 HZ PHE 74 HZ PHE 74 -10.168 -13.552 -18.754 604 H GLY 75 H GLY 75 -6.194 -17.477 -12.401 605 HA2 GLY 75 2HA GLY 75 -5.275 -19.924 -12.195 606 HA3 GLY 75 3HA GLY 75 -4.304 -19.393 -13.560 607 H SER 76 H SER 76 -3.018 -20.249 -11.346 608 HA SER 76 HA SER 76 -2.190 -17.807 -9.931 609 HB2 SER 76 2HB SER 76 -1.396 -19.194 -8.158 610 HB3 SER 76 3HB SER 76 -2.984 -19.820 -8.601 611 HG SER 76 HG SER 76 -0.674 -21.113 -8.559 612 H SER 77 H SER 77 -0.302 -16.918 -10.416 613 HA SER 77 HA SER 77 1.820 -18.603 -11.555 614 HB2 SER 77 2HB SER 77 2.000 -17.400 -13.460 615 HB3 SER 77 3HB SER 77 0.361 -16.861 -13.095 616 HG SER 77 HG SER 77 1.839 -15.125 -13.490 617 H LYS 78 H LYS 78 3.925 -17.983 -11.072 618 HA LYS 78 HA LYS 78 4.421 -16.873 -8.592 619 HB2 LYS 78 2HB LYS 78 6.027 -18.263 -9.858 620 HB3 LYS 78 3HB LYS 78 6.302 -16.920 -10.960 621 HG2 LYS 78 2HG LYS 78 7.458 -15.689 -9.381 622 HG3 LYS 78 3HG LYS 78 6.753 -16.574 -8.026 623 HD2 LYS 78 2HD LYS 78 8.327 -18.174 -8.105 624 HD3 LYS 78 3HD LYS 78 8.301 -18.243 -9.868 625 HE2 LYS 78 2HE LYS 78 9.522 -15.949 -9.699 626 HE3 LYS 78 3HE LYS 78 9.896 -16.475 -8.059 627 HZ1 LYS 78 3HZ LYS 78 10.551 -17.984 -10.532 628 HZ2 LYS 78 1HZ LYS 78 10.942 -18.448 -8.952 629 HZ3 LYS 78 2HZ LYS 78 11.647 -17.067 -9.627 630 H GLU 79 H GLU 79 4.240 -15.303 -11.731 631 HA GLU 79 HA GLU 79 5.313 -12.811 -10.997 632 HB2 GLU 79 2HB GLU 79 3.428 -13.694 -13.164 633 HB3 GLU 79 3HB GLU 79 3.818 -11.993 -12.950 634 HG2 GLU 79 2HG GLU 79 5.694 -12.250 -14.083 635 HG3 GLU 79 3HG GLU 79 6.240 -13.484 -12.948 636 H ILE 80 H ILE 80 1.923 -13.887 -11.182 637 HA ILE 80 HA ILE 80 0.816 -11.488 -10.190 638 HB ILE 80 HB ILE 80 -0.402 -14.238 -9.952 639 HG12 ILE 80 2HG1 ILE 80 0.296 -13.888 -12.257 640 HG13 ILE 80 3HG1 ILE 80 -1.456 -13.760 -12.142 641 HG21 ILE 80 1HG2 ILE 80 -1.397 -12.212 -8.743 642 HG22 ILE 80 2HG2 ILE 80 -1.835 -11.634 -10.350 643 HG23 ILE 80 3HG2 ILE 80 -2.472 -13.169 -9.761 644 HD11 ILE 80 3HD1 ILE 80 -1.293 -11.838 -13.221 645 HD12 ILE 80 1HD1 ILE 80 -0.522 -11.166 -11.785 646 HD13 ILE 80 2HD1 ILE 80 0.465 -11.842 -13.081 647 H ASP 81 H ASP 81 1.347 -14.621 -8.568 648 HA ASP 81 HA ASP 81 0.524 -13.926 -6.027 649 HB2 ASP 81 2HB ASP 81 2.612 -15.858 -7.004 650 HB3 ASP 81 3HB ASP 81 2.289 -15.661 -5.283 651 H MET 82 H MET 82 3.485 -13.118 -7.681 652 HA MET 82 HA MET 82 4.929 -12.270 -5.375 653 HB2 MET 82 2HB MET 82 5.301 -12.180 -8.303 654 HB3 MET 82 3HB MET 82 6.102 -10.899 -7.403 655 HG2 MET 82 2HG MET 82 6.853 -12.979 -5.917 656 HG3 MET 82 3HG MET 82 6.634 -13.804 -7.458 657 HE1 MET 82 3HE MET 82 10.304 -13.691 -7.842 658 HE2 MET 82 1HE MET 82 9.844 -13.568 -6.144 659 HE3 MET 82 2HE MET 82 8.894 -14.566 -7.245 660 H ALA 83 H ALA 83 3.356 -10.436 -8.002 661 HA ALA 83 HA ALA 83 3.711 -7.886 -7.013 662 HB1 ALA 83 1HB ALA 83 1.988 -7.183 -8.460 663 HB2 ALA 83 2HB ALA 83 2.727 -8.581 -9.242 664 HB3 ALA 83 3HB ALA 83 1.188 -8.753 -8.399 665 H ILE 84 H ILE 84 1.452 -10.343 -5.994 666 HA ILE 84 HA ILE 84 -0.224 -8.599 -4.468 667 HB ILE 84 HB ILE 84 0.114 -11.594 -4.269 668 HG12 ILE 84 2HG1 ILE 84 -2.133 -10.104 -5.612 669 HG13 ILE 84 3HG1 ILE 84 -0.673 -10.555 -6.486 670 HG21 ILE 84 1HG2 ILE 84 -0.853 -10.678 -2.245 671 HG22 ILE 84 2HG2 ILE 84 -2.038 -9.780 -3.191 672 HG23 ILE 84 3HG2 ILE 84 -2.085 -11.542 -3.165 673 HD11 ILE 84 3HD1 ILE 84 -2.757 -12.090 -6.562 674 HD12 ILE 84 1HD1 ILE 84 -1.152 -12.801 -6.390 675 HD13 ILE 84 2HD1 ILE 84 -2.196 -12.627 -4.978 676 H VAL 85 H VAL 85 2.250 -11.003 -3.561 677 HA VAL 85 HA VAL 85 2.245 -10.591 -0.824 678 HB VAL 85 HB VAL 85 4.626 -11.249 -2.564 679 HG11 VAL 85 1HG1 VAL 85 4.204 -11.232 0.389 680 HG12 VAL 85 2HG1 VAL 85 5.272 -12.440 -0.328 681 HG13 VAL 85 3HG1 VAL 85 5.606 -10.722 -0.550 682 HG21 VAL 85 3HG2 VAL 85 3.776 -13.288 -2.822 683 HG22 VAL 85 1HG2 VAL 85 3.512 -13.449 -1.086 684 HG23 VAL 85 2HG2 VAL 85 2.277 -12.703 -2.100 685 H THR 86 H THR 86 3.773 -8.716 -3.362 686 HA THR 86 HA THR 86 5.378 -7.119 -1.624 687 HB THR 86 HB THR 86 5.492 -5.575 -3.657 688 HG1 THR 86 HG1 THR 86 3.988 -6.003 -5.087 689 HG21 THR 86 3HG2 THR 86 6.926 -7.753 -3.007 690 HG22 THR 86 1HG2 THR 86 7.250 -6.778 -4.441 691 HG23 THR 86 2HG2 THR 86 6.309 -8.264 -4.578 692 H LEU 87 H LEU 87 2.320 -6.536 -3.353 693 HA LEU 87 HA LEU 87 1.855 -3.935 -2.512 694 HB2 LEU 87 2HB LEU 87 0.020 -6.192 -3.232 695 HB3 LEU 87 3HB LEU 87 -0.617 -4.626 -2.733 696 HG LEU 87 HG LEU 87 1.148 -5.138 -5.127 697 HD11 LEU 87 1HD1 LEU 87 -1.427 -5.798 -4.980 698 HD12 LEU 87 2HD1 LEU 87 -0.698 -5.135 -6.442 699 HD13 LEU 87 3HD1 LEU 87 -1.609 -4.084 -5.357 700 HD21 LEU 87 3HD2 LEU 87 0.289 -2.689 -3.733 701 HD22 LEU 87 1HD2 LEU 87 0.103 -2.678 -5.487 702 HD23 LEU 87 2HD2 LEU 87 1.687 -2.979 -4.770 703 H LYS 88 H LYS 88 1.458 -6.943 -0.798 704 HA LYS 88 HA LYS 88 -0.104 -5.829 1.339 705 HB2 LYS 88 2HB LYS 88 0.658 -8.419 0.482 706 HB3 LYS 88 3HB LYS 88 1.260 -8.226 2.123 707 HG2 LYS 88 2HG LYS 88 -0.952 -7.694 2.919 708 HG3 LYS 88 3HG LYS 88 -1.587 -7.736 1.272 709 HD2 LYS 88 2HD LYS 88 -0.282 -10.094 2.621 710 HD3 LYS 88 3HD LYS 88 -2.022 -9.800 2.635 711 HE2 LYS 88 2HE LYS 88 -1.721 -9.641 0.046 712 HE3 LYS 88 3HE LYS 88 -0.235 -10.537 0.356 713 HZ1 LYS 88 3HZ LYS 88 -2.311 -11.874 -0.152 714 HZ2 LYS 88 1HZ LYS 88 -2.848 -11.452 1.395 715 HZ3 LYS 88 2HZ LYS 88 -1.421 -12.341 1.209 716 H VAL 89 H VAL 89 3.143 -7.309 1.393 717 HA VAL 89 HA VAL 89 3.952 -6.366 3.853 718 HB VAL 89 HB VAL 89 6.235 -6.729 3.161 719 HG11 VAL 89 1HG1 VAL 89 5.439 -8.939 1.617 720 HG12 VAL 89 2HG1 VAL 89 5.758 -8.889 3.352 721 HG13 VAL 89 3HG1 VAL 89 4.123 -8.619 2.746 722 HG21 VAL 89 3HG2 VAL 89 6.651 -7.337 0.719 723 HG22 VAL 89 1HG2 VAL 89 5.100 -6.568 0.385 724 HG23 VAL 89 2HG2 VAL 89 6.415 -5.629 1.092 725 H PHE 90 H PHE 90 3.822 -4.688 0.796 726 HA PHE 90 HA PHE 90 5.408 -2.455 1.671 727 HB2 PHE 90 2HB PHE 90 5.419 -2.927 -0.673 728 HB3 PHE 90 3HB PHE 90 3.660 -2.910 -0.748 729 HD1 PHE 90 HD1 PHE 90 6.031 -0.505 0.814 730 HD2 PHE 90 HD2 PHE 90 3.090 -1.195 -2.185 731 HE1 PHE 90 HE1 PHE 90 6.086 1.881 0.216 732 HE2 PHE 90 HE2 PHE 90 3.140 1.190 -2.787 733 HZ PHE 90 HZ PHE 90 4.640 2.731 -1.587 734 H ALA 91 H ALA 91 1.960 -3.124 1.243 735 HA ALA 91 HA ALA 91 1.054 -0.528 1.918 736 HB1 ALA 91 1HB ALA 91 -0.384 -3.174 2.081 737 HB2 ALA 91 2HB ALA 91 -1.145 -1.586 2.187 738 HB3 ALA 91 3HB ALA 91 -0.350 -2.085 0.694 739 H VAL 92 H VAL 92 1.684 -3.434 3.813 740 HA VAL 92 HA VAL 92 0.638 -2.325 6.250 741 HB VAL 92 HB VAL 92 2.422 -4.736 5.887 742 HG11 VAL 92 1HG1 VAL 92 2.535 -4.434 8.134 743 HG12 VAL 92 2HG1 VAL 92 1.023 -3.526 8.200 744 HG13 VAL 92 3HG1 VAL 92 0.991 -5.285 8.070 745 HG21 VAL 92 3HG2 VAL 92 0.678 -5.737 4.940 746 HG22 VAL 92 1HG2 VAL 92 -0.213 -5.519 6.446 747 HG23 VAL 92 2HG2 VAL 92 -0.325 -4.305 5.172 748 H ALA 93 H ALA 93 3.930 -3.367 5.341 749 HA ALA 93 HA ALA 93 5.210 -2.070 7.483 750 HB1 ALA 93 1HB ALA 93 7.133 -2.907 6.635 751 HB2 ALA 93 2HB ALA 93 6.010 -3.883 5.686 752 HB3 ALA 93 3HB ALA 93 6.738 -2.440 4.980 753 H GLY 94 H GLY 94 3.869 -0.833 4.606 754 HA2 GLY 94 2HA GLY 94 5.552 1.567 4.662 755 HA3 GLY 94 3HA GLY 94 4.410 1.137 3.398 756 H LEU 95 H LEU 95 2.069 1.143 4.089 757 HA LEU 95 HA LEU 95 1.367 3.685 5.021 758 HB2 LEU 95 2HB LEU 95 -0.460 1.305 5.118 759 HB3 LEU 95 3HB LEU 95 -0.880 2.996 4.854 760 HG LEU 95 HG LEU 95 0.520 1.161 2.911 761 HD11 LEU 95 1HD1 LEU 95 -2.221 2.415 2.916 762 HD12 LEU 95 2HD1 LEU 95 -1.840 0.701 3.071 763 HD13 LEU 95 3HD1 LEU 95 -1.510 1.543 1.557 764 HD21 LEU 95 3HD2 LEU 95 1.380 3.010 2.018 765 HD22 LEU 95 1HD2 LEU 95 0.453 4.048 3.102 766 HD23 LEU 95 2HD2 LEU 95 -0.269 3.476 1.598 767 H LEU 96 H LEU 96 1.337 0.541 6.662 768 HA LEU 96 HA LEU 96 0.512 1.770 9.161 769 HB2 LEU 96 2HB LEU 96 0.539 -0.884 8.034 770 HB3 LEU 96 3HB LEU 96 1.264 -0.878 9.641 771 HG LEU 96 HG LEU 96 -1.108 -1.436 9.732 772 HD11 LEU 96 1HD1 LEU 96 -0.998 -0.491 11.734 773 HD12 LEU 96 2HD1 LEU 96 -1.555 1.020 11.015 774 HD13 LEU 96 3HD1 LEU 96 0.173 0.695 11.155 775 HD21 LEU 96 3HD2 LEU 96 -2.772 0.348 9.209 776 HD22 LEU 96 1HD2 LEU 96 -1.946 -0.310 7.796 777 HD23 LEU 96 2HD2 LEU 96 -1.474 1.263 8.440 778 H ASN 97 H ASN 97 3.355 1.532 7.553 779 HA ASN 97 HA ASN 97 5.562 1.617 8.117 780 HB2 ASN 97 2HB ASN 97 4.299 3.547 9.502 781 HB3 ASN 97 3HB ASN 97 4.958 2.618 10.846 782 HD21 ASN 97 1HD2 ASN 97 5.537 5.138 8.866 783 HD22 ASN 97 2HD2 ASN 97 7.263 5.184 8.933 784 H MET 98 H MET 98 4.099 -0.827 8.785 785 HA MET 98 HA MET 98 4.816 -1.854 11.290 786 HB2 MET 98 2HB MET 98 3.517 -2.799 8.983 787 HB3 MET 98 3HB MET 98 4.853 -3.907 9.263 788 HG2 MET 98 2HG MET 98 2.891 -4.727 10.368 789 HG3 MET 98 3HG MET 98 4.073 -4.224 11.574 790 HE1 MET 98 3HE MET 98 1.821 -3.084 13.900 791 HE2 MET 98 1HE MET 98 3.429 -3.617 13.406 792 HE3 MET 98 2HE MET 98 3.081 -1.895 13.563 793 H THR 99 H THR 99 6.333 -3.819 11.493 794 HA THR 99 HA THR 99 8.869 -3.241 10.106 795 HB THR 99 HB THR 99 8.784 -4.258 12.934 796 HG1 THR 99 HG1 THR 99 8.298 -2.322 13.620 797 HG21 THR 99 3HG2 THR 99 11.005 -4.188 12.763 798 HG22 THR 99 1HG2 THR 99 10.954 -2.503 12.249 799 HG23 THR 99 2HG2 THR 99 10.822 -3.793 11.054 800 H VAL 100 H VAL 100 7.221 -5.103 9.041 801 HA VAL 100 HA VAL 100 7.852 -7.732 10.068 802 HB VAL 100 HB VAL 100 6.622 -8.545 8.055 803 HG11 VAL 100 1HG1 VAL 100 5.246 -6.518 9.811 804 HG12 VAL 100 2HG1 VAL 100 4.405 -7.677 8.780 805 HG13 VAL 100 3HG1 VAL 100 5.416 -8.248 10.108 806 HG21 VAL 100 3HG2 VAL 100 5.353 -6.103 7.318 807 HG22 VAL 100 1HG2 VAL 100 7.099 -5.905 7.159 808 HG23 VAL 100 2HG2 VAL 100 6.278 -7.215 6.310 809 H SER 101 H SER 101 9.318 -9.154 9.278 810 HA SER 101 HA SER 101 11.047 -8.199 7.090 811 HB2 SER 101 2HB SER 101 11.672 -9.684 9.625 812 HB3 SER 101 3HB SER 101 12.737 -9.827 8.226 813 HG SER 101 HG SER 101 11.958 -7.268 9.030 814 H THR 102 H THR 102 8.569 -10.068 7.330 815 HA THR 102 HA THR 102 9.580 -12.013 5.412 816 HB THR 102 HB THR 102 8.649 -13.937 6.516 817 HG1 THR 102 HG1 THR 102 7.519 -13.784 8.420 818 HG21 THR 102 3HG2 THR 102 10.224 -12.400 8.580 819 HG22 THR 102 1HG2 THR 102 10.943 -13.175 7.170 820 HG23 THR 102 2HG2 THR 102 10.128 -14.150 8.393 821 H ALA 103 H ALA 103 8.149 -12.432 3.829 822 HA ALA 103 HA ALA 103 5.909 -10.882 3.398 823 HB1 ALA 103 1HB ALA 103 5.245 -12.787 1.790 824 HB2 ALA 103 2HB ALA 103 6.763 -11.933 1.512 825 HB3 ALA 103 3HB ALA 103 6.773 -13.521 2.278 826 H ALA 104 H ALA 104 6.197 -13.897 5.146 827 HA ALA 104 HA ALA 104 3.419 -14.487 5.277 828 HB1 ALA 104 1HB ALA 104 4.035 -16.089 7.006 829 HB2 ALA 104 2HB ALA 104 5.136 -16.193 5.631 830 HB3 ALA 104 3HB ALA 104 5.645 -15.375 7.108 831 H ALA 105 H ALA 105 5.648 -12.715 7.365 832 HA ALA 105 HA ALA 105 3.887 -12.344 9.536 833 HB1 ALA 105 1HB ALA 105 6.300 -12.014 9.722 834 HB2 ALA 105 2HB ALA 105 6.194 -10.611 8.658 835 HB3 ALA 105 3HB ALA 105 5.416 -10.578 10.240 836 H ALA 106 H ALA 106 4.494 -10.453 6.615 837 HA ALA 106 HA ALA 106 2.922 -8.216 7.316 838 HB1 ALA 106 1HB ALA 106 2.803 -8.255 4.596 839 HB2 ALA 106 2HB ALA 106 4.134 -7.584 5.539 840 HB3 ALA 106 3HB ALA 106 4.242 -9.226 4.905 841 H GLU 107 H GLU 107 2.171 -10.967 5.168 842 HA GLU 107 HA GLU 107 -0.486 -10.300 4.663 843 HB2 GLU 107 2HB GLU 107 -0.791 -12.633 4.012 844 HB3 GLU 107 3HB GLU 107 0.736 -12.011 3.402 845 HG2 GLU 107 2HG GLU 107 1.941 -13.143 5.167 846 HG3 GLU 107 3HG GLU 107 0.425 -13.705 5.871 847 H ASN 108 H ASN 108 0.977 -11.915 7.397 848 HA ASN 108 HA ASN 108 -1.398 -12.955 8.533 849 HB2 ASN 108 2HB ASN 108 1.372 -12.420 9.523 850 HB3 ASN 108 3HB ASN 108 0.106 -12.763 10.698 851 HD21 ASN 108 1HD2 ASN 108 2.514 -14.273 9.802 852 HD22 ASN 108 2HD2 ASN 108 1.920 -15.838 9.372 853 H MET 109 H MET 109 0.405 -9.947 9.085 854 HA MET 109 HA MET 109 -1.388 -8.971 11.075 855 HB2 MET 109 2HB MET 109 1.121 -8.242 10.105 856 HB3 MET 109 3HB MET 109 0.078 -6.896 9.667 857 HG2 MET 109 2HG MET 109 0.386 -8.039 12.434 858 HG3 MET 109 3HG MET 109 1.155 -6.571 11.835 859 HE1 MET 109 3HE MET 109 0.171 -4.700 11.025 860 HE2 MET 109 1HE MET 109 -1.536 -4.554 10.604 861 HE3 MET 109 2HE MET 109 -0.942 -3.885 12.124 862 H TYR 110 H TYR 110 -0.963 -8.328 7.612 863 HA TYR 110 HA TYR 110 -2.868 -6.317 7.328 864 HB2 TYR 110 2HB TYR 110 -1.166 -7.217 5.615 865 HB3 TYR 110 3HB TYR 110 -2.394 -8.413 5.219 866 HD1 TYR 110 HD1 TYR 110 -2.528 -4.742 5.930 867 HD2 TYR 110 HD2 TYR 110 -3.393 -7.895 3.207 868 HE1 TYR 110 HE1 TYR 110 -3.599 -3.130 4.413 869 HE2 TYR 110 HE2 TYR 110 -4.465 -6.291 1.681 870 HH TYR 110 HH TYR 110 -5.607 -3.977 1.951 871 H SER 111 H SER 111 -3.233 -9.810 7.421 872 HA SER 111 HA SER 111 -6.050 -9.688 6.765 873 HB2 SER 111 2HB SER 111 -6.013 -12.110 6.987 874 HB3 SER 111 3HB SER 111 -4.625 -11.591 6.031 875 HG SER 111 HG SER 111 -4.109 -13.151 7.669 876 H GLN 112 H GLN 112 -4.070 -10.479 9.605 877 HA GLN 112 HA GLN 112 -6.140 -11.079 11.373 878 HB2 GLN 112 2HB GLN 112 -3.830 -11.565 11.919 879 HB3 GLN 112 3HB GLN 112 -3.433 -9.852 11.915 880 HG2 GLN 112 2HG GLN 112 -4.774 -9.477 13.866 881 HG3 GLN 112 3HG GLN 112 -5.371 -11.135 13.824 882 HE21 GLN 112 1HE2 GLN 112 -4.559 -11.046 16.072 883 HE22 GLN 112 2HE2 GLN 112 -2.904 -11.454 16.352 884 H MET 113 H MET 113 -4.855 -8.001 10.316 885 HA MET 113 HA MET 113 -6.169 -6.438 12.315 886 HB2 MET 113 2HB MET 113 -4.160 -5.643 11.135 887 HB3 MET 113 3HB MET 113 -5.063 -5.609 9.626 888 HG2 MET 113 2HG MET 113 -5.627 -3.521 10.063 889 HG3 MET 113 3HG MET 113 -6.558 -4.097 11.443 890 HE1 MET 113 3HE MET 113 -5.582 -1.118 12.004 891 HE2 MET 113 1HE MET 113 -6.503 -2.314 12.916 892 HE3 MET 113 2HE MET 113 -5.110 -1.525 13.655 893 H GLY 114 H GLY 114 -7.050 -7.718 9.203 894 HA2 GLY 114 2HA GLY 114 -9.378 -8.016 8.673 895 HA3 GLY 114 3HA GLY 114 -9.723 -6.530 9.547 896 H LEU 115 H LEU 115 -6.984 -6.573 7.453 897 HA LEU 115 HA LEU 115 -8.383 -4.742 5.644 898 HB2 LEU 115 2HB LEU 115 -5.431 -5.302 5.874 899 HB3 LEU 115 3HB LEU 115 -6.188 -4.023 4.927 900 HG LEU 115 HG LEU 115 -6.532 -4.119 7.902 901 HD11 LEU 115 1HD1 LEU 115 -4.574 -2.720 8.169 902 HD12 LEU 115 2HD1 LEU 115 -4.228 -2.833 6.444 903 HD13 LEU 115 3HD1 LEU 115 -4.119 -4.270 7.460 904 HD21 LEU 115 3HD2 LEU 115 -6.299 -1.519 7.070 905 HD22 LEU 115 1HD2 LEU 115 -7.815 -2.383 7.321 906 HD23 LEU 115 2HD2 LEU 115 -7.113 -2.285 5.706 907 H ASP 116 H ASP 116 -6.845 -7.849 5.763 908 HA ASP 116 HA ASP 116 -6.888 -8.118 2.856 909 HB2 ASP 116 2HB ASP 116 -5.037 -8.978 4.545 910 HB3 ASP 116 3HB ASP 116 -6.113 -10.368 4.660 911 H THR 117 H THR 117 -7.637 -10.411 2.116 912 HA THR 117 HA THR 117 -9.859 -11.525 3.564 913 HB THR 117 HB THR 117 -10.593 -10.420 0.875 914 HG1 THR 117 HG1 THR 117 -10.487 -8.474 1.691 915 HG21 THR 117 3HG2 THR 117 -12.383 -10.742 3.254 916 HG22 THR 117 1HG2 THR 117 -11.926 -12.148 2.294 917 HG23 THR 117 2HG2 THR 117 -12.783 -10.805 1.538 918 H ARG 118 H ARG 118 -7.331 -12.387 2.356 919 HA ARG 118 HA ARG 118 -8.336 -14.728 1.012 920 HB2 ARG 118 2HB ARG 118 -8.139 -13.106 -0.847 921 HB3 ARG 118 3HB ARG 118 -6.438 -12.891 -0.457 922 HG2 ARG 118 2HG ARG 118 -6.043 -14.492 -1.946 923 HG3 ARG 118 3HG ARG 118 -6.674 -15.617 -0.742 924 HD2 ARG 118 2HD ARG 118 -8.449 -14.195 -2.707 925 HD3 ARG 118 3HD ARG 118 -7.677 -15.736 -3.078 926 HE ARG 118 HE ARG 118 -8.953 -16.121 -0.678 927 HH11 ARG 118 1HH1 ARG 118 -9.889 -15.160 -3.891 928 HH12 ARG 118 2HH1 ARG 118 -11.481 -15.831 -3.768 929 HH21 ARG 118 1HH2 ARG 118 -11.047 -17.008 -0.504 930 HH22 ARG 118 2HH2 ARG 118 -12.140 -16.880 -1.841 931 HA PRO 119 HA PRO 119 -4.543 -15.260 3.656 932 HB2 PRO 119 2HB PRO 119 -5.572 -17.282 5.147 933 HB3 PRO 119 3HB PRO 119 -5.800 -15.576 5.553 934 HG2 PRO 119 2HG PRO 119 -7.666 -17.458 4.160 935 HG3 PRO 119 3HG PRO 119 -8.018 -16.262 5.421 936 HD2 PRO 119 2HD PRO 119 -8.514 -15.804 2.799 937 HD3 PRO 119 3HD PRO 119 -8.055 -14.510 3.924 938 H SER 120 H SER 120 -3.342 -16.114 1.962 939 HA SER 120 HA SER 120 -3.734 -18.992 1.459 940 HB2 SER 120 2HB SER 120 -3.188 -16.744 -0.419 941 HB3 SER 120 3HB SER 120 -2.417 -18.294 -0.756 942 HG SER 120 HG SER 120 -4.312 -18.557 -1.719 943 H MET 121 H MET 121 -1.956 -20.305 1.523 944 HA MET 121 HA MET 121 0.515 -19.057 2.512 945 HB2 MET 121 2HB MET 121 -0.982 -21.154 3.544 946 HB3 MET 121 3HB MET 121 0.369 -21.956 2.755 947 HG2 MET 121 2HG MET 121 1.683 -21.468 4.458 948 HG3 MET 121 3HG MET 121 1.379 -19.748 4.224 949 HE1 MET 121 3HE MET 121 1.900 -21.314 7.212 950 HE2 MET 121 1HE MET 121 0.418 -22.045 7.828 951 HE3 MET 121 2HE MET 121 1.177 -22.685 6.370 952 H LYS 122 H LYS 122 2.534 -20.383 1.966 953 HA LYS 122 HA LYS 122 2.429 -21.614 -0.676 954 HB2 LYS 122 2HB LYS 122 4.161 -20.188 -1.594 955 HB3 LYS 122 3HB LYS 122 2.798 -19.202 -1.080 956 HG2 LYS 122 2HG LYS 122 4.404 -19.240 1.149 957 HG3 LYS 122 3HG LYS 122 5.562 -19.184 -0.181 958 HD2 LYS 122 2HD LYS 122 3.195 -17.342 -0.096 959 HD3 LYS 122 3HD LYS 122 4.686 -16.958 0.768 960 HE2 LYS 122 2HE LYS 122 5.510 -16.131 -1.122 961 HE3 LYS 122 3HE LYS 122 5.456 -17.752 -1.813 962 HZ1 LYS 122 3HZ LYS 122 4.226 -16.456 -3.278 963 HZ2 LYS 122 1HZ LYS 122 3.460 -15.588 -2.044 964 HZ3 LYS 122 2HZ LYS 122 3.037 -17.201 -2.332 965 H GLU 123 H GLU 123 4.260 -22.895 -1.177 966 HA GLU 123 HA GLU 123 6.395 -23.156 0.747 967 HB2 GLU 123 2HB GLU 123 4.709 -24.511 1.837 968 HB3 GLU 123 3HB GLU 123 4.395 -25.384 0.344 969 HG2 GLU 123 2HG GLU 123 6.360 -26.586 0.475 970 HG3 GLU 123 3HG GLU 123 7.131 -25.407 1.534 971 H ALA 124 H ALA 124 8.028 -23.056 -0.662 972 HA ALA 124 HA ALA 124 8.423 -25.206 -2.522 973 HB1 ALA 124 1HB ALA 124 8.767 -23.585 -4.468 974 HB2 ALA 124 2HB ALA 124 7.107 -23.986 -4.024 975 HB3 ALA 124 3HB ALA 124 7.806 -22.446 -3.525 976 H GLY 125 H GLY 125 10.483 -24.547 -3.959 977 HA2 GLY 125 2HA GLY 125 12.357 -22.805 -2.664 978 HA3 GLY 125 3HA GLY 125 12.675 -24.498 -2.315 979 H GLY 126 H GLY 126 13.077 -21.959 -4.540 980 HA2 GLY 126 2HA GLY 126 13.528 -23.536 -6.884 981 HA3 GLY 126 3HA GLY 126 13.969 -21.849 -6.663 982 H LYS 127 H LYS 127 15.310 -24.528 -7.586 983 HA LYS 127 HA LYS 127 17.686 -24.431 -5.883 984 HB2 LYS 127 2HB LYS 127 16.716 -26.355 -7.983 985 HB3 LYS 127 3HB LYS 127 18.374 -26.397 -7.400 986 HG2 LYS 127 2HG LYS 127 17.646 -26.873 -5.170 987 HG3 LYS 127 3HG LYS 127 15.957 -26.633 -5.623 988 HD2 LYS 127 2HD LYS 127 16.581 -28.522 -7.394 989 HD3 LYS 127 3HD LYS 127 17.766 -28.927 -6.149 990 HE2 LYS 127 2HE LYS 127 16.172 -29.992 -5.029 991 HE3 LYS 127 3HE LYS 127 15.329 -28.458 -4.820 992 HZ1 LYS 127 3HZ LYS 127 15.008 -29.947 -7.333 993 HZ2 LYS 127 1HZ LYS 127 13.937 -28.879 -6.575 994 HZ3 LYS 127 2HZ LYS 127 14.146 -30.442 -5.965 995 H GLU 128 H GLU 128 16.946 -22.292 -7.802 996 HA GLU 128 HA GLU 128 19.280 -22.447 -9.592 997 HB2 GLU 128 2HB GLU 128 16.632 -21.048 -9.874 998 HB3 GLU 128 3HB GLU 128 18.030 -20.552 -10.818 999 HG2 GLU 128 2HG GLU 128 18.165 -23.037 -11.497 1000 HG3 GLU 128 3HG GLU 128 16.501 -23.116 -10.921 1001 H GLU 129 H GLU 129 20.722 -21.704 -7.978 1002 HA GLU 129 HA GLU 129 20.786 -18.818 -7.757 1003 HB2 GLU 129 2HB GLU 129 19.462 -19.771 -5.769 1004 HB3 GLU 129 3HB GLU 129 21.002 -20.412 -5.214 1005 HG2 GLU 129 2HG GLU 129 21.909 -18.093 -5.273 1006 HG3 GLU 129 3HG GLU 129 20.280 -17.524 -5.635 1007 H GLY 130 H GLY 130 22.850 -17.995 -7.177 1008 HA2 GLY 130 2HA GLY 130 25.146 -18.039 -6.924 1009 HA3 GLY 130 3HA GLY 130 25.033 -19.758 -6.581 1010 HA PRO 131 HA PRO 131 25.213 -19.320 -11.404 1011 HB2 PRO 131 2HB PRO 131 25.866 -16.863 -12.358 1012 HB3 PRO 131 3HB PRO 131 24.196 -17.377 -12.090 1013 HG2 PRO 131 2HG PRO 131 25.960 -15.688 -10.359 1014 HG3 PRO 131 3HG PRO 131 24.249 -15.464 -10.769 1015 HD2 PRO 131 2HD PRO 131 25.055 -16.524 -8.411 1016 HD3 PRO 131 3HD PRO 131 23.543 -17.005 -9.207 1017 HA PRO 132 HA PRO 132 29.585 -19.695 -11.692 1018 HB2 PRO 132 2HB PRO 132 30.043 -19.366 -14.347 1019 HB3 PRO 132 3HB PRO 132 29.272 -20.809 -13.677 1020 HG2 PRO 132 2HG PRO 132 28.017 -18.419 -14.971 1021 HG3 PRO 132 3HG PRO 132 27.634 -20.137 -15.184 1022 HD2 PRO 132 2HD PRO 132 26.163 -18.501 -13.606 1023 HD3 PRO 132 3HD PRO 132 26.382 -20.227 -13.251 1024 H GLN 133 H GLN 133 30.311 -17.883 -10.535 1025 HA GLN 133 HA GLN 133 31.839 -16.019 -12.000 1026 HB2 GLN 133 2HB GLN 133 29.455 -15.124 -12.270 1027 HB3 GLN 133 3HB GLN 133 29.527 -14.736 -10.556 1028 HG2 GLN 133 2HG GLN 133 30.165 -12.748 -11.476 1029 HG3 GLN 133 3HG GLN 133 31.734 -13.513 -11.228 1030 HE21 GLN 133 1HE2 GLN 133 33.000 -13.949 -12.946 1031 HE22 GLN 133 2HE2 GLN 133 32.580 -13.590 -14.583 1032 H ALA 134 H ALA 134 33.535 -15.618 -10.753 1033 HA ALA 134 HA ALA 134 33.150 -15.285 -7.865 1034 HB1 ALA 134 1HB ALA 134 34.209 -17.159 -7.334 1035 HB2 ALA 134 2HB ALA 134 34.300 -17.576 -9.046 1036 HB3 ALA 134 3HB ALA 134 35.608 -16.668 -8.289 1037 H TYR 135 H TYR 135 35.623 -15.223 -10.436 1038 HA TYR 135 HA TYR 135 36.975 -13.021 -9.092 1039 HB2 TYR 135 2HB TYR 135 37.734 -15.096 -10.959 1040 HB3 TYR 135 3HB TYR 135 38.245 -13.516 -11.543 1041 HD1 TYR 135 HD1 TYR 135 38.524 -15.903 -8.736 1042 HD2 TYR 135 HD2 TYR 135 40.042 -12.347 -10.513 1043 HE1 TYR 135 HE1 TYR 135 40.453 -15.972 -7.212 1044 HE2 TYR 135 HE2 TYR 135 41.975 -12.407 -8.994 1045 HH TYR 135 HH TYR 135 42.918 -13.418 -7.252 Start of MODEL 12 1 H21 MYR 1 1H2 MYR 1 8.020 11.322 -6.036 2 H22 MYR 1 2H2 MYR 1 9.169 10.891 -4.785 3 H31 MYR 1 1H3 MYR 1 8.333 8.671 -4.586 4 H32 MYR 1 2H3 MYR 1 7.930 8.555 -6.300 5 H41 MYR 1 1H4 MYR 1 5.823 9.618 -6.042 6 H42 MYR 1 2H4 MYR 1 6.331 10.552 -4.632 7 H51 MYR 1 1H5 MYR 1 6.069 8.692 -3.126 8 H52 MYR 1 2H5 MYR 1 6.183 7.494 -4.416 9 H61 MYR 1 1H6 MYR 1 3.924 8.934 -5.241 10 H62 MYR 1 2H6 MYR 1 3.793 9.095 -3.488 11 H71 MYR 1 1H7 MYR 1 4.504 6.305 -4.219 12 H72 MYR 1 2H7 MYR 1 3.062 6.820 -5.096 13 H81 MYR 1 1H8 MYR 1 2.509 7.804 -2.522 14 H82 MYR 1 2H8 MYR 1 3.445 6.357 -2.139 15 H91 MYR 1 1H9 MYR 1 1.776 5.296 -4.072 16 H92 MYR 1 2H9 MYR 1 0.730 6.590 -3.488 17 H101 MYR 1 1H10 MYR 1 0.474 5.654 -1.359 18 H102 MYR 1 2H10 MYR 1 2.079 4.941 -1.319 19 H111 MYR 1 1H11 MYR 1 0.394 3.666 -3.423 20 H112 MYR 1 2H11 MYR 1 -0.432 3.673 -1.873 21 H121 MYR 1 1H12 MYR 1 2.465 2.792 -1.769 22 H122 MYR 1 2H12 MYR 1 1.369 1.712 -2.632 23 H131 MYR 1 1H13 MYR 1 -0.131 2.316 -0.316 24 H132 MYR 1 2H13 MYR 1 1.519 2.319 0.311 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 10.334 12.269 -6.688 29 HA2 GLY 2 2HA GLY 2 12.239 12.086 -8.017 30 HA3 GLY 2 3HA GLY 2 11.976 10.351 -8.111 31 H ASN 3 H ASN 3 10.609 9.509 -9.711 32 HA ASN 3 HA ASN 3 10.631 10.924 -12.161 33 HB2 ASN 3 2HB ASN 3 9.155 8.405 -11.364 34 HB3 ASN 3 3HB ASN 3 9.300 9.001 -13.016 35 HD21 ASN 3 1HD2 ASN 3 10.553 6.914 -10.815 36 HD22 ASN 3 2HD2 ASN 3 12.124 6.684 -11.495 37 H GLY 4 H GLY 4 8.236 10.510 -9.650 38 HA2 GLY 4 2HA GLY 4 6.739 12.730 -10.180 39 HA3 GLY 4 3HA GLY 4 6.041 11.498 -11.221 40 H ALA 5 H ALA 5 4.117 11.995 -9.877 41 HA ALA 5 HA ALA 5 4.165 10.429 -7.379 42 HB1 ALA 5 1HB ALA 5 2.253 12.682 -7.935 43 HB2 ALA 5 2HB ALA 5 2.591 11.887 -6.397 44 HB3 ALA 5 3HB ALA 5 3.809 12.924 -7.140 45 H SER 6 H SER 6 1.988 11.566 -9.964 46 HA SER 6 HA SER 6 -0.013 9.625 -9.458 47 HB2 SER 6 2HB SER 6 0.178 10.669 -12.212 48 HB3 SER 6 3HB SER 6 -1.183 10.684 -11.091 49 HG SER 6 HG SER 6 -0.139 12.425 -10.004 50 H ARG 7 H ARG 7 2.735 9.752 -11.667 51 HA ARG 7 HA ARG 7 2.156 7.489 -13.200 52 HB2 ARG 7 2HB ARG 7 4.190 9.336 -13.116 53 HB3 ARG 7 3HB ARG 7 5.002 7.862 -12.604 54 HG2 ARG 7 2HG ARG 7 3.635 6.942 -14.737 55 HG3 ARG 7 3HG ARG 7 3.918 8.613 -15.229 56 HD2 ARG 7 2HD ARG 7 6.170 8.334 -15.371 57 HD3 ARG 7 3HD ARG 7 6.213 7.145 -14.070 58 HE ARG 7 HE ARG 7 4.957 5.816 -16.052 59 HH11 ARG 7 1HH1 ARG 7 7.924 7.633 -15.924 60 HH12 ARG 7 2HH1 ARG 7 8.705 6.692 -17.152 61 HH21 ARG 7 1HH2 ARG 7 5.975 4.570 -17.669 62 HH22 ARG 7 2HH2 ARG 7 7.595 4.951 -18.144 63 H ASP 8 H ASP 8 4.109 7.779 -10.239 64 HA ASP 8 HA ASP 8 4.853 5.110 -9.991 65 HB2 ASP 8 2HB ASP 8 5.796 6.927 -8.620 66 HB3 ASP 8 3HB ASP 8 4.262 7.078 -7.769 67 H TRP 9 H TRP 9 1.867 6.726 -9.108 68 HA TRP 9 HA TRP 9 0.794 4.539 -7.618 69 HB2 TRP 9 2HB TRP 9 -0.045 6.747 -7.172 70 HB3 TRP 9 3HB TRP 9 -0.496 6.974 -8.860 71 HD1 TRP 9 HD1 TRP 9 -2.781 5.911 -9.676 72 HE1 TRP 9 HE1 TRP 9 -4.791 4.912 -8.416 73 HE3 TRP 9 HE3 TRP 9 -0.654 5.364 -5.059 74 HZ2 TRP 9 HZ2 TRP 9 -5.395 4.012 -5.810 75 HZ3 TRP 9 HZ3 TRP 9 -2.016 4.427 -3.237 76 HH2 TRP 9 HH2 TRP 9 -4.337 3.766 -3.606 77 H LYS 10 H LYS 10 0.010 5.854 -10.842 78 HA LYS 10 HA LYS 10 -1.811 3.938 -11.641 79 HB2 LYS 10 2HB LYS 10 -0.557 6.101 -12.824 80 HB3 LYS 10 3HB LYS 10 -0.015 4.742 -13.800 81 HG2 LYS 10 2HG LYS 10 -2.282 4.119 -14.290 82 HG3 LYS 10 3HG LYS 10 -2.899 5.349 -13.183 83 HD2 LYS 10 2HD LYS 10 -3.118 6.370 -15.255 84 HD3 LYS 10 3HD LYS 10 -1.577 7.005 -14.673 85 HE2 LYS 10 2HE LYS 10 -0.833 6.361 -16.698 86 HE3 LYS 10 3HE LYS 10 -0.745 4.770 -15.945 87 HZ1 LYS 10 3HZ LYS 10 -3.352 5.121 -16.861 88 HZ2 LYS 10 1HZ LYS 10 -2.182 4.047 -17.445 89 HZ3 LYS 10 2HZ LYS 10 -2.324 5.591 -18.120 90 H MET 11 H MET 11 1.681 3.761 -11.530 91 HA MET 11 HA MET 11 1.910 1.381 -13.089 92 HB2 MET 11 2HB MET 11 3.733 3.108 -12.617 93 HB3 MET 11 3HB MET 11 3.902 2.342 -11.043 94 HG2 MET 11 2HG MET 11 5.498 1.203 -12.170 95 HG3 MET 11 3HG MET 11 4.117 0.168 -12.526 96 HE1 MET 11 3HE MET 11 7.075 2.002 -14.009 97 HE2 MET 11 1HE MET 11 6.433 2.844 -15.419 98 HE3 MET 11 2HE MET 11 5.983 3.371 -13.798 99 H ALA 12 H ALA 12 2.155 2.013 -9.589 100 HA ALA 12 HA ALA 12 2.506 -0.574 -8.698 101 HB1 ALA 12 1HB ALA 12 1.362 0.215 -6.592 102 HB2 ALA 12 2HB ALA 12 2.718 1.200 -7.145 103 HB3 ALA 12 3HB ALA 12 1.063 1.740 -7.427 104 H ILE 13 H ILE 13 -0.396 0.975 -9.859 105 HA ILE 13 HA ILE 13 -2.152 -1.112 -8.915 106 HB ILE 13 HB ILE 13 -2.679 1.149 -10.847 107 HG12 ILE 13 2HG1 ILE 13 -2.091 1.866 -8.547 108 HG13 ILE 13 3HG1 ILE 13 -3.755 2.254 -8.969 109 HG21 ILE 13 1HG2 ILE 13 -4.377 -1.039 -9.773 110 HG22 ILE 13 2HG2 ILE 13 -5.101 0.557 -9.970 111 HG23 ILE 13 3HG2 ILE 13 -4.393 -0.268 -11.359 112 HD11 ILE 13 3HD1 ILE 13 -2.884 0.954 -6.697 113 HD12 ILE 13 1HD1 ILE 13 -4.545 1.052 -7.283 114 HD13 ILE 13 2HD1 ILE 13 -3.541 -0.336 -7.704 115 H LYS 14 H LYS 14 -0.857 -0.062 -12.050 116 HA LYS 14 HA LYS 14 -2.136 -1.851 -13.718 117 HB2 LYS 14 2HB LYS 14 -0.730 -0.054 -14.564 118 HB3 LYS 14 3HB LYS 14 0.702 -0.823 -13.893 119 HG2 LYS 14 2HG LYS 14 -0.752 -2.606 -15.648 120 HG3 LYS 14 3HG LYS 14 -0.284 -1.110 -16.460 121 HD2 LYS 14 2HD LYS 14 1.651 -2.730 -14.823 122 HD3 LYS 14 3HD LYS 14 1.382 -3.032 -16.542 123 HE2 LYS 14 2HE LYS 14 2.036 -0.740 -17.055 124 HE3 LYS 14 3HE LYS 14 2.264 -0.408 -15.339 125 HZ1 LYS 14 3HZ LYS 14 4.375 -0.858 -16.333 126 HZ2 LYS 14 1HZ LYS 14 3.822 -2.311 -17.000 127 HZ3 LYS 14 2HZ LYS 14 3.985 -2.159 -15.324 128 H ARG 15 H ARG 15 0.562 -2.390 -11.553 129 HA ARG 15 HA ARG 15 1.037 -5.063 -12.580 130 HB2 ARG 15 2HB ARG 15 2.265 -3.572 -10.254 131 HB3 ARG 15 3HB ARG 15 2.767 -5.166 -10.801 132 HG2 ARG 15 2HG ARG 15 2.784 -3.396 -13.029 133 HG3 ARG 15 3HG ARG 15 3.657 -2.642 -11.693 134 HD2 ARG 15 2HD ARG 15 5.327 -4.158 -11.760 135 HD3 ARG 15 3HD ARG 15 4.238 -5.493 -12.136 136 HE ARG 15 HE ARG 15 4.409 -3.829 -14.379 137 HH11 ARG 15 1HH1 ARG 15 6.401 -5.998 -12.523 138 HH12 ARG 15 2HH1 ARG 15 7.402 -6.438 -13.867 139 HH21 ARG 15 1HH2 ARG 15 5.720 -4.401 -16.157 140 HH22 ARG 15 2HH2 ARG 15 7.014 -5.528 -15.934 141 H CYS 16 H CYS 16 -0.222 -3.539 -9.639 142 HA CYS 16 HA CYS 16 -0.663 -5.884 -8.167 143 HB2 CYS 16 2HB CYS 16 -0.729 -3.524 -7.286 144 HB3 CYS 16 3HB CYS 16 -2.318 -3.360 -8.023 145 HG CYS 16 HG CYS 16 -1.460 -5.471 -5.472 146 H SER 17 H SER 17 -2.409 -4.459 -10.791 147 HA SER 17 HA SER 17 -4.954 -5.516 -10.414 148 HB2 SER 17 2HB SER 17 -4.582 -3.906 -12.159 149 HB3 SER 17 3HB SER 17 -3.423 -4.965 -12.963 150 HG SER 17 HG SER 17 -6.210 -5.082 -12.906 151 H ASN 18 H ASN 18 -2.004 -7.062 -11.365 152 HA ASN 18 HA ASN 18 -3.207 -9.399 -12.495 153 HB2 ASN 18 2HB ASN 18 -0.560 -8.350 -12.168 154 HB3 ASN 18 3HB ASN 18 -0.595 -10.006 -11.567 155 HD21 ASN 18 1HD2 ASN 18 0.449 -8.551 -14.058 156 HD22 ASN 18 2HD2 ASN 18 -0.067 -9.567 -15.356 157 H VAL 19 H VAL 19 -2.434 -8.334 -9.303 158 HA VAL 19 HA VAL 19 -2.078 -10.683 -7.904 159 HB VAL 19 HB VAL 19 -3.646 -8.262 -7.002 160 HG11 VAL 19 1HG1 VAL 19 -3.116 -9.003 -4.734 161 HG12 VAL 19 2HG1 VAL 19 -4.072 -10.212 -5.595 162 HG13 VAL 19 3HG1 VAL 19 -2.336 -10.445 -5.384 163 HG21 VAL 19 3HG2 VAL 19 -1.309 -7.837 -7.787 164 HG22 VAL 19 1HG2 VAL 19 -1.595 -7.436 -6.093 165 HG23 VAL 19 2HG2 VAL 19 -0.745 -8.922 -6.517 166 H ALA 20 H ALA 20 -3.311 -12.375 -7.371 167 HA ALA 20 HA ALA 20 -6.181 -12.244 -8.026 168 HB1 ALA 20 1HB ALA 20 -4.470 -14.721 -7.916 169 HB2 ALA 20 2HB ALA 20 -6.124 -14.585 -8.513 170 HB3 ALA 20 3HB ALA 20 -4.804 -13.812 -9.391 171 H VAL 21 H VAL 21 -7.680 -13.164 -6.610 172 HA VAL 21 HA VAL 21 -7.186 -12.853 -3.876 173 HB VAL 21 HB VAL 21 -9.366 -14.564 -5.074 174 HG11 VAL 21 1HG1 VAL 21 -8.853 -13.360 -2.407 175 HG12 VAL 21 2HG1 VAL 21 -10.521 -13.428 -2.981 176 HG13 VAL 21 3HG1 VAL 21 -9.578 -14.911 -2.829 177 HG21 VAL 21 3HG2 VAL 21 -8.871 -11.757 -5.387 178 HG22 VAL 21 1HG2 VAL 21 -10.172 -12.742 -6.057 179 HG23 VAL 21 2HG2 VAL 21 -10.354 -12.005 -4.465 180 H GLY 22 H GLY 22 -7.051 -15.703 -5.941 181 HA2 GLY 22 2HA GLY 22 -6.176 -17.283 -3.605 182 HA3 GLY 22 3HA GLY 22 -6.941 -17.965 -5.032 183 H VAL 23 H VAL 23 -4.853 -19.307 -4.551 184 HA VAL 23 HA VAL 23 -2.412 -18.139 -5.551 185 HB VAL 23 HB VAL 23 -1.443 -20.371 -5.250 186 HG11 VAL 23 1HG1 VAL 23 -1.495 -18.895 -3.339 187 HG12 VAL 23 2HG1 VAL 23 -3.129 -19.426 -2.935 188 HG13 VAL 23 3HG1 VAL 23 -1.777 -20.553 -2.810 189 HG21 VAL 23 3HG2 VAL 23 -3.155 -21.967 -3.971 190 HG22 VAL 23 1HG2 VAL 23 -4.298 -21.123 -5.017 191 HG23 VAL 23 2HG2 VAL 23 -2.946 -22.010 -5.722 192 H GLY 24 H GLY 24 -4.964 -20.225 -6.757 193 HA2 GLY 24 2HA GLY 24 -4.472 -19.644 -9.450 194 HA3 GLY 24 3HA GLY 24 -3.663 -21.159 -9.077 195 H GLY 25 H GLY 25 -5.211 -21.906 -10.779 196 HA2 GLY 25 2HA GLY 25 -6.961 -23.361 -11.187 197 HA3 GLY 25 3HA GLY 25 -7.426 -23.212 -9.499 198 H LYS 26 H LYS 26 -8.329 -20.934 -8.963 199 HA LYS 26 HA LYS 26 -10.498 -20.468 -10.846 200 HB2 LYS 26 2HB LYS 26 -10.122 -20.210 -7.990 201 HB3 LYS 26 3HB LYS 26 -10.773 -18.723 -8.667 202 HG2 LYS 26 2HG LYS 26 -12.679 -19.826 -9.514 203 HG3 LYS 26 3HG LYS 26 -11.972 -21.419 -9.231 204 HD2 LYS 26 2HD LYS 26 -11.915 -20.659 -6.744 205 HD3 LYS 26 3HD LYS 26 -13.115 -19.473 -7.265 206 HE2 LYS 26 2HE LYS 26 -14.726 -21.029 -7.517 207 HE3 LYS 26 3HE LYS 26 -13.608 -22.228 -8.166 208 HZ1 LYS 26 3HZ LYS 26 -14.079 -23.178 -6.175 209 HZ2 LYS 26 1HZ LYS 26 -14.372 -21.706 -5.394 210 HZ3 LYS 26 2HZ LYS 26 -12.783 -22.210 -5.680 211 H SER 27 H SER 27 -10.824 -18.625 -11.988 212 HA SER 27 HA SER 27 -8.600 -16.729 -12.058 213 HB2 SER 27 2HB SER 27 -10.271 -17.890 -14.038 214 HB3 SER 27 3HB SER 27 -10.594 -16.156 -14.034 215 HG SER 27 HG SER 27 -8.787 -16.954 -15.385 216 H LYS 28 H LYS 28 -8.843 -15.184 -10.554 217 HA LYS 28 HA LYS 28 -11.020 -13.325 -10.831 218 HB2 LYS 28 2HB LYS 28 -11.331 -15.397 -8.965 219 HB3 LYS 28 3HB LYS 28 -10.881 -13.983 -8.020 220 HG2 LYS 28 2HG LYS 28 -12.857 -13.268 -9.970 221 HG3 LYS 28 3HG LYS 28 -13.409 -14.648 -9.018 222 HD2 LYS 28 2HD LYS 28 -12.789 -13.355 -6.960 223 HD3 LYS 28 3HD LYS 28 -12.497 -11.960 -8.001 224 HE2 LYS 28 2HE LYS 28 -15.032 -13.021 -8.681 225 HE3 LYS 28 3HE LYS 28 -14.960 -12.910 -6.923 226 HZ1 LYS 28 3HZ LYS 28 -13.876 -10.562 -7.967 227 HZ2 LYS 28 1HZ LYS 28 -15.317 -10.748 -7.099 228 HZ3 LYS 28 2HZ LYS 28 -15.329 -10.845 -8.787 229 H LYS 29 H LYS 29 -9.533 -11.734 -11.208 230 HA LYS 29 HA LYS 29 -7.497 -11.237 -9.153 231 HB2 LYS 29 2HB LYS 29 -6.437 -9.770 -10.803 232 HB3 LYS 29 3HB LYS 29 -6.678 -11.386 -11.455 233 HG2 LYS 29 2HG LYS 29 -8.728 -10.550 -12.592 234 HG3 LYS 29 3HG LYS 29 -8.305 -8.925 -12.047 235 HD2 LYS 29 2HD LYS 29 -6.721 -8.693 -13.618 236 HD3 LYS 29 3HD LYS 29 -6.106 -10.328 -13.365 237 HE2 LYS 29 2HE LYS 29 -8.708 -9.884 -14.777 238 HE3 LYS 29 3HE LYS 29 -7.183 -9.705 -15.642 239 HZ1 LYS 29 3HZ LYS 29 -7.647 -11.903 -15.994 240 HZ2 LYS 29 1HZ LYS 29 -8.393 -12.118 -14.491 241 HZ3 LYS 29 2HZ LYS 29 -6.707 -12.024 -14.592 242 H PHE 30 H PHE 30 -7.117 -8.999 -8.490 243 HA PHE 30 HA PHE 30 -9.627 -7.674 -7.923 244 HB2 PHE 30 2HB PHE 30 -6.789 -7.114 -7.046 245 HB3 PHE 30 3HB PHE 30 -8.176 -6.155 -6.540 246 HD1 PHE 30 HD2 PHE 30 -10.208 -7.768 -5.691 247 HD2 PHE 30 HD1 PHE 30 -6.043 -8.628 -5.510 248 HE1 PHE 30 HE2 PHE 30 -10.615 -9.335 -3.838 249 HE2 PHE 30 HE1 PHE 30 -6.444 -10.197 -3.658 250 HZ PHE 30 HZ PHE 30 -8.732 -10.552 -2.819 251 H GLY 31 H GLY 31 -9.164 -5.064 -7.818 252 HA2 GLY 31 2HA GLY 31 -7.978 -4.180 -10.336 253 HA3 GLY 31 3HA GLY 31 -9.708 -3.933 -10.149 254 H GLU 32 H GLU 32 -8.372 -1.719 -10.589 255 HA GLU 32 HA GLU 32 -7.111 -0.399 -8.505 256 HB2 GLU 32 2HB GLU 32 -8.027 1.708 -9.613 257 HB3 GLU 32 3HB GLU 32 -7.055 0.641 -10.618 258 HG2 GLU 32 2HG GLU 32 -9.821 -0.097 -10.788 259 HG3 GLU 32 3HG GLU 32 -9.623 1.619 -11.137 260 H GLY 33 H GLY 33 -10.549 -0.831 -9.135 261 HA2 GLY 33 2HA GLY 33 -11.513 0.992 -7.207 262 HA3 GLY 33 3HA GLY 33 -12.406 -0.371 -7.866 263 H ASN 34 H ASN 34 -10.657 -2.429 -6.989 264 HA ASN 34 HA ASN 34 -11.647 -2.802 -4.356 265 HB2 ASN 34 2HB ASN 34 -9.607 -4.332 -5.980 266 HB3 ASN 34 3HB ASN 34 -10.166 -4.847 -4.391 267 HD21 ASN 34 1HD2 ASN 34 -12.744 -4.584 -4.330 268 HD22 ASN 34 2HD2 ASN 34 -13.534 -5.440 -5.606 269 H PHE 35 H PHE 35 -8.433 -2.058 -5.654 270 HA PHE 35 HA PHE 35 -7.067 -2.108 -3.189 271 HB2 PHE 35 2HB PHE 35 -6.312 -0.395 -5.554 272 HB3 PHE 35 3HB PHE 35 -5.246 -1.090 -4.338 273 HD1 PHE 35 HD1 PHE 35 -6.194 -3.864 -4.230 274 HD2 PHE 35 HD2 PHE 35 -5.590 -1.288 -7.564 275 HE1 PHE 35 HE1 PHE 35 -5.825 -5.823 -5.673 276 HE2 PHE 35 HE2 PHE 35 -5.221 -3.243 -9.012 277 HZ PHE 35 HZ PHE 35 -5.338 -5.514 -8.067 278 H ARG 36 H ARG 36 -8.323 0.638 -5.081 279 HA ARG 36 HA ARG 36 -7.656 2.649 -3.263 280 HB2 ARG 36 2HB ARG 36 -9.145 4.062 -4.473 281 HB3 ARG 36 3HB ARG 36 -8.435 2.955 -5.639 282 HG2 ARG 36 2HG ARG 36 -10.450 1.608 -5.630 283 HG3 ARG 36 3HG ARG 36 -11.161 2.652 -4.398 284 HD2 ARG 36 2HD ARG 36 -10.241 3.699 -7.061 285 HD3 ARG 36 3HD ARG 36 -11.864 3.056 -6.813 286 HE ARG 36 HE ARG 36 -11.549 4.905 -4.830 287 HH11 ARG 36 1HH1 ARG 36 -11.299 4.949 -8.302 288 HH12 ARG 36 2HH1 ARG 36 -11.786 6.605 -8.446 289 HH21 ARG 36 1HH2 ARG 36 -12.192 7.087 -5.007 290 HH22 ARG 36 2HH2 ARG 36 -12.293 7.820 -6.572 291 H TRP 37 H TRP 37 -10.387 0.461 -3.369 292 HA TRP 37 HA TRP 37 -12.032 1.802 -1.508 293 HB2 TRP 37 2HB TRP 37 -12.995 0.105 -2.906 294 HB3 TRP 37 3HB TRP 37 -11.865 -1.106 -2.307 295 HD1 TRP 37 HD1 TRP 37 -15.121 0.647 -1.424 296 HE1 TRP 37 HE1 TRP 37 -16.180 -0.528 0.607 297 HE3 TRP 37 HE3 TRP 37 -11.250 -2.447 -0.166 298 HZ2 TRP 37 HZ2 TRP 37 -15.468 -2.504 2.492 299 HZ3 TRP 37 HZ3 TRP 37 -11.520 -3.948 1.765 300 HH2 TRP 37 HH2 TRP 37 -13.586 -3.974 3.065 301 H ALA 38 H ALA 38 -9.650 -0.803 -1.116 302 HA ALA 38 HA ALA 38 -9.998 -1.010 1.705 303 HB1 ALA 38 1HB ALA 38 -7.813 -2.291 1.562 304 HB2 ALA 38 2HB ALA 38 -9.163 -2.926 0.620 305 HB3 ALA 38 3HB ALA 38 -7.882 -2.013 -0.179 306 H ILE 39 H ILE 39 -7.415 0.401 -0.307 307 HA ILE 39 HA ILE 39 -5.802 1.389 1.711 308 HB ILE 39 HB ILE 39 -6.333 2.670 -0.972 309 HG12 ILE 39 2HG1 ILE 39 -4.029 0.871 -0.245 310 HG13 ILE 39 3HG1 ILE 39 -5.543 0.222 -0.866 311 HG21 ILE 39 1HG2 ILE 39 -3.772 3.271 -0.390 312 HG22 ILE 39 2HG2 ILE 39 -5.134 4.331 -0.033 313 HG23 ILE 39 3HG2 ILE 39 -4.476 3.289 1.227 314 HD11 ILE 39 3HD1 ILE 39 -5.254 1.683 -2.865 315 HD12 ILE 39 1HD1 ILE 39 -3.652 2.099 -2.255 316 HD13 ILE 39 2HD1 ILE 39 -4.028 0.429 -2.682 317 H ARG 40 H ARG 40 -8.262 3.248 -0.090 318 HA ARG 40 HA ARG 40 -8.157 5.565 1.427 319 HB2 ARG 40 2HB ARG 40 -9.381 5.264 -0.737 320 HB3 ARG 40 3HB ARG 40 -10.640 4.413 0.149 321 HG2 ARG 40 2HG ARG 40 -11.120 6.404 1.442 322 HG3 ARG 40 3HG ARG 40 -9.804 7.264 0.639 323 HD2 ARG 40 2HD ARG 40 -10.928 7.232 -1.442 324 HD3 ARG 40 3HD ARG 40 -12.107 6.054 -0.868 325 HE ARG 40 HE ARG 40 -12.213 8.890 -0.541 326 HH11 ARG 40 1HH1 ARG 40 -13.127 5.854 0.897 327 HH12 ARG 40 2HH1 ARG 40 -14.475 6.519 1.758 328 HH21 ARG 40 1HH2 ARG 40 -13.985 9.777 0.588 329 HH22 ARG 40 2HH2 ARG 40 -14.963 8.750 1.581 330 H MET 41 H MET 41 -10.267 2.735 1.857 331 HA MET 41 HA MET 41 -11.777 3.607 3.996 332 HB2 MET 41 2HB MET 41 -12.308 1.532 2.925 333 HB3 MET 41 3HB MET 41 -10.746 0.846 3.348 334 HG2 MET 41 2HG MET 41 -11.343 0.469 5.527 335 HG3 MET 41 3HG MET 41 -12.563 1.740 5.526 336 HE1 MET 41 3HE MET 41 -14.940 1.421 5.242 337 HE2 MET 41 1HE MET 41 -14.716 1.336 3.495 338 HE3 MET 41 2HE MET 41 -15.727 0.145 4.313 339 H ALA 42 H ALA 42 -8.609 2.002 4.065 340 HA ALA 42 HA ALA 42 -8.354 1.925 6.871 341 HB1 ALA 42 1HB ALA 42 -6.823 1.128 4.646 342 HB2 ALA 42 2HB ALA 42 -5.789 2.164 5.632 343 HB3 ALA 42 3HB ALA 42 -6.552 0.743 6.346 344 H ASN 43 H ASN 43 -7.206 4.269 4.462 345 HA ASN 43 HA ASN 43 -5.763 5.952 6.119 346 HB2 ASN 43 2HB ASN 43 -7.089 6.184 3.505 347 HB3 ASN 43 3HB ASN 43 -6.906 7.714 4.359 348 HD21 ASN 43 1HD2 ASN 43 -5.367 8.573 3.050 349 HD22 ASN 43 2HD2 ASN 43 -3.764 7.941 2.913 350 H VAL 44 H VAL 44 -9.226 5.684 5.678 351 HA VAL 44 HA VAL 44 -9.884 8.092 7.071 352 HB VAL 44 HB VAL 44 -11.664 5.698 6.609 353 HG11 VAL 44 1HG1 VAL 44 -12.078 8.467 7.572 354 HG12 VAL 44 2HG1 VAL 44 -13.301 7.799 6.490 355 HG13 VAL 44 3HG1 VAL 44 -12.918 6.978 8.004 356 HG21 VAL 44 3HG2 VAL 44 -12.258 7.699 4.745 357 HG22 VAL 44 1HG2 VAL 44 -10.503 7.530 4.721 358 HG23 VAL 44 2HG2 VAL 44 -11.528 6.124 4.430 359 H SER 45 H SER 45 -10.485 4.687 7.958 360 HA SER 45 HA SER 45 -11.156 5.122 10.607 361 HB2 SER 45 2HB SER 45 -9.589 2.676 9.876 362 HB3 SER 45 3HB SER 45 -11.021 2.823 10.894 363 HG SER 45 HG SER 45 -11.133 1.949 8.570 364 H THR 46 H THR 46 -8.028 5.069 9.095 365 HA THR 46 HA THR 46 -6.780 5.513 11.730 366 HB THR 46 HB THR 46 -4.772 4.461 11.002 367 HG1 THR 46 HG1 THR 46 -5.841 3.845 8.468 368 HG21 THR 46 3HG2 THR 46 -5.484 2.190 10.561 369 HG22 THR 46 1HG2 THR 46 -7.058 2.757 10.005 370 HG23 THR 46 2HG2 THR 46 -6.602 2.941 11.699 371 H GLY 47 H GLY 47 -7.859 7.656 10.420 372 HA2 GLY 47 2HA GLY 47 -5.726 9.454 10.276 373 HA3 GLY 47 3HA GLY 47 -6.116 8.975 8.631 374 H ARG 48 H ARG 48 -8.703 8.924 8.380 375 HA ARG 48 HA ARG 48 -10.587 10.175 8.139 376 HB2 ARG 48 2HB ARG 48 -10.404 10.019 10.716 377 HB3 ARG 48 3HB ARG 48 -9.860 11.689 10.630 378 HG2 ARG 48 2HG ARG 48 -11.931 12.443 10.361 379 HG3 ARG 48 3HG ARG 48 -12.274 11.266 9.091 380 HD2 ARG 48 2HD ARG 48 -12.800 9.582 10.735 381 HD3 ARG 48 3HD ARG 48 -12.319 10.660 12.044 382 HE ARG 48 HE ARG 48 -14.838 10.597 10.731 383 HH11 ARG 48 1HH1 ARG 48 -12.537 12.744 12.218 384 HH12 ARG 48 2HH1 ARG 48 -13.726 13.927 12.655 385 HH21 ARG 48 1HH2 ARG 48 -16.413 12.145 11.301 386 HH22 ARG 48 2HH2 ARG 48 -15.930 13.584 12.134 387 H GLU 49 H GLU 49 -8.524 11.007 6.621 388 HA GLU 49 HA GLU 49 -9.172 13.723 6.115 389 HB2 GLU 49 2HB GLU 49 -6.821 13.155 7.775 390 HB3 GLU 49 3HB GLU 49 -6.473 14.158 6.373 391 HG2 GLU 49 2HG GLU 49 -8.672 15.397 7.277 392 HG3 GLU 49 3HG GLU 49 -8.041 14.756 8.794 393 HA PRO 50 HA PRO 50 -7.713 12.681 2.112 394 HB2 PRO 50 2HB PRO 50 -6.774 15.057 1.192 395 HB3 PRO 50 3HB PRO 50 -8.497 14.719 1.399 396 HG2 PRO 50 2HG PRO 50 -6.631 16.215 3.199 397 HG3 PRO 50 3HG PRO 50 -8.293 16.616 2.729 398 HD2 PRO 50 2HD PRO 50 -7.687 15.476 5.109 399 HD3 PRO 50 3HD PRO 50 -9.211 15.155 4.258 400 H GLY 51 H GLY 51 -5.389 14.806 3.798 401 HA2 GLY 51 2HA GLY 51 -3.163 13.649 2.354 402 HA3 GLY 51 3HA GLY 51 -3.074 14.898 3.587 403 H ASP 52 H ASP 52 -3.651 11.424 3.150 404 HA ASP 52 HA ASP 52 -2.121 10.941 5.601 405 HB2 ASP 52 2HB ASP 52 -4.923 10.028 5.036 406 HB3 ASP 52 3HB ASP 52 -3.861 9.041 6.036 407 H ILE 53 H ILE 53 -1.553 10.686 2.734 408 HA ILE 53 HA ILE 53 -1.199 7.767 2.545 409 HB ILE 53 HB ILE 53 -1.091 9.776 0.292 410 HG12 ILE 53 2HG1 ILE 53 -3.284 7.800 0.951 411 HG13 ILE 53 3HG1 ILE 53 -3.358 9.519 1.324 412 HG21 ILE 53 1HG2 ILE 53 0.257 7.792 -0.109 413 HG22 ILE 53 2HG2 ILE 53 -1.118 6.761 0.280 414 HG23 ILE 53 3HG2 ILE 53 -1.168 7.793 -1.149 415 HD11 ILE 53 3HD1 ILE 53 -4.299 9.798 -0.657 416 HD12 ILE 53 1HD1 ILE 53 -2.734 9.419 -1.376 417 HD13 ILE 53 2HD1 ILE 53 -3.929 8.143 -1.139 418 HA PRO 54 HA PRO 54 3.023 9.459 3.342 419 HB2 PRO 54 2HB PRO 54 3.792 7.384 4.914 420 HB3 PRO 54 3HB PRO 54 2.912 8.785 5.536 421 HG2 PRO 54 2HG PRO 54 1.877 6.077 4.787 422 HG3 PRO 54 3HG PRO 54 1.475 7.079 6.194 423 HD2 PRO 54 2HD PRO 54 -0.123 6.921 4.015 424 HD3 PRO 54 3HD PRO 54 0.008 8.393 4.998 425 H GLU 55 H GLU 55 4.712 9.017 2.057 426 HA GLU 55 HA GLU 55 4.599 6.647 0.377 427 HB2 GLU 55 2HB GLU 55 6.502 7.731 -0.820 428 HB3 GLU 55 3HB GLU 55 5.046 8.714 -0.759 429 HG2 GLU 55 2HG GLU 55 5.959 10.161 0.847 430 HG3 GLU 55 3HG GLU 55 7.276 9.050 1.217 431 H THR 56 H THR 56 5.057 5.778 2.849 432 HA THR 56 HA THR 56 7.825 4.846 2.704 433 HB THR 56 HB THR 56 8.312 5.249 4.999 434 HG1 THR 56 HG1 THR 56 6.805 5.839 6.464 435 HG21 THR 56 3HG2 THR 56 8.296 7.654 5.133 436 HG22 THR 56 1HG2 THR 56 6.970 7.752 3.975 437 HG23 THR 56 2HG2 THR 56 8.557 7.188 3.452 438 H LEU 57 H LEU 57 7.881 2.706 2.853 439 HA LEU 57 HA LEU 57 5.660 1.086 3.195 440 HB2 LEU 57 2HB LEU 57 8.583 0.688 3.181 441 HB3 LEU 57 3HB LEU 57 7.636 -0.591 3.938 442 HG LEU 57 HG LEU 57 7.238 0.396 1.115 443 HD11 LEU 57 1HD1 LEU 57 9.437 -0.816 1.710 444 HD12 LEU 57 2HD1 LEU 57 8.495 -1.388 0.334 445 HD13 LEU 57 3HD1 LEU 57 8.419 -2.247 1.872 446 HD21 LEU 57 3HD2 LEU 57 5.364 -0.789 1.130 447 HD22 LEU 57 1HD2 LEU 57 5.606 -1.144 2.841 448 HD23 LEU 57 2HD2 LEU 57 6.260 -2.230 1.614 449 H ASP 58 H ASP 58 7.769 2.496 5.570 450 HA ASP 58 HA ASP 58 7.117 0.808 7.747 451 HB2 ASP 58 2HB ASP 58 9.005 2.630 7.445 452 HB3 ASP 58 3HB ASP 58 7.801 3.686 8.178 453 H GLN 59 H GLN 59 5.862 3.987 6.753 454 HA GLN 59 HA GLN 59 3.973 4.251 8.809 455 HB2 GLN 59 2HB GLN 59 4.186 5.429 6.051 456 HB3 GLN 59 3HB GLN 59 2.814 5.789 7.091 457 HG2 GLN 59 2HG GLN 59 5.479 6.133 8.298 458 HG3 GLN 59 3HG GLN 59 5.053 7.258 7.010 459 HE21 GLN 59 1HE2 GLN 59 4.073 9.033 7.639 460 HE22 GLN 59 2HE2 GLN 59 3.131 9.228 9.073 461 H LEU 60 H LEU 60 3.670 2.920 5.534 462 HA LEU 60 HA LEU 60 0.908 2.348 5.697 463 HB2 LEU 60 2HB LEU 60 2.125 2.494 3.582 464 HB3 LEU 60 3HB LEU 60 3.045 1.053 4.009 465 HG LEU 60 HG LEU 60 0.437 0.186 4.163 466 HD11 LEU 60 1HD1 LEU 60 0.675 2.347 2.127 467 HD12 LEU 60 2HD1 LEU 60 -0.684 1.920 3.166 468 HD13 LEU 60 3HD1 LEU 60 -0.301 0.924 1.762 469 HD21 LEU 60 3HD2 LEU 60 2.539 0.032 2.028 470 HD22 LEU 60 1HD2 LEU 60 0.995 -0.804 1.867 471 HD23 LEU 60 2HD2 LEU 60 2.069 -1.189 3.212 472 H ARG 61 H ARG 61 3.758 0.243 6.079 473 HA ARG 61 HA ARG 61 2.476 -2.131 6.656 474 HB2 ARG 61 2HB ARG 61 4.906 -1.922 6.324 475 HB3 ARG 61 3HB ARG 61 5.046 -1.106 7.875 476 HG2 ARG 61 2HG ARG 61 3.831 -3.345 8.682 477 HG3 ARG 61 3HG ARG 61 4.673 -3.968 7.262 478 HD2 ARG 61 2HD ARG 61 6.698 -3.772 8.223 479 HD3 ARG 61 3HD ARG 61 6.294 -2.237 8.989 480 HE ARG 61 HE ARG 61 6.117 -4.848 10.155 481 HH11 ARG 61 1HH1 ARG 61 4.831 -1.613 10.224 482 HH12 ARG 61 2HH1 ARG 61 4.305 -1.717 11.872 483 HH21 ARG 61 1HH2 ARG 61 5.429 -4.997 12.325 484 HH22 ARG 61 2HH2 ARG 61 4.647 -3.642 13.066 485 H LEU 62 H LEU 62 3.054 0.633 8.734 486 HA LEU 62 HA LEU 62 2.345 -0.644 11.174 487 HB2 LEU 62 2HB LEU 62 3.667 1.335 11.259 488 HB3 LEU 62 3HB LEU 62 2.467 2.246 10.343 489 HG LEU 62 HG LEU 62 0.926 2.099 12.261 490 HD11 LEU 62 1HD1 LEU 62 1.821 1.358 14.438 491 HD12 LEU 62 2HD1 LEU 62 3.266 0.767 13.618 492 HD13 LEU 62 3HD1 LEU 62 1.696 0.045 13.267 493 HD21 LEU 62 3HD2 LEU 62 1.787 3.972 13.142 494 HD22 LEU 62 1HD2 LEU 62 3.043 3.778 11.919 495 HD23 LEU 62 2HD2 LEU 62 3.314 3.193 13.561 496 H VAL 63 H VAL 63 0.568 1.480 8.944 497 HA VAL 63 HA VAL 63 -1.842 1.590 10.340 498 HB VAL 63 HB VAL 63 -1.443 1.634 7.346 499 HG11 VAL 63 1HG1 VAL 63 -3.805 1.968 9.067 500 HG12 VAL 63 2HG1 VAL 63 -3.594 3.201 7.822 501 HG13 VAL 63 3HG1 VAL 63 -3.691 1.498 7.371 502 HG21 VAL 63 3HG2 VAL 63 -0.599 3.680 7.564 503 HG22 VAL 63 1HG2 VAL 63 -1.962 4.184 8.563 504 HG23 VAL 63 2HG2 VAL 63 -0.554 3.428 9.309 505 H ILE 64 H ILE 64 -0.526 -0.891 8.257 506 HA ILE 64 HA ILE 64 -2.938 -2.345 7.883 507 HB ILE 64 HB ILE 64 -0.084 -3.322 7.732 508 HG12 ILE 64 2HG1 ILE 64 -1.876 -2.600 5.422 509 HG13 ILE 64 3HG1 ILE 64 -0.857 -1.397 6.205 510 HG21 ILE 64 1HG2 ILE 64 -1.109 -5.323 7.699 511 HG22 ILE 64 2HG2 ILE 64 -2.682 -4.628 7.311 512 HG23 ILE 64 3HG2 ILE 64 -1.493 -4.887 6.034 513 HD11 ILE 64 3HD1 ILE 64 0.811 -3.577 5.673 514 HD12 ILE 64 1HD1 ILE 64 -0.176 -3.352 4.229 515 HD13 ILE 64 2HD1 ILE 64 0.783 -2.013 4.859 516 H CYS 65 H CYS 65 -0.097 -3.065 9.922 517 HA CYS 65 HA CYS 65 -1.311 -5.179 11.325 518 HB2 CYS 65 2HB CYS 65 0.567 -5.067 12.822 519 HB3 CYS 65 3HB CYS 65 1.151 -4.741 11.194 520 HG CYS 65 HG CYS 65 2.491 -3.121 13.092 521 H ASP 66 H ASP 66 -1.463 -1.742 11.712 522 HA ASP 66 HA ASP 66 -2.423 -1.788 14.417 523 HB2 ASP 66 2HB ASP 66 -1.278 0.189 13.687 524 HB3 ASP 66 3HB ASP 66 -2.360 0.374 12.309 525 H LEU 67 H LEU 67 -3.965 -0.950 11.310 526 HA LEU 67 HA LEU 67 -6.582 -0.825 12.327 527 HB2 LEU 67 2HB LEU 67 -6.181 0.219 10.262 528 HB3 LEU 67 3HB LEU 67 -5.463 -1.236 9.573 529 HG LEU 67 HG LEU 67 -8.288 -1.494 10.348 530 HD11 LEU 67 1HD1 LEU 67 -8.774 -0.357 8.012 531 HD12 LEU 67 2HD1 LEU 67 -7.357 0.595 8.454 532 HD13 LEU 67 3HD1 LEU 67 -8.768 0.570 9.512 533 HD21 LEU 67 3HD2 LEU 67 -6.566 -2.246 8.002 534 HD22 LEU 67 1HD2 LEU 67 -8.313 -2.485 8.011 535 HD23 LEU 67 2HD2 LEU 67 -7.305 -3.303 9.205 536 H GLN 68 H GLN 68 -4.645 -3.488 11.151 537 HA GLN 68 HA GLN 68 -6.811 -5.346 10.956 538 HB2 GLN 68 2HB GLN 68 -4.756 -5.635 9.653 539 HB3 GLN 68 3HB GLN 68 -3.832 -5.826 11.137 540 HG2 GLN 68 2HG GLN 68 -6.118 -7.658 10.682 541 HG3 GLN 68 3HG GLN 68 -4.660 -7.893 9.719 542 HE21 GLN 68 1HE2 GLN 68 -2.597 -7.766 11.110 543 HE22 GLN 68 2HE2 GLN 68 -2.632 -8.689 12.570 544 H GLU 69 H GLU 69 -4.372 -4.582 13.394 545 HA GLU 69 HA GLU 69 -4.890 -6.695 15.157 546 HB2 GLU 69 2HB GLU 69 -3.611 -4.028 15.352 547 HB3 GLU 69 3HB GLU 69 -4.135 -4.755 16.864 548 HG2 GLU 69 2HG GLU 69 -2.768 -6.682 16.486 549 HG3 GLU 69 3HG GLU 69 -2.356 -6.127 14.865 550 H ARG 70 H ARG 70 -6.329 -3.466 14.928 551 HA ARG 70 HA ARG 70 -8.000 -3.749 17.205 552 HB2 ARG 70 2HB ARG 70 -8.074 -1.890 14.832 553 HB3 ARG 70 3HB ARG 70 -9.251 -1.807 16.136 554 HG2 ARG 70 2HG ARG 70 -7.678 -1.095 17.684 555 HG3 ARG 70 3HG ARG 70 -6.322 -1.687 16.722 556 HD2 ARG 70 2HD ARG 70 -6.160 0.556 16.304 557 HD3 ARG 70 3HD ARG 70 -7.221 0.070 14.982 558 HE ARG 70 HE ARG 70 -8.945 0.726 16.968 559 HH11 ARG 70 1HH1 ARG 70 -6.273 2.367 15.456 560 HH12 ARG 70 2HH1 ARG 70 -6.936 3.949 15.701 561 HH21 ARG 70 1HH2 ARG 70 -9.829 2.803 17.296 562 HH22 ARG 70 2HH2 ARG 70 -8.959 4.195 16.748 563 H ARG 71 H ARG 71 -8.753 -3.847 13.718 564 HA ARG 71 HA ARG 71 -11.424 -4.567 13.928 565 HB2 ARG 71 2HB ARG 71 -9.404 -5.265 11.791 566 HB3 ARG 71 3HB ARG 71 -11.135 -5.530 11.631 567 HG2 ARG 71 2HG ARG 71 -9.980 -2.821 12.205 568 HG3 ARG 71 3HG ARG 71 -10.181 -3.438 10.564 569 HD2 ARG 71 2HD ARG 71 -12.450 -3.290 10.640 570 HD3 ARG 71 3HD ARG 71 -12.521 -3.614 12.372 571 HE ARG 71 HE ARG 71 -11.337 -1.106 11.974 572 HH11 ARG 71 1HH1 ARG 71 -14.417 -2.688 11.617 573 HH12 ARG 71 2HH1 ARG 71 -15.337 -1.241 11.865 574 HH21 ARG 71 1HH2 ARG 71 -12.536 0.807 12.302 575 HH22 ARG 71 2HH2 ARG 71 -14.265 0.747 12.253 576 H GLU 72 H GLU 72 -8.550 -6.639 13.785 577 HA GLU 72 HA GLU 72 -9.841 -9.111 13.689 578 HB2 GLU 72 2HB GLU 72 -7.422 -8.802 13.321 579 HB3 GLU 72 3HB GLU 72 -7.216 -8.439 15.029 580 HG2 GLU 72 2HG GLU 72 -8.461 -10.834 15.172 581 HG3 GLU 72 3HG GLU 72 -7.556 -11.016 13.670 582 H LYS 73 H LYS 73 -8.712 -7.263 16.510 583 HA LYS 73 HA LYS 73 -9.455 -9.039 18.506 584 HB2 LYS 73 2HB LYS 73 -8.129 -6.921 18.789 585 HB3 LYS 73 3HB LYS 73 -9.642 -6.029 18.693 586 HG2 LYS 73 2HG LYS 73 -9.868 -8.116 20.643 587 HG3 LYS 73 3HG LYS 73 -8.438 -7.133 20.968 588 HD2 LYS 73 2HD LYS 73 -9.745 -5.132 21.037 589 HD3 LYS 73 3HD LYS 73 -11.179 -5.985 20.459 590 HE2 LYS 73 2HE LYS 73 -10.406 -7.400 22.714 591 HE3 LYS 73 3HE LYS 73 -10.132 -5.715 23.152 592 HZ1 LYS 73 3HZ LYS 73 -12.493 -6.950 23.347 593 HZ2 LYS 73 1HZ LYS 73 -12.645 -6.245 21.816 594 HZ3 LYS 73 2HZ LYS 73 -12.317 -5.277 23.164 595 H PHE 74 H PHE 74 -11.389 -6.601 16.835 596 HA PHE 74 HA PHE 74 -13.719 -7.025 18.443 597 HB2 PHE 74 2HB PHE 74 -12.908 -5.067 16.685 598 HB3 PHE 74 3HB PHE 74 -14.165 -5.897 15.775 599 HD1 PHE 74 HD2 PHE 74 -16.467 -5.927 16.575 600 HD2 PHE 74 HD1 PHE 74 -13.423 -3.797 18.651 601 HE1 PHE 74 HE2 PHE 74 -18.189 -4.693 17.826 602 HE2 PHE 74 HE1 PHE 74 -15.140 -2.559 19.906 603 HZ PHE 74 HZ PHE 74 -17.526 -3.006 19.493 604 H GLY 75 H GLY 75 -12.381 -8.468 15.589 605 HA2 GLY 75 2HA GLY 75 -13.691 -10.810 15.568 606 HA3 GLY 75 3HA GLY 75 -14.872 -9.744 14.821 607 H SER 76 H SER 76 -14.499 -11.398 13.067 608 HA SER 76 HA SER 76 -12.376 -10.407 11.292 609 HB2 SER 76 2HB SER 76 -12.452 -12.945 10.464 610 HB3 SER 76 3HB SER 76 -11.380 -12.420 11.763 611 HG SER 76 HG SER 76 -12.387 -13.823 12.944 612 H SER 77 H SER 77 -13.017 -9.961 9.269 613 HA SER 77 HA SER 77 -15.467 -11.145 8.218 614 HB2 SER 77 2HB SER 77 -16.672 -9.201 7.990 615 HB3 SER 77 3HB SER 77 -15.782 -8.808 9.461 616 HG SER 77 HG SER 77 -15.808 -7.377 7.353 617 H LYS 78 H LYS 78 -15.594 -11.158 5.974 618 HA LYS 78 HA LYS 78 -13.248 -11.378 4.535 619 HB2 LYS 78 2HB LYS 78 -14.663 -11.259 2.507 620 HB3 LYS 78 3HB LYS 78 -15.326 -12.330 3.734 621 HG2 LYS 78 2HG LYS 78 -16.815 -10.445 4.443 622 HG3 LYS 78 3HG LYS 78 -16.251 -9.558 3.026 623 HD2 LYS 78 2HD LYS 78 -17.687 -10.648 1.723 624 HD3 LYS 78 3HD LYS 78 -17.044 -12.203 2.256 625 HE2 LYS 78 2HE LYS 78 -19.328 -12.248 2.815 626 HE3 LYS 78 3HE LYS 78 -18.485 -11.917 4.327 627 HZ1 LYS 78 3HZ LYS 78 -20.500 -10.520 3.867 628 HZ2 LYS 78 1HZ LYS 78 -19.623 -9.774 2.627 629 HZ3 LYS 78 2HZ LYS 78 -19.091 -9.657 4.229 630 H GLU 79 H GLU 79 -15.282 -8.553 5.039 631 HA GLU 79 HA GLU 79 -14.116 -6.867 3.120 632 HB2 GLU 79 2HB GLU 79 -15.827 -6.538 5.499 633 HB3 GLU 79 3HB GLU 79 -14.868 -5.128 5.073 634 HG2 GLU 79 2HG GLU 79 -16.611 -4.644 3.758 635 HG3 GLU 79 3HG GLU 79 -15.854 -5.790 2.653 636 H ILE 80 H ILE 80 -13.356 -7.366 6.551 637 HA ILE 80 HA ILE 80 -11.234 -5.472 6.612 638 HB ILE 80 HB ILE 80 -11.740 -7.806 8.463 639 HG12 ILE 80 2HG1 ILE 80 -12.474 -4.911 8.897 640 HG13 ILE 80 3HG1 ILE 80 -13.593 -6.076 8.198 641 HG21 ILE 80 1HG2 ILE 80 -10.088 -5.316 8.873 642 HG22 ILE 80 2HG2 ILE 80 -10.366 -6.589 10.060 643 HG23 ILE 80 3HG2 ILE 80 -9.453 -6.937 8.592 644 HD11 ILE 80 3HD1 ILE 80 -14.201 -6.677 10.231 645 HD12 ILE 80 1HD1 ILE 80 -12.555 -7.220 10.559 646 HD13 ILE 80 2HD1 ILE 80 -13.027 -5.562 10.930 647 H ASP 81 H ASP 81 -11.223 -9.040 6.617 648 HA ASP 81 HA ASP 81 -8.498 -9.453 6.472 649 HB2 ASP 81 2HB ASP 81 -10.884 -11.009 5.595 650 HB3 ASP 81 3HB ASP 81 -9.303 -11.540 5.029 651 H MET 82 H MET 82 -10.767 -8.721 3.875 652 HA MET 82 HA MET 82 -8.949 -9.121 1.740 653 HB2 MET 82 2HB MET 82 -11.573 -7.706 2.035 654 HB3 MET 82 3HB MET 82 -10.636 -7.507 0.560 655 HG2 MET 82 2HG MET 82 -10.810 -9.774 0.007 656 HG3 MET 82 3HG MET 82 -11.328 -10.217 1.632 657 HE1 MET 82 3HE MET 82 -14.483 -11.102 -0.433 658 HE2 MET 82 1HE MET 82 -12.933 -11.048 -1.272 659 HE3 MET 82 2HE MET 82 -13.026 -11.693 0.367 660 H ALA 83 H ALA 83 -9.942 -6.236 3.548 661 HA ALA 83 HA ALA 83 -8.583 -4.298 2.112 662 HB1 ALA 83 1HB ALA 83 -10.054 -3.535 3.763 663 HB2 ALA 83 2HB ALA 83 -9.287 -4.504 5.022 664 HB3 ALA 83 3HB ALA 83 -8.455 -3.094 4.365 665 H ILE 84 H ILE 84 -7.391 -6.405 4.695 666 HA ILE 84 HA ILE 84 -4.818 -5.230 4.875 667 HB ILE 84 HB ILE 84 -5.681 -8.029 5.612 668 HG12 ILE 84 2HG1 ILE 84 -5.195 -6.077 7.744 669 HG13 ILE 84 3HG1 ILE 84 -6.542 -5.646 6.695 670 HG21 ILE 84 1HG2 ILE 84 -3.674 -7.637 7.251 671 HG22 ILE 84 2HG2 ILE 84 -3.393 -8.203 5.606 672 HG23 ILE 84 3HG2 ILE 84 -3.152 -6.503 6.006 673 HD11 ILE 84 3HD1 ILE 84 -7.617 -7.754 7.150 674 HD12 ILE 84 1HD1 ILE 84 -6.237 -8.282 8.112 675 HD13 ILE 84 2HD1 ILE 84 -7.234 -6.935 8.664 676 H VAL 85 H VAL 85 -6.034 -8.093 3.158 677 HA VAL 85 HA VAL 85 -3.625 -8.984 2.083 678 HB VAL 85 HB VAL 85 -6.359 -9.136 0.805 679 HG11 VAL 85 1HG1 VAL 85 -5.027 -11.384 0.061 680 HG12 VAL 85 2HG1 VAL 85 -5.160 -9.925 -0.923 681 HG13 VAL 85 3HG1 VAL 85 -3.724 -10.195 0.066 682 HG21 VAL 85 3HG2 VAL 85 -5.528 -11.582 1.992 683 HG22 VAL 85 1HG2 VAL 85 -5.366 -10.299 3.192 684 HG23 VAL 85 2HG2 VAL 85 -6.918 -10.576 2.401 685 H THR 86 H THR 86 -5.983 -6.697 0.729 686 HA THR 86 HA THR 86 -4.693 -6.230 -1.709 687 HB THR 86 HB THR 86 -5.922 -4.037 -1.710 688 HG1 THR 86 HG1 THR 86 -6.247 -3.392 0.312 689 HG21 THR 86 3HG2 THR 86 -7.612 -5.212 -2.561 690 HG22 THR 86 1HG2 THR 86 -8.117 -5.721 -0.951 691 HG23 THR 86 2HG2 THR 86 -6.923 -6.667 -1.841 692 H LEU 87 H LEU 87 -4.443 -4.483 1.379 693 HA LEU 87 HA LEU 87 -2.679 -2.488 0.567 694 HB2 LEU 87 2HB LEU 87 -3.332 -3.780 3.164 695 HB3 LEU 87 3HB LEU 87 -1.911 -2.742 3.083 696 HG LEU 87 HG LEU 87 -4.737 -1.907 2.431 697 HD11 LEU 87 1HD1 LEU 87 -4.894 -0.950 4.507 698 HD12 LEU 87 2HD1 LEU 87 -3.147 -0.840 4.713 699 HD13 LEU 87 3HD1 LEU 87 -3.959 -2.396 4.885 700 HD21 LEU 87 3HD2 LEU 87 -3.295 -0.593 1.109 701 HD22 LEU 87 1HD2 LEU 87 -2.112 -0.442 2.408 702 HD23 LEU 87 2HD2 LEU 87 -3.663 0.389 2.528 703 H LYS 88 H LYS 88 -2.085 -5.817 1.491 704 HA LYS 88 HA LYS 88 0.755 -5.561 1.666 705 HB2 LYS 88 2HB LYS 88 -1.175 -7.560 2.207 706 HB3 LYS 88 3HB LYS 88 -0.049 -8.244 1.042 707 HG2 LYS 88 2HG LYS 88 1.204 -8.750 2.811 708 HG3 LYS 88 3HG LYS 88 1.627 -7.037 2.838 709 HD2 LYS 88 2HD LYS 88 0.260 -6.588 4.615 710 HD3 LYS 88 3HD LYS 88 -0.876 -7.875 4.205 711 HE2 LYS 88 2HE LYS 88 1.417 -9.262 4.785 712 HE3 LYS 88 3HE LYS 88 1.483 -7.923 5.930 713 HZ1 LYS 88 3HZ LYS 88 -1.128 -8.900 5.918 714 HZ2 LYS 88 1HZ LYS 88 0.007 -8.979 7.170 715 HZ3 LYS 88 2HZ LYS 88 -0.100 -10.237 6.044 716 H VAL 89 H VAL 89 -1.238 -7.368 -0.681 717 HA VAL 89 HA VAL 89 0.718 -7.852 -2.563 718 HB VAL 89 HB VAL 89 -1.104 -8.001 -4.239 719 HG11 VAL 89 1HG1 VAL 89 -2.561 -9.587 -2.659 720 HG12 VAL 89 2HG1 VAL 89 -0.949 -10.025 -3.226 721 HG13 VAL 89 3HG1 VAL 89 -1.164 -9.355 -1.609 722 HG21 VAL 89 3HG2 VAL 89 -2.594 -6.284 -3.734 723 HG22 VAL 89 1HG2 VAL 89 -3.459 -7.735 -3.227 724 HG23 VAL 89 2HG2 VAL 89 -2.665 -6.717 -2.026 725 H PHE 90 H PHE 90 -1.239 -4.959 -2.112 726 HA PHE 90 HA PHE 90 -0.345 -3.675 -4.505 727 HB2 PHE 90 2HB PHE 90 -2.457 -2.990 -3.626 728 HB3 PHE 90 3HB PHE 90 -1.765 -2.663 -2.041 729 HD1 PHE 90 HD2 PHE 90 -0.944 -1.643 -5.539 730 HD2 PHE 90 HD1 PHE 90 -1.747 -0.434 -1.538 731 HE1 PHE 90 HE2 PHE 90 -0.593 0.706 -6.182 732 HE2 PHE 90 HE1 PHE 90 -1.398 1.917 -2.174 733 HZ PHE 90 HZ PHE 90 -0.819 2.489 -4.499 734 H ALA 91 H ALA 91 0.702 -3.741 -1.163 735 HA ALA 91 HA ALA 91 2.454 -1.528 -1.260 736 HB1 ALA 91 1HB ALA 91 1.766 -2.361 0.864 737 HB2 ALA 91 2HB ALA 91 2.419 -3.962 0.514 738 HB3 ALA 91 3HB ALA 91 3.510 -2.595 0.742 739 H VAL 92 H VAL 92 3.104 -5.023 -1.544 740 HA VAL 92 HA VAL 92 5.854 -4.687 -2.174 741 HB VAL 92 HB VAL 92 4.138 -7.081 -2.830 742 HG11 VAL 92 1HG1 VAL 92 6.578 -8.024 -2.133 743 HG12 VAL 92 2HG1 VAL 92 6.083 -7.683 -3.792 744 HG13 VAL 92 3HG1 VAL 92 7.018 -6.492 -2.887 745 HG21 VAL 92 3HG2 VAL 92 3.739 -7.034 -0.596 746 HG22 VAL 92 1HG2 VAL 92 5.327 -7.798 -0.548 747 HG23 VAL 92 2HG2 VAL 92 5.172 -6.067 -0.248 748 H ALA 93 H ALA 93 3.093 -5.682 -4.204 749 HA ALA 93 HA ALA 93 4.496 -5.606 -6.641 750 HB1 ALA 93 1HB ALA 93 1.546 -5.107 -6.435 751 HB2 ALA 93 2HB ALA 93 2.443 -5.959 -7.692 752 HB3 ALA 93 3HB ALA 93 2.236 -6.696 -6.103 753 H GLY 94 H GLY 94 3.346 -3.096 -4.646 754 HA2 GLY 94 2HA GLY 94 3.221 -1.169 -6.849 755 HA3 GLY 94 3HA GLY 94 2.740 -0.871 -5.186 756 H LEU 95 H LEU 95 4.563 -0.894 -3.570 757 HA LEU 95 HA LEU 95 6.467 1.038 -4.261 758 HB2 LEU 95 2HB LEU 95 6.233 -0.866 -1.955 759 HB3 LEU 95 3HB LEU 95 7.588 0.252 -2.093 760 HG LEU 95 HG LEU 95 5.972 1.192 -0.601 761 HD11 LEU 95 1HD1 LEU 95 7.097 2.596 -2.465 762 HD12 LEU 95 2HD1 LEU 95 5.794 3.307 -1.514 763 HD13 LEU 95 3HD1 LEU 95 5.469 2.695 -3.135 764 HD21 LEU 95 3HD2 LEU 95 3.698 1.382 -0.995 765 HD22 LEU 95 1HD2 LEU 95 4.076 -0.191 -1.699 766 HD23 LEU 95 2HD2 LEU 95 3.881 1.218 -2.742 767 H LEU 96 H LEU 96 6.783 -2.477 -3.890 768 HA LEU 96 HA LEU 96 9.554 -2.401 -4.742 769 HB2 LEU 96 2HB LEU 96 7.824 -4.259 -3.383 770 HB3 LEU 96 3HB LEU 96 8.661 -5.053 -4.714 771 HG LEU 96 HG LEU 96 10.347 -3.417 -2.928 772 HD11 LEU 96 1HD1 LEU 96 8.543 -4.788 -1.564 773 HD12 LEU 96 2HD1 LEU 96 10.225 -4.690 -1.045 774 HD13 LEU 96 3HD1 LEU 96 9.651 -6.116 -1.909 775 HD21 LEU 96 3HD2 LEU 96 11.069 -6.183 -3.403 776 HD22 LEU 96 1HD2 LEU 96 11.942 -4.703 -3.799 777 HD23 LEU 96 2HD2 LEU 96 10.714 -5.323 -4.902 778 H ASN 97 H ASN 97 6.686 -2.217 -6.313 779 HA ASN 97 HA ASN 97 5.954 -2.639 -8.430 780 HB2 ASN 97 2HB ASN 97 8.900 -2.683 -9.110 781 HB3 ASN 97 3HB ASN 97 7.565 -2.294 -10.192 782 HD21 ASN 97 1HD2 ASN 97 6.768 -0.265 -10.236 783 HD22 ASN 97 2HD2 ASN 97 7.383 1.040 -9.285 784 H MET 98 H MET 98 6.507 -4.946 -6.704 785 HA MET 98 HA MET 98 7.711 -7.043 -8.143 786 HB2 MET 98 2HB MET 98 6.226 -6.729 -5.689 787 HB3 MET 98 3HB MET 98 5.700 -8.176 -6.540 788 HG2 MET 98 2HG MET 98 8.614 -7.746 -6.311 789 HG3 MET 98 3HG MET 98 7.743 -8.149 -4.833 790 HE1 MET 98 3HE MET 98 9.924 -10.133 -5.487 791 HE2 MET 98 1HE MET 98 9.650 -11.302 -6.779 792 HE3 MET 98 2HE MET 98 9.948 -9.608 -7.172 793 H THR 99 H THR 99 6.172 -9.115 -8.515 794 HA THR 99 HA THR 99 3.866 -8.277 -10.129 795 HB THR 99 HB THR 99 5.630 -10.446 -11.188 796 HG1 THR 99 HG1 THR 99 6.142 -7.667 -11.262 797 HG21 THR 99 3HG2 THR 99 4.769 -9.083 -13.318 798 HG22 THR 99 1HG2 THR 99 3.502 -8.631 -12.179 799 HG23 THR 99 2HG2 THR 99 3.798 -10.332 -12.539 800 H VAL 100 H VAL 100 3.557 -9.294 -7.638 801 HA VAL 100 HA VAL 100 3.256 -12.155 -7.684 802 HB VAL 100 HB VAL 100 2.132 -11.825 -5.477 803 HG11 VAL 100 1HG1 VAL 100 4.459 -12.265 -5.446 804 HG12 VAL 100 2HG1 VAL 100 4.848 -10.617 -5.945 805 HG13 VAL 100 3HG1 VAL 100 4.192 -10.921 -4.336 806 HG21 VAL 100 3HG2 VAL 100 1.318 -9.840 -4.903 807 HG22 VAL 100 1HG2 VAL 100 2.933 -9.138 -4.992 808 HG23 VAL 100 2HG2 VAL 100 1.903 -9.164 -6.423 809 H SER 101 H SER 101 1.601 -13.224 -8.523 810 HA SER 101 HA SER 101 -0.888 -11.774 -9.079 811 HB2 SER 101 2HB SER 101 0.445 -14.161 -10.302 812 HB3 SER 101 3HB SER 101 -1.302 -13.978 -10.456 813 HG SER 101 HG SER 101 -0.129 -13.011 -12.193 814 H THR 102 H THR 102 0.118 -13.189 -6.518 815 HA THR 102 HA THR 102 -2.460 -14.403 -5.899 816 HB THR 102 HB THR 102 -1.568 -16.418 -4.978 817 HG1 THR 102 HG1 THR 102 1.054 -15.803 -5.802 818 HG21 THR 102 3HG2 THR 102 -0.117 -16.079 -7.595 819 HG22 THR 102 1HG2 THR 102 -1.867 -16.259 -7.491 820 HG23 THR 102 2HG2 THR 102 -0.812 -17.551 -6.919 821 H ALA 103 H ALA 103 -3.162 -13.762 -3.965 822 HA ALA 103 HA ALA 103 -1.892 -11.884 -2.393 823 HB1 ALA 103 1HB ALA 103 -4.185 -12.082 -2.062 824 HB2 ALA 103 2HB ALA 103 -4.098 -13.826 -1.813 825 HB3 ALA 103 3HB ALA 103 -3.503 -12.727 -0.569 826 H ALA 104 H ALA 104 -1.592 -15.358 -2.339 827 HA ALA 104 HA ALA 104 -0.366 -15.578 0.215 828 HB1 ALA 104 1HB ALA 104 -1.004 -17.657 -0.323 829 HB2 ALA 104 2HB ALA 104 -0.910 -17.344 -2.056 830 HB3 ALA 104 3HB ALA 104 0.549 -17.750 -1.154 831 H ALA 105 H ALA 105 0.883 -15.197 -3.069 832 HA ALA 105 HA ALA 105 3.615 -15.530 -2.433 833 HB1 ALA 105 1HB ALA 105 2.766 -15.711 -4.715 834 HB2 ALA 105 2HB ALA 105 2.373 -13.991 -4.711 835 HB3 ALA 105 3HB ALA 105 4.055 -14.512 -4.607 836 H ALA 106 H ALA 106 1.512 -12.693 -2.552 837 HA ALA 106 HA ALA 106 3.505 -10.739 -2.198 838 HB1 ALA 106 1HB ALA 106 0.554 -10.829 -1.845 839 HB2 ALA 106 2HB ALA 106 1.442 -9.471 -1.153 840 HB3 ALA 106 3HB ALA 106 1.539 -9.798 -2.884 841 H GLU 107 H GLU 107 1.293 -12.195 0.195 842 HA GLU 107 HA GLU 107 2.368 -10.946 2.449 843 HB2 GLU 107 2HB GLU 107 0.205 -12.213 2.340 844 HB3 GLU 107 3HB GLU 107 1.136 -13.703 2.364 845 HG2 GLU 107 2HG GLU 107 2.015 -12.096 4.525 846 HG3 GLU 107 3HG GLU 107 0.252 -12.126 4.545 847 H ASN 108 H ASN 108 3.353 -13.845 0.736 848 HA ASN 108 HA ASN 108 5.114 -14.884 2.665 849 HB2 ASN 108 2HB ASN 108 4.428 -16.264 0.818 850 HB3 ASN 108 3HB ASN 108 5.098 -15.126 -0.348 851 HD21 ASN 108 1HD2 ASN 108 7.071 -15.496 -1.071 852 HD22 ASN 108 2HD2 ASN 108 8.223 -16.569 -0.359 853 H MET 109 H MET 109 5.758 -12.806 -0.157 854 HA MET 109 HA MET 109 8.513 -12.467 0.415 855 HB2 MET 109 2HB MET 109 6.830 -11.834 -1.689 856 HB3 MET 109 3HB MET 109 7.283 -10.261 -1.049 857 HG2 MET 109 2HG MET 109 9.219 -12.416 -1.862 858 HG3 MET 109 3HG MET 109 8.760 -11.034 -2.854 859 HE1 MET 109 3HE MET 109 8.989 -8.382 -0.645 860 HE2 MET 109 1HE MET 109 10.476 -8.085 -1.546 861 HE3 MET 109 2HE MET 109 9.066 -8.756 -2.368 862 H TYR 110 H TYR 110 5.615 -10.748 1.370 863 HA TYR 110 HA TYR 110 6.820 -8.400 2.340 864 HB2 TYR 110 2HB TYR 110 4.295 -9.039 1.975 865 HB3 TYR 110 3HB TYR 110 4.388 -9.543 3.659 866 HD1 TYR 110 HD2 TYR 110 5.655 -6.617 1.696 867 HD2 TYR 110 HD1 TYR 110 3.497 -7.986 5.098 868 HE1 TYR 110 HE2 TYR 110 5.307 -4.288 2.405 869 HE2 TYR 110 HE1 TYR 110 3.141 -5.660 5.815 870 HH TYR 110 HH TYR 110 4.117 -2.946 3.799 871 H SER 111 H SER 111 6.255 -11.545 3.813 872 HA SER 111 HA SER 111 7.150 -10.693 6.418 873 HB2 SER 111 2HB SER 111 6.811 -12.990 7.090 874 HB3 SER 111 3HB SER 111 5.451 -12.503 6.079 875 HG SER 111 HG SER 111 6.527 -13.548 4.321 876 H GLN 112 H GLN 112 8.444 -12.684 3.783 877 HA GLN 112 HA GLN 112 10.816 -13.498 4.964 878 HB2 GLN 112 2HB GLN 112 9.925 -14.272 2.759 879 HB3 GLN 112 3HB GLN 112 10.459 -12.750 2.058 880 HG2 GLN 112 2HG GLN 112 12.770 -13.457 3.072 881 HG3 GLN 112 3HG GLN 112 12.060 -15.069 3.005 882 HE21 GLN 112 1HE2 GLN 112 14.000 -15.228 1.525 883 HE22 GLN 112 2HE2 GLN 112 13.721 -14.907 -0.149 884 H MET 113 H MET 113 9.983 -10.432 3.475 885 HA MET 113 HA MET 113 12.665 -9.417 3.493 886 HB2 MET 113 2HB MET 113 9.972 -8.363 2.818 887 HB3 MET 113 3HB MET 113 11.199 -7.185 3.264 888 HG2 MET 113 2HG MET 113 11.585 -9.260 1.125 889 HG3 MET 113 3HG MET 113 10.981 -7.634 0.817 890 HE1 MET 113 3HE MET 113 13.763 -5.304 1.611 891 HE2 MET 113 1HE MET 113 13.071 -5.672 0.031 892 HE3 MET 113 2HE MET 113 12.033 -5.610 1.456 893 H GLY 114 H GLY 114 10.005 -9.495 5.725 894 HA2 GLY 114 2HA GLY 114 10.451 -9.232 8.078 895 HA3 GLY 114 3HA GLY 114 11.676 -8.041 7.667 896 H LEU 115 H LEU 115 8.625 -7.966 6.032 897 HA LEU 115 HA LEU 115 7.996 -5.459 7.423 898 HB2 LEU 115 2HB LEU 115 6.790 -6.485 4.865 899 HB3 LEU 115 3HB LEU 115 6.693 -4.852 5.522 900 HG LEU 115 HG LEU 115 9.321 -6.045 4.698 901 HD11 LEU 115 1HD1 LEU 115 9.057 -5.064 2.508 902 HD12 LEU 115 2HD1 LEU 115 7.439 -4.498 2.922 903 HD13 LEU 115 3HD1 LEU 115 7.762 -6.227 2.796 904 HD21 LEU 115 3HD2 LEU 115 9.893 -4.114 5.707 905 HD22 LEU 115 1HD2 LEU 115 8.285 -3.414 5.521 906 HD23 LEU 115 2HD2 LEU 115 9.413 -3.402 4.165 907 H ASP 116 H ASP 116 6.835 -8.669 6.813 908 HA ASP 116 HA ASP 116 4.164 -8.114 7.786 909 HB2 ASP 116 2HB ASP 116 4.941 -9.903 6.019 910 HB3 ASP 116 3HB ASP 116 5.235 -10.888 7.449 911 H THR 117 H THR 117 3.256 -9.442 9.578 912 HA THR 117 HA THR 117 5.222 -10.112 11.648 913 HB THR 117 HB THR 117 2.772 -8.582 12.445 914 HG1 THR 117 HG1 THR 117 5.259 -7.397 11.708 915 HG21 THR 117 3HG2 THR 117 5.092 -7.920 13.925 916 HG22 THR 117 1HG2 THR 117 5.073 -9.673 13.737 917 HG23 THR 117 2HG2 THR 117 3.690 -8.849 14.456 918 H ARG 118 H ARG 118 3.594 -11.779 9.951 919 HA ARG 118 HA ARG 118 2.138 -13.214 12.045 920 HB2 ARG 118 2HB ARG 118 1.011 -12.337 9.396 921 HB3 ARG 118 3HB ARG 118 0.367 -13.735 10.247 922 HG2 ARG 118 2HG ARG 118 0.623 -11.156 11.710 923 HG3 ARG 118 3HG ARG 118 -0.692 -11.363 10.552 924 HD2 ARG 118 2HD ARG 118 -1.808 -12.765 11.898 925 HD3 ARG 118 3HD ARG 118 -0.344 -13.637 12.352 926 HE ARG 118 HE ARG 118 -0.528 -11.051 13.570 927 HH11 ARG 118 1HH1 ARG 118 -1.527 -14.377 13.808 928 HH12 ARG 118 2HH1 ARG 118 -1.772 -14.317 15.522 929 HH21 ARG 118 1HH2 ARG 118 -0.847 -10.959 15.826 930 HH22 ARG 118 2HH2 ARG 118 -1.386 -12.372 16.669 931 HA PRO 119 HA PRO 119 4.951 -15.909 9.511 932 HB2 PRO 119 2HB PRO 119 6.097 -17.127 11.649 933 HB3 PRO 119 3HB PRO 119 6.693 -15.605 10.978 934 HG2 PRO 119 2HG PRO 119 4.940 -16.067 13.360 935 HG3 PRO 119 3HG PRO 119 6.309 -14.955 13.177 936 HD2 PRO 119 2HD PRO 119 3.734 -14.136 13.000 937 HD3 PRO 119 3HD PRO 119 5.044 -13.378 12.071 938 H SER 120 H SER 120 3.087 -17.049 8.813 939 HA SER 120 HA SER 120 2.790 -19.629 9.973 940 HB2 SER 120 2HB SER 120 1.292 -17.917 11.347 941 HB3 SER 120 3HB SER 120 0.186 -18.167 9.997 942 HG SER 120 HG SER 120 -0.365 -19.824 11.208 943 H MET 121 H MET 121 1.226 -20.973 8.762 944 HA MET 121 HA MET 121 0.486 -19.884 6.146 945 HB2 MET 121 2HB MET 121 2.153 -22.360 6.600 946 HB3 MET 121 3HB MET 121 1.360 -21.988 5.075 947 HG2 MET 121 2HG MET 121 3.025 -20.671 4.467 948 HG3 MET 121 3HG MET 121 2.880 -19.728 5.949 949 HE1 MET 121 3HE MET 121 5.274 -19.136 6.252 950 HE2 MET 121 1HE MET 121 6.641 -20.250 6.222 951 HE3 MET 121 2HE MET 121 5.762 -19.894 4.735 952 H LYS 122 H LYS 122 -1.515 -20.441 5.590 953 HA LYS 122 HA LYS 122 -3.168 -21.983 7.259 954 HB2 LYS 122 2HB LYS 122 -4.877 -21.686 5.594 955 HB3 LYS 122 3HB LYS 122 -3.951 -20.195 5.705 956 HG2 LYS 122 2HG LYS 122 -2.655 -20.937 3.708 957 HG3 LYS 122 3HG LYS 122 -3.768 -22.299 3.562 958 HD2 LYS 122 2HD LYS 122 -5.389 -21.021 2.684 959 HD3 LYS 122 3HD LYS 122 -5.104 -19.713 3.834 960 HE2 LYS 122 2HE LYS 122 -3.042 -20.129 1.755 961 HE3 LYS 122 3HE LYS 122 -4.597 -19.503 1.210 962 HZ1 LYS 122 3HZ LYS 122 -3.189 -17.673 1.733 963 HZ2 LYS 122 1HZ LYS 122 -2.810 -18.308 3.254 964 HZ3 LYS 122 2HZ LYS 122 -4.376 -17.756 2.935 965 H GLU 123 H GLU 123 -4.555 -23.830 6.274 966 HA GLU 123 HA GLU 123 -2.688 -25.815 5.162 967 HB2 GLU 123 2HB GLU 123 -5.101 -26.129 6.944 968 HB3 GLU 123 3HB GLU 123 -4.326 -27.488 6.141 969 HG2 GLU 123 2HG GLU 123 -2.183 -26.737 7.279 970 HG3 GLU 123 3HG GLU 123 -3.206 -25.697 8.269 971 H ALA 124 H ALA 124 -4.132 -27.717 4.144 972 HA ALA 124 HA ALA 124 -6.119 -26.503 2.350 973 HB1 ALA 124 1HB ALA 124 -4.639 -28.517 0.950 974 HB2 ALA 124 2HB ALA 124 -4.878 -26.818 0.539 975 HB3 ALA 124 3HB ALA 124 -3.536 -27.293 1.581 976 H GLY 125 H GLY 125 -7.925 -27.677 2.094 977 HA2 GLY 125 2HA GLY 125 -9.123 -29.713 1.802 978 HA3 GLY 125 3HA GLY 125 -7.846 -30.555 2.668 979 H GLY 126 H GLY 126 -10.428 -31.074 3.331 980 HA2 GLY 126 2HA GLY 126 -10.802 -31.253 5.866 981 HA3 GLY 126 3HA GLY 126 -10.926 -29.503 5.773 982 H LYS 127 H LYS 127 -12.377 -29.222 3.421 983 HA LYS 127 HA LYS 127 -14.958 -30.389 4.222 984 HB2 LYS 127 2HB LYS 127 -14.217 -27.757 2.983 985 HB3 LYS 127 3HB LYS 127 -15.840 -28.405 2.785 986 HG2 LYS 127 2HG LYS 127 -15.243 -28.613 5.520 987 HG3 LYS 127 3HG LYS 127 -14.703 -27.012 5.009 988 HD2 LYS 127 2HD LYS 127 -17.431 -28.136 4.393 989 HD3 LYS 127 3HD LYS 127 -17.082 -27.123 5.796 990 HE2 LYS 127 2HE LYS 127 -16.153 -26.062 3.215 991 HE3 LYS 127 3HE LYS 127 -17.903 -26.185 3.389 992 HZ1 LYS 127 3HZ LYS 127 -17.826 -24.834 5.334 993 HZ2 LYS 127 1HZ LYS 127 -16.959 -24.032 4.123 994 HZ3 LYS 127 2HZ LYS 127 -16.135 -24.842 5.358 995 H GLU 128 H GLU 128 -16.179 -31.490 2.771 996 HA GLU 128 HA GLU 128 -14.953 -32.629 0.515 997 HB2 GLU 128 2HB GLU 128 -17.126 -33.255 1.984 998 HB3 GLU 128 3HB GLU 128 -17.913 -32.548 0.580 999 HG2 GLU 128 2HG GLU 128 -16.034 -34.225 -0.529 1000 HG3 GLU 128 3HG GLU 128 -16.595 -35.115 0.885 1001 H GLU 129 H GLU 129 -14.476 -31.667 -1.337 1002 HA GLU 129 HA GLU 129 -15.605 -29.188 -2.143 1003 HB2 GLU 129 2HB GLU 129 -14.325 -29.593 -4.261 1004 HB3 GLU 129 3HB GLU 129 -13.357 -29.673 -2.795 1005 HG2 GLU 129 2HG GLU 129 -14.479 -32.230 -3.722 1006 HG3 GLU 129 3HG GLU 129 -13.263 -31.497 -4.767 1007 H GLY 130 H GLY 130 -16.827 -28.748 -4.063 1008 HA2 GLY 130 2HA GLY 130 -18.135 -30.915 -5.447 1009 HA3 GLY 130 3HA GLY 130 -19.194 -30.044 -4.348 1010 HA PRO 131 HA PRO 131 -17.798 -26.882 -7.747 1011 HB2 PRO 131 2HB PRO 131 -16.571 -27.941 -9.925 1012 HB3 PRO 131 3HB PRO 131 -15.685 -27.372 -8.506 1013 HG2 PRO 131 2HG PRO 131 -16.462 -30.163 -9.261 1014 HG3 PRO 131 3HG PRO 131 -14.926 -29.568 -8.605 1015 HD2 PRO 131 2HD PRO 131 -16.788 -30.796 -7.070 1016 HD3 PRO 131 3HD PRO 131 -15.723 -29.521 -6.443 1017 HA PRO 132 HA PRO 132 -21.256 -27.563 -10.376 1018 HB2 PRO 132 2HB PRO 132 -20.710 -25.978 -12.511 1019 HB3 PRO 132 3HB PRO 132 -21.166 -25.335 -10.929 1020 HG2 PRO 132 2HG PRO 132 -18.446 -25.613 -12.148 1021 HG3 PRO 132 3HG PRO 132 -19.128 -24.256 -11.233 1022 HD2 PRO 132 2HD PRO 132 -17.449 -26.066 -10.120 1023 HD3 PRO 132 3HD PRO 132 -18.741 -25.269 -9.199 1024 H GLN 133 H GLN 133 -21.825 -27.983 -12.802 1025 HA GLN 133 HA GLN 133 -20.162 -30.225 -13.650 1026 HB2 GLN 133 2HB GLN 133 -22.038 -30.924 -14.980 1027 HB3 GLN 133 3HB GLN 133 -22.625 -30.505 -13.376 1028 HG2 GLN 133 2HG GLN 133 -23.015 -28.159 -14.534 1029 HG3 GLN 133 3HG GLN 133 -23.084 -29.166 -15.980 1030 HE21 GLN 133 1HE2 GLN 133 -25.034 -29.808 -16.508 1031 HE22 GLN 133 2HE2 GLN 133 -26.353 -30.077 -15.425 1032 H ALA 134 H ALA 134 -19.462 -30.488 -15.815 1033 HA ALA 134 HA ALA 134 -19.559 -28.124 -17.536 1034 HB1 ALA 134 1HB ALA 134 -17.481 -28.089 -16.073 1035 HB2 ALA 134 2HB ALA 134 -16.937 -29.489 -16.999 1036 HB3 ALA 134 3HB ALA 134 -17.230 -27.953 -17.814 1037 H TYR 135 H TYR 135 -21.076 -29.795 -18.488 1038 HA TYR 135 HA TYR 135 -21.589 -31.262 -20.148 1039 HB2 TYR 135 2HB TYR 135 -20.064 -29.710 -21.409 1040 HB3 TYR 135 3HB TYR 135 -18.749 -30.835 -21.089 1041 HD1 TYR 135 HD1 TYR 135 -21.936 -30.377 -22.882 1042 HD2 TYR 135 HD2 TYR 135 -18.538 -32.875 -22.321 1043 HE1 TYR 135 HE1 TYR 135 -22.555 -31.659 -24.888 1044 HE2 TYR 135 HE2 TYR 135 -19.146 -34.163 -24.326 1045 HH TYR 135 HH TYR 135 -21.988 -33.297 -26.274 Start of MODEL 13 1 H21 MYR 1 1H2 MYR 1 1.808 8.981 -10.283 2 H22 MYR 1 2H2 MYR 1 0.423 8.140 -9.615 3 H31 MYR 1 1H3 MYR 1 1.383 9.626 -7.376 4 H32 MYR 1 2H3 MYR 1 2.872 9.226 -8.234 5 H41 MYR 1 1H4 MYR 1 2.612 7.336 -6.826 6 H42 MYR 1 2H4 MYR 1 1.917 6.746 -8.338 7 H51 MYR 1 1H5 MYR 1 -0.391 7.169 -7.537 8 H52 MYR 1 2H5 MYR 1 0.198 8.034 -6.116 9 H61 MYR 1 1H6 MYR 1 -0.370 5.838 -5.302 10 H62 MYR 1 2H6 MYR 1 1.393 5.840 -5.389 11 H71 MYR 1 1H7 MYR 1 1.334 4.630 -7.586 12 H72 MYR 1 2H7 MYR 1 -0.428 4.727 -7.630 13 H81 MYR 1 1H8 MYR 1 0.282 2.472 -6.854 14 H82 MYR 1 2H8 MYR 1 -0.602 3.301 -5.571 15 H91 MYR 1 1H9 MYR 1 2.364 3.804 -5.499 16 H92 MYR 1 2H9 MYR 1 1.939 2.103 -5.305 17 H101 MYR 1 1H10 MYR 1 0.488 4.267 -3.678 18 H102 MYR 1 2H10 MYR 1 2.058 3.687 -3.146 19 H111 MYR 1 1H11 MYR 1 1.134 1.323 -3.018 20 H112 MYR 1 2H11 MYR 1 -0.401 1.894 -3.655 21 H121 MYR 1 1H12 MYR 1 -1.063 2.094 -1.473 22 H122 MYR 1 2H12 MYR 1 -0.149 3.603 -1.469 23 H131 MYR 1 1H13 MYR 1 0.590 2.321 0.475 24 H132 MYR 1 2H13 MYR 1 1.924 2.313 -0.681 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 -0.386 9.780 -11.456 29 HA2 GLY 2 2HA GLY 2 -2.180 11.541 -10.580 30 HA3 GLY 2 3HA GLY 2 -0.713 12.504 -10.474 31 H ASN 3 H ASN 3 -1.435 13.980 -12.023 32 HA ASN 3 HA ASN 3 -1.783 14.842 -14.103 33 HB2 ASN 3 2HB ASN 3 0.116 12.575 -14.697 34 HB3 ASN 3 3HB ASN 3 -0.415 13.705 -15.939 35 HD21 ASN 3 1HD2 ASN 3 1.030 15.203 -16.319 36 HD22 ASN 3 2HD2 ASN 3 2.058 15.955 -15.151 37 H GLY 4 H GLY 4 -3.728 12.924 -13.140 38 HA2 GLY 4 2HA GLY 4 -5.618 11.878 -13.918 39 HA3 GLY 4 3HA GLY 4 -5.268 12.610 -15.477 40 H ALA 5 H ALA 5 -3.480 10.207 -13.560 41 HA ALA 5 HA ALA 5 -4.048 8.163 -15.555 42 HB1 ALA 5 1HB ALA 5 -2.011 9.431 -16.312 43 HB2 ALA 5 2HB ALA 5 -1.191 8.820 -14.874 44 HB3 ALA 5 3HB ALA 5 -1.787 7.695 -16.095 45 H SER 6 H SER 6 -4.682 6.466 -14.411 46 HA SER 6 HA SER 6 -3.536 6.030 -11.744 47 HB2 SER 6 2HB SER 6 -6.118 5.201 -13.042 48 HB3 SER 6 3HB SER 6 -5.516 4.349 -11.620 49 HG SER 6 HG SER 6 -6.953 6.427 -11.518 50 H ARG 7 H ARG 7 -2.132 5.346 -14.204 51 HA ARG 7 HA ARG 7 -2.299 2.590 -14.763 52 HB2 ARG 7 2HB ARG 7 -0.080 2.866 -15.796 53 HB3 ARG 7 3HB ARG 7 -1.194 4.137 -16.282 54 HG2 ARG 7 2HG ARG 7 -0.152 5.579 -14.504 55 HG3 ARG 7 3HG ARG 7 1.080 4.328 -14.329 56 HD2 ARG 7 2HD ARG 7 0.512 5.300 -17.069 57 HD3 ARG 7 3HD ARG 7 1.351 6.405 -15.982 58 HE ARG 7 HE ARG 7 2.427 4.070 -17.219 59 HH11 ARG 7 1HH1 ARG 7 2.609 6.083 -14.385 60 HH12 ARG 7 2HH1 ARG 7 4.252 5.660 -14.030 61 HH21 ARG 7 1HH2 ARG 7 4.590 3.505 -16.762 62 HH22 ARG 7 2HH2 ARG 7 5.377 4.194 -15.383 63 H ASP 8 H ASP 8 -0.369 4.432 -12.450 64 HA ASP 8 HA ASP 8 1.312 2.372 -11.580 65 HB2 ASP 8 2HB ASP 8 0.301 4.890 -10.287 66 HB3 ASP 8 3HB ASP 8 1.320 3.765 -9.392 67 H TRP 9 H TRP 9 -1.948 3.272 -10.599 68 HA TRP 9 HA TRP 9 -2.080 1.470 -8.394 69 HB2 TRP 9 2HB TRP 9 -3.560 3.363 -8.419 70 HB3 TRP 9 3HB TRP 9 -4.225 2.890 -9.980 71 HD1 TRP 9 HD1 TRP 9 -6.285 1.317 -9.961 72 HE1 TRP 9 HE1 TRP 9 -7.637 0.131 -8.119 73 HE3 TRP 9 HE3 TRP 9 -3.194 2.205 -5.987 74 HZ2 TRP 9 HZ2 TRP 9 -7.421 -0.362 -5.349 75 HZ3 TRP 9 HZ3 TRP 9 -3.839 1.342 -3.775 76 HH2 TRP 9 HH2 TRP 9 -5.910 0.086 -3.465 77 H LYS 10 H LYS 10 -3.656 1.383 -11.597 78 HA LYS 10 HA LYS 10 -4.742 -1.153 -11.437 79 HB2 LYS 10 2HB LYS 10 -4.885 0.696 -13.294 80 HB3 LYS 10 3HB LYS 10 -3.560 -0.204 -14.021 81 HG2 LYS 10 2HG LYS 10 -4.867 -2.058 -14.432 82 HG3 LYS 10 3HG LYS 10 -6.044 -1.634 -13.186 83 HD2 LYS 10 2HD LYS 10 -6.838 0.222 -14.555 84 HD3 LYS 10 3HD LYS 10 -5.638 -0.162 -15.791 85 HE2 LYS 10 2HE LYS 10 -7.683 -2.164 -14.876 86 HE3 LYS 10 3HE LYS 10 -8.026 -1.000 -16.155 87 HZ1 LYS 10 3HZ LYS 10 -6.403 -3.381 -16.224 88 HZ2 LYS 10 1HZ LYS 10 -5.661 -2.032 -16.928 89 HZ3 LYS 10 2HZ LYS 10 -7.169 -2.556 -17.487 90 H MET 11 H MET 11 -1.451 -0.189 -12.180 91 HA MET 11 HA MET 11 -0.602 -2.788 -13.025 92 HB2 MET 11 2HB MET 11 0.473 -0.545 -13.614 93 HB3 MET 11 3HB MET 11 1.189 -0.588 -12.009 94 HG2 MET 11 2HG MET 11 2.846 -1.813 -12.795 95 HG3 MET 11 3HG MET 11 1.700 -3.087 -13.205 96 HE1 MET 11 3HE MET 11 3.612 -3.681 -14.664 97 HE2 MET 11 1HE MET 11 2.405 -4.001 -15.910 98 HE3 MET 11 2HE MET 11 3.853 -3.075 -16.304 99 H ALA 12 H ALA 12 0.011 -0.863 -10.086 100 HA ALA 12 HA ALA 12 1.454 -2.719 -8.643 101 HB1 ALA 12 1HB ALA 12 1.201 -0.456 -7.868 102 HB2 ALA 12 2HB ALA 12 -0.531 -0.688 -7.632 103 HB3 ALA 12 3HB ALA 12 0.621 -1.558 -6.619 104 H ILE 13 H ILE 13 -2.027 -2.496 -9.098 105 HA ILE 13 HA ILE 13 -2.603 -4.590 -7.203 106 HB ILE 13 HB ILE 13 -4.382 -3.303 -9.278 107 HG12 ILE 13 2HG1 ILE 13 -3.542 -1.757 -7.530 108 HG13 ILE 13 3HG1 ILE 13 -5.282 -2.005 -7.430 109 HG21 ILE 13 1HG2 ILE 13 -4.856 -5.391 -7.208 110 HG22 ILE 13 2HG2 ILE 13 -6.137 -4.233 -7.561 111 HG23 ILE 13 3HG2 ILE 13 -5.498 -5.259 -8.845 112 HD11 ILE 13 3HD1 ILE 13 -5.134 -2.781 -5.361 113 HD12 ILE 13 1HD1 ILE 13 -3.830 -3.889 -5.787 114 HD13 ILE 13 2HD1 ILE 13 -3.464 -2.215 -5.368 115 H LYS 14 H LYS 14 -2.136 -4.308 -10.660 116 HA LYS 14 HA LYS 14 -3.217 -6.770 -11.459 117 HB2 LYS 14 2HB LYS 14 -2.662 -5.063 -13.083 118 HB3 LYS 14 3HB LYS 14 -0.961 -5.144 -12.644 119 HG2 LYS 14 2HG LYS 14 -1.341 -6.292 -14.731 120 HG3 LYS 14 3HG LYS 14 -0.867 -7.448 -13.484 121 HD2 LYS 14 2HD LYS 14 -2.833 -8.531 -13.579 122 HD3 LYS 14 3HD LYS 14 -3.759 -7.032 -13.694 123 HE2 LYS 14 2HE LYS 14 -4.062 -8.315 -15.712 124 HE3 LYS 14 3HE LYS 14 -3.123 -6.868 -16.077 125 HZ1 LYS 14 3HZ LYS 14 -2.407 -9.240 -16.928 126 HZ2 LYS 14 1HZ LYS 14 -1.650 -9.303 -15.416 127 HZ3 LYS 14 2HZ LYS 14 -1.263 -8.068 -16.505 128 H ARG 15 H ARG 15 -0.105 -5.922 -10.088 129 HA ARG 15 HA ARG 15 0.975 -8.578 -10.527 130 HB2 ARG 15 2HB ARG 15 2.128 -6.249 -8.981 131 HB3 ARG 15 3HB ARG 15 2.983 -7.720 -9.426 132 HG2 ARG 15 2HG ARG 15 1.752 -6.129 -11.604 133 HG3 ARG 15 3HG ARG 15 3.199 -5.488 -10.824 134 HD2 ARG 15 2HD ARG 15 3.296 -8.340 -11.559 135 HD3 ARG 15 3HD ARG 15 3.234 -7.206 -12.908 136 HE ARG 15 HE ARG 15 5.175 -6.288 -11.142 137 HH11 ARG 15 1HH1 ARG 15 4.606 -9.053 -13.180 138 HH12 ARG 15 2HH1 ARG 15 6.288 -9.362 -13.453 139 HH21 ARG 15 1HH2 ARG 15 7.393 -6.684 -11.495 140 HH22 ARG 15 2HH2 ARG 15 7.873 -8.014 -12.493 141 H CYS 16 H CYS 16 0.224 -6.537 -7.701 142 HA CYS 16 HA CYS 16 0.695 -8.493 -5.755 143 HB2 CYS 16 2HB CYS 16 0.462 -6.062 -5.294 144 HB3 CYS 16 3HB CYS 16 -1.264 -6.193 -5.609 145 HG CYS 16 HG CYS 16 -0.052 -8.279 -3.261 146 H SER 17 H SER 17 -1.894 -8.110 -7.965 147 HA SER 17 HA SER 17 -4.062 -9.202 -6.656 148 HB2 SER 17 2HB SER 17 -4.715 -8.573 -8.744 149 HB3 SER 17 3HB SER 17 -3.179 -9.035 -9.476 150 HG SER 17 HG SER 17 -3.857 -11.122 -9.593 151 H ASN 18 H ASN 18 -1.195 -10.781 -7.859 152 HA ASN 18 HA ASN 18 -2.314 -13.427 -7.334 153 HB2 ASN 18 2HB ASN 18 -0.667 -12.588 -9.312 154 HB3 ASN 18 3HB ASN 18 0.520 -13.168 -8.147 155 HD21 ASN 18 1HD2 ASN 18 1.121 -14.855 -9.508 156 HD22 ASN 18 2HD2 ASN 18 0.121 -16.245 -9.737 157 H VAL 19 H VAL 19 -1.984 -11.754 -5.090 158 HA VAL 19 HA VAL 19 0.418 -12.718 -3.735 159 HB VAL 19 HB VAL 19 -0.255 -10.325 -3.530 160 HG11 VAL 19 1HG1 VAL 19 -2.138 -9.698 -2.172 161 HG12 VAL 19 2HG1 VAL 19 -2.701 -10.752 -3.470 162 HG13 VAL 19 3HG1 VAL 19 -2.511 -11.388 -1.836 163 HG21 VAL 19 3HG2 VAL 19 1.203 -10.972 -1.857 164 HG22 VAL 19 1HG2 VAL 19 -0.172 -10.375 -0.928 165 HG23 VAL 19 2HG2 VAL 19 0.055 -12.110 -1.152 166 H ALA 20 H ALA 20 0.418 -14.184 -2.115 167 HA ALA 20 HA ALA 20 -2.165 -15.431 -1.453 168 HB1 ALA 20 1HB ALA 20 -1.089 -17.483 -1.199 169 HB2 ALA 20 2HB ALA 20 -0.296 -16.766 -2.602 170 HB3 ALA 20 3HB ALA 20 0.500 -16.737 -1.029 171 H VAL 21 H VAL 21 -2.849 -15.520 0.609 172 HA VAL 21 HA VAL 21 -1.813 -13.838 2.568 173 HB VAL 21 HB VAL 21 -3.315 -14.901 4.135 174 HG11 VAL 21 1HG1 VAL 21 -4.998 -15.160 1.743 175 HG12 VAL 21 2HG1 VAL 21 -5.175 -14.110 3.150 176 HG13 VAL 21 3HG1 VAL 21 -4.077 -13.660 1.844 177 HG21 VAL 21 3HG2 VAL 21 -3.157 -17.156 2.200 178 HG22 VAL 21 1HG2 VAL 21 -3.148 -17.175 3.963 179 HG23 VAL 21 2HG2 VAL 21 -4.660 -16.920 3.092 180 H GLY 22 H GLY 22 -0.934 -17.077 1.713 181 HA2 GLY 22 2HA GLY 22 1.103 -17.030 3.833 182 HA3 GLY 22 3HA GLY 22 0.076 -18.447 3.668 183 H VAL 23 H VAL 23 2.750 -18.792 3.512 184 HA VAL 23 HA VAL 23 3.826 -18.595 0.898 185 HB VAL 23 HB VAL 23 5.598 -20.049 1.667 186 HG11 VAL 23 1HG1 VAL 23 5.273 -17.624 2.534 187 HG12 VAL 23 2HG1 VAL 23 4.948 -18.408 4.081 188 HG13 VAL 23 3HG1 VAL 23 6.499 -18.652 3.276 189 HG21 VAL 23 3HG2 VAL 23 5.233 -20.752 4.230 190 HG22 VAL 23 1HG2 VAL 23 3.567 -20.849 3.658 191 HG23 VAL 23 2HG2 VAL 23 4.826 -21.803 2.874 192 H GLY 24 H GLY 24 1.792 -20.931 2.478 193 HA2 GLY 24 2HA GLY 24 0.841 -22.149 0.210 194 HA3 GLY 24 3HA GLY 24 2.276 -23.069 0.635 195 H GLY 25 H GLY 25 0.584 -24.795 0.789 196 HA2 GLY 25 2HA GLY 25 -0.284 -26.332 2.306 197 HA3 GLY 25 3HA GLY 25 -0.115 -25.132 3.579 198 H LYS 26 H LYS 26 -1.954 -25.409 0.533 199 HA LYS 26 HA LYS 26 -4.133 -24.979 0.039 200 HB2 LYS 26 2HB LYS 26 -4.158 -26.796 2.029 201 HB3 LYS 26 3HB LYS 26 -5.049 -25.496 2.810 202 HG2 LYS 26 2HG LYS 26 -5.868 -26.226 0.062 203 HG3 LYS 26 3HG LYS 26 -6.228 -27.378 1.350 204 HD2 LYS 26 2HD LYS 26 -7.034 -25.088 2.521 205 HD3 LYS 26 3HD LYS 26 -7.349 -24.697 0.829 206 HE2 LYS 26 2HE LYS 26 -8.868 -26.449 0.584 207 HE3 LYS 26 3HE LYS 26 -8.261 -27.298 2.005 208 HZ1 LYS 26 3HZ LYS 26 -9.700 -24.704 2.108 209 HZ2 LYS 26 1HZ LYS 26 -9.251 -25.671 3.421 210 HZ3 LYS 26 2HZ LYS 26 -10.438 -26.208 2.343 211 H SER 27 H SER 27 -2.573 -22.760 0.844 212 HA SER 27 HA SER 27 -4.176 -21.140 2.620 213 HB2 SER 27 2HB SER 27 -1.644 -20.682 1.061 214 HB3 SER 27 3HB SER 27 -2.491 -19.337 1.824 215 HG SER 27 HG SER 27 -1.970 -21.619 3.354 216 H LYS 28 H LYS 28 -4.788 -18.888 1.883 217 HA LYS 28 HA LYS 28 -6.110 -19.089 -0.736 218 HB2 LYS 28 2HB LYS 28 -6.811 -17.161 1.474 219 HB3 LYS 28 3HB LYS 28 -7.782 -17.601 0.075 220 HG2 LYS 28 2HG LYS 28 -7.972 -19.896 0.986 221 HG3 LYS 28 3HG LYS 28 -7.109 -19.355 2.428 222 HD2 LYS 28 2HD LYS 28 -9.106 -17.477 2.149 223 HD3 LYS 28 3HD LYS 28 -9.897 -18.978 1.662 224 HE2 LYS 28 2HE LYS 28 -8.224 -19.131 4.085 225 HE3 LYS 28 3HE LYS 28 -9.680 -18.145 4.220 226 HZ1 LYS 28 3HZ LYS 28 -10.008 -20.501 4.836 227 HZ2 LYS 28 1HZ LYS 28 -9.653 -20.948 3.244 228 HZ3 LYS 28 2HZ LYS 28 -11.014 -20.000 3.572 229 H LYS 29 H LYS 29 -6.646 -16.662 -1.502 230 HA LYS 29 HA LYS 29 -4.150 -15.110 -1.369 231 HB2 LYS 29 2HB LYS 29 -5.749 -15.683 -3.871 232 HB3 LYS 29 3HB LYS 29 -4.341 -14.635 -3.776 233 HG2 LYS 29 2HG LYS 29 -3.121 -16.406 -4.312 234 HG3 LYS 29 3HG LYS 29 -3.470 -17.034 -2.700 235 HD2 LYS 29 2HD LYS 29 -5.522 -18.096 -3.626 236 HD3 LYS 29 3HD LYS 29 -5.018 -17.570 -5.234 237 HE2 LYS 29 2HE LYS 29 -4.345 -19.849 -4.944 238 HE3 LYS 29 3HE LYS 29 -2.900 -18.839 -4.913 239 HZ1 LYS 29 3HZ LYS 29 -2.536 -19.264 -2.730 240 HZ2 LYS 29 1HZ LYS 29 -3.340 -20.701 -3.119 241 HZ3 LYS 29 2HZ LYS 29 -4.175 -19.444 -2.356 242 H PHE 30 H PHE 30 -4.370 -12.853 -1.755 243 HA PHE 30 HA PHE 30 -6.989 -11.842 -0.974 244 HB2 PHE 30 2HB PHE 30 -4.237 -10.621 -1.075 245 HB3 PHE 30 3HB PHE 30 -5.676 -9.642 -0.811 246 HD1 PHE 30 HD2 PHE 30 -7.299 -11.236 0.955 247 HD2 PHE 30 HD1 PHE 30 -3.074 -10.725 0.905 248 HE1 PHE 30 HE2 PHE 30 -7.211 -11.756 3.358 249 HE2 PHE 30 HE1 PHE 30 -2.979 -11.245 3.308 250 HZ PHE 30 HZ PHE 30 -5.050 -11.761 4.537 251 H GLY 31 H GLY 31 -7.364 -9.491 -1.979 252 HA2 GLY 31 2HA GLY 31 -6.780 -9.452 -4.836 253 HA3 GLY 31 3HA GLY 31 -8.471 -9.619 -4.387 254 H GLU 32 H GLU 32 -8.174 -7.534 -5.834 255 HA GLU 32 HA GLU 32 -7.154 -5.173 -4.798 256 HB2 GLU 32 2HB GLU 32 -8.836 -4.032 -6.259 257 HB3 GLU 32 3HB GLU 32 -7.879 -5.257 -7.079 258 HG2 GLU 32 2HG GLU 32 -9.813 -6.843 -6.642 259 HG3 GLU 32 3HG GLU 32 -10.743 -5.411 -6.207 260 H GLY 33 H GLY 33 -10.370 -6.605 -4.353 261 HA2 GLY 33 2HA GLY 33 -11.473 -4.492 -2.846 262 HA3 GLY 33 3HA GLY 33 -12.037 -6.157 -2.840 263 H ASN 34 H ASN 34 -9.609 -7.331 -1.889 264 HA ASN 34 HA ASN 34 -10.025 -7.113 0.886 265 HB2 ASN 34 2HB ASN 34 -8.762 -8.910 -0.741 266 HB3 ASN 34 3HB ASN 34 -7.393 -8.136 0.052 267 HD21 ASN 34 1HD2 ASN 34 -7.563 -7.968 2.450 268 HD22 ASN 34 2HD2 ASN 34 -8.239 -9.316 3.293 269 H PHE 35 H PHE 35 -7.464 -5.838 -1.213 270 HA PHE 35 HA PHE 35 -5.898 -4.672 0.799 271 HB2 PHE 35 2HB PHE 35 -6.199 -3.595 -2.005 272 HB3 PHE 35 3HB PHE 35 -4.799 -3.465 -0.946 273 HD1 PHE 35 HD1 PHE 35 -4.531 -6.220 0.028 274 HD2 PHE 35 HD2 PHE 35 -5.440 -4.750 -3.862 275 HE1 PHE 35 HE1 PHE 35 -3.592 -8.267 -0.962 276 HE2 PHE 35 HE2 PHE 35 -4.504 -6.795 -4.858 277 HZ PHE 35 HZ PHE 35 -3.579 -8.558 -3.407 278 H ARG 36 H ARG 36 -8.575 -3.368 -1.116 279 HA ARG 36 HA ARG 36 -8.470 -0.724 -0.235 280 HB2 ARG 36 2HB ARG 36 -10.962 -2.294 -0.916 281 HB3 ARG 36 3HB ARG 36 -10.780 -0.545 -0.953 282 HG2 ARG 36 2HG ARG 36 -8.767 -1.711 -2.598 283 HG3 ARG 36 3HG ARG 36 -10.336 -2.393 -3.032 284 HD2 ARG 36 2HD ARG 36 -11.157 0.051 -2.997 285 HD3 ARG 36 3HD ARG 36 -9.446 0.469 -3.068 286 HE ARG 36 HE ARG 36 -9.435 -0.136 -5.271 287 HH11 ARG 36 1HH1 ARG 36 -12.251 -1.496 -3.742 288 HH12 ARG 36 2HH1 ARG 36 -12.935 -2.078 -5.224 289 HH21 ARG 36 1HH2 ARG 36 -10.324 -0.898 -7.228 290 HH22 ARG 36 2HH2 ARG 36 -11.838 -1.738 -7.206 291 H TRP 37 H TRP 37 -10.244 -3.492 1.109 292 HA TRP 37 HA TRP 37 -11.559 -2.154 3.171 293 HB2 TRP 37 2HB TRP 37 -12.188 -4.404 2.630 294 HB3 TRP 37 3HB TRP 37 -10.570 -5.002 2.984 295 HD1 TRP 37 HD1 TRP 37 -13.826 -3.989 4.676 296 HE1 TRP 37 HE1 TRP 37 -13.739 -4.705 7.147 297 HE3 TRP 37 HE3 TRP 37 -8.920 -5.405 4.940 298 HZ2 TRP 37 HZ2 TRP 37 -11.842 -5.733 8.968 299 HZ3 TRP 37 HZ3 TRP 37 -8.048 -6.243 7.083 300 HH2 TRP 37 HH2 TRP 37 -9.480 -6.402 9.054 301 H ALA 38 H ALA 38 -8.399 -3.785 3.196 302 HA ALA 38 HA ALA 38 -7.794 -3.241 5.895 303 HB1 ALA 38 1HB ALA 38 -6.130 -3.963 3.510 304 HB2 ALA 38 2HB ALA 38 -5.384 -3.594 5.066 305 HB3 ALA 38 3HB ALA 38 -6.522 -4.934 4.930 306 H ILE 39 H ILE 39 -6.769 -1.590 2.908 307 HA ILE 39 HA ILE 39 -5.244 0.419 4.074 308 HB ILE 39 HB ILE 39 -6.927 0.597 1.572 309 HG12 ILE 39 2HG1 ILE 39 -3.966 0.188 1.591 310 HG13 ILE 39 3HG1 ILE 39 -5.009 -1.191 1.919 311 HG21 ILE 39 1HG2 ILE 39 -6.307 2.723 1.442 312 HG22 ILE 39 2HG2 ILE 39 -5.399 2.577 2.946 313 HG23 ILE 39 3HG2 ILE 39 -4.620 2.210 1.407 314 HD11 ILE 39 3HD1 ILE 39 -5.124 -1.475 -0.273 315 HD12 ILE 39 1HD1 ILE 39 -6.119 -0.020 -0.329 316 HD13 ILE 39 2HD1 ILE 39 -4.377 0.092 -0.584 317 H ARG 40 H ARG 40 -8.667 0.584 3.083 318 HA ARG 40 HA ARG 40 -9.240 3.137 3.958 319 HB2 ARG 40 2HB ARG 40 -10.865 1.952 2.674 320 HB3 ARG 40 3HB ARG 40 -10.968 0.668 3.871 321 HG2 ARG 40 2HG ARG 40 -11.627 3.335 4.890 322 HG3 ARG 40 3HG ARG 40 -12.719 2.723 3.646 323 HD2 ARG 40 2HD ARG 40 -11.931 0.931 5.894 324 HD3 ARG 40 3HD ARG 40 -13.127 2.193 6.186 325 HE ARG 40 HE ARG 40 -13.905 0.843 3.888 326 HH11 ARG 40 1HH1 ARG 40 -13.452 0.159 7.271 327 HH12 ARG 40 2HH1 ARG 40 -14.663 -1.079 7.317 328 HH21 ARG 40 1HH2 ARG 40 -15.502 -0.785 3.935 329 HH22 ARG 40 2HH2 ARG 40 -15.828 -1.616 5.419 330 H MET 41 H MET 41 -9.482 0.104 5.801 331 HA MET 41 HA MET 41 -10.479 1.079 8.178 332 HB2 MET 41 2HB MET 41 -9.934 -1.338 7.509 333 HB3 MET 41 3HB MET 41 -8.308 -1.005 8.090 334 HG2 MET 41 2HG MET 41 -9.205 -1.897 9.971 335 HG3 MET 41 3HG MET 41 -9.607 -0.202 10.234 336 HE1 MET 41 3HE MET 41 -12.429 -2.332 11.754 337 HE2 MET 41 1HE MET 41 -10.822 -1.642 11.979 338 HE3 MET 41 2HE MET 41 -12.219 -0.581 11.801 339 H ALA 42 H ALA 42 -7.080 0.902 7.158 340 HA ALA 42 HA ALA 42 -6.079 2.105 9.547 341 HB1 ALA 42 1HB ALA 42 -4.436 2.274 7.107 342 HB2 ALA 42 2HB ALA 42 -4.031 1.666 8.713 343 HB3 ALA 42 3HB ALA 42 -4.935 0.652 7.588 344 H ASN 43 H ASN 43 -7.249 3.295 6.495 345 HA ASN 43 HA ASN 43 -6.070 5.843 6.502 346 HB2 ASN 43 2HB ASN 43 -8.256 4.501 5.087 347 HB3 ASN 43 3HB ASN 43 -8.512 6.232 5.286 348 HD21 ASN 43 1HD2 ASN 43 -8.358 6.087 2.901 349 HD22 ASN 43 2HD2 ASN 43 -6.791 6.223 2.187 350 H VAL 44 H VAL 44 -8.947 4.584 8.075 351 HA VAL 44 HA VAL 44 -9.563 7.236 9.160 352 HB VAL 44 HB VAL 44 -11.442 5.993 8.205 353 HG11 VAL 44 1HG1 VAL 44 -10.919 3.957 10.368 354 HG12 VAL 44 2HG1 VAL 44 -12.248 3.937 9.208 355 HG13 VAL 44 3HG1 VAL 44 -10.587 3.728 8.651 356 HG21 VAL 44 3HG2 VAL 44 -11.359 7.257 10.672 357 HG22 VAL 44 1HG2 VAL 44 -12.799 6.910 9.715 358 HG23 VAL 44 2HG2 VAL 44 -12.281 5.783 10.970 359 H SER 45 H SER 45 -8.610 3.993 10.130 360 HA SER 45 HA SER 45 -8.940 4.153 12.873 361 HB2 SER 45 2HB SER 45 -8.294 2.080 11.760 362 HB3 SER 45 3HB SER 45 -6.730 2.772 11.329 363 HG SER 45 HG SER 45 -7.674 2.369 13.977 364 H THR 46 H THR 46 -6.230 5.268 10.888 365 HA THR 46 HA THR 46 -5.202 6.716 13.242 366 HB THR 46 HB THR 46 -2.964 6.617 12.220 367 HG1 THR 46 HG1 THR 46 -3.902 4.688 10.390 368 HG21 THR 46 3HG2 THR 46 -2.771 4.829 13.538 369 HG22 THR 46 1HG2 THR 46 -3.193 3.828 12.149 370 HG23 THR 46 2HG2 THR 46 -4.451 4.375 13.257 371 H GLY 47 H GLY 47 -7.161 7.474 11.059 372 HA2 GLY 47 2HA GLY 47 -5.905 10.050 10.457 373 HA3 GLY 47 3HA GLY 47 -6.502 9.102 9.103 374 H ARG 48 H ARG 48 -8.615 9.202 8.580 375 HA ARG 48 HA ARG 48 -10.745 9.717 10.295 376 HB2 ARG 48 2HB ARG 48 -9.240 12.035 9.854 377 HB3 ARG 48 3HB ARG 48 -10.645 12.199 8.809 378 HG2 ARG 48 2HG ARG 48 -11.127 11.341 11.601 379 HG3 ARG 48 3HG ARG 48 -10.634 13.014 11.334 380 HD2 ARG 48 2HD ARG 48 -12.604 13.572 10.415 381 HD3 ARG 48 3HD ARG 48 -12.706 12.070 9.497 382 HE ARG 48 HE ARG 48 -13.963 11.154 11.186 383 HH11 ARG 48 1HH1 ARG 48 -12.506 14.115 12.293 384 HH12 ARG 48 2HH1 ARG 48 -13.419 14.168 13.765 385 HH21 ARG 48 1HH2 ARG 48 -15.171 11.211 13.120 386 HH22 ARG 48 2HH2 ARG 48 -14.934 12.515 14.234 387 H GLU 49 H GLU 49 -12.357 8.791 9.233 388 HA GLU 49 HA GLU 49 -13.763 8.127 7.572 389 HB2 GLU 49 2HB GLU 49 -12.934 10.823 6.823 390 HB3 GLU 49 3HB GLU 49 -13.377 9.841 5.433 391 HG2 GLU 49 2HG GLU 49 -15.524 10.114 5.868 392 HG3 GLU 49 3HG GLU 49 -15.314 9.475 7.498 393 HA PRO 50 HA PRO 50 -11.526 5.600 4.770 394 HB2 PRO 50 2HB PRO 50 -13.265 5.324 2.704 395 HB3 PRO 50 3HB PRO 50 -13.510 4.552 4.275 396 HG2 PRO 50 2HG PRO 50 -14.719 7.067 3.191 397 HG3 PRO 50 3HG PRO 50 -15.492 5.756 4.102 398 HD2 PRO 50 2HD PRO 50 -14.746 8.089 5.256 399 HD3 PRO 50 3HD PRO 50 -14.726 6.543 6.128 400 H GLY 51 H GLY 51 -13.177 8.237 3.011 401 HA2 GLY 51 2HA GLY 51 -12.397 9.703 1.424 402 HA3 GLY 51 3HA GLY 51 -10.774 9.318 1.978 403 H ASP 52 H ASP 52 -9.613 7.649 0.970 404 HA ASP 52 HA ASP 52 -10.589 5.945 -1.015 405 HB2 ASP 52 2HB ASP 52 -10.562 8.532 -1.960 406 HB3 ASP 52 3HB ASP 52 -9.018 7.903 -2.526 407 H ILE 53 H ILE 53 -8.512 5.613 -2.711 408 HA ILE 53 HA ILE 53 -6.631 4.219 -1.253 409 HB ILE 53 HB ILE 53 -5.152 4.464 -3.317 410 HG12 ILE 53 2HG1 ILE 53 -7.463 5.436 -4.859 411 HG13 ILE 53 3HG1 ILE 53 -6.717 6.650 -3.825 412 HG21 ILE 53 1HG2 ILE 53 -7.968 3.415 -3.510 413 HG22 ILE 53 2HG2 ILE 53 -6.717 3.087 -4.708 414 HG23 ILE 53 3HG2 ILE 53 -6.515 2.529 -3.048 415 HD11 ILE 53 3HD1 ILE 53 -4.508 5.880 -4.897 416 HD12 ILE 53 1HD1 ILE 53 -5.541 5.157 -6.129 417 HD13 ILE 53 2HD1 ILE 53 -5.603 6.895 -5.835 418 HA PRO 54 HA PRO 54 -3.765 7.100 0.409 419 HB2 PRO 54 2HB PRO 54 -1.436 5.719 0.206 420 HB3 PRO 54 3HB PRO 54 -2.698 5.307 1.373 421 HG2 PRO 54 2HG PRO 54 -2.099 4.068 -1.285 422 HG3 PRO 54 3HG PRO 54 -2.508 3.280 0.250 423 HD2 PRO 54 2HD PRO 54 -4.321 3.647 -1.727 424 HD3 PRO 54 3HD PRO 54 -4.765 3.665 -0.008 425 H GLU 55 H GLU 55 -1.342 7.868 -0.097 426 HA GLU 55 HA GLU 55 -0.718 8.079 -2.895 427 HB2 GLU 55 2HB GLU 55 -0.868 10.593 -2.902 428 HB3 GLU 55 3HB GLU 55 -2.413 9.753 -2.903 429 HG2 GLU 55 2HG GLU 55 -2.957 10.449 -0.811 430 HG3 GLU 55 3HG GLU 55 -1.278 10.535 -0.281 431 H THR 56 H THR 56 0.472 7.333 -0.262 432 HA THR 56 HA THR 56 3.045 8.520 -0.697 433 HB THR 56 HB THR 56 2.326 10.334 0.616 434 HG1 THR 56 HG1 THR 56 4.153 9.972 1.643 435 HG21 THR 56 3HG2 THR 56 0.222 9.364 1.410 436 HG22 THR 56 1HG2 THR 56 1.121 10.102 2.735 437 HG23 THR 56 2HG2 THR 56 1.113 8.349 2.543 438 H LEU 57 H LEU 57 4.299 6.784 -0.575 439 HA LEU 57 HA LEU 57 3.606 4.421 0.814 440 HB2 LEU 57 2HB LEU 57 5.019 4.324 -1.124 441 HB3 LEU 57 3HB LEU 57 6.220 5.359 -0.354 442 HG LEU 57 HG LEU 57 6.509 3.484 1.348 443 HD11 LEU 57 1HD1 LEU 57 4.316 2.418 0.138 444 HD12 LEU 57 2HD1 LEU 57 5.469 1.515 1.120 445 HD13 LEU 57 3HD1 LEU 57 5.623 1.523 -0.637 446 HD21 LEU 57 3HD2 LEU 57 8.088 4.045 -0.497 447 HD22 LEU 57 1HD2 LEU 57 7.266 2.849 -1.499 448 HD23 LEU 57 2HD2 LEU 57 8.101 2.344 -0.030 449 H ASP 58 H ASP 58 5.567 7.204 1.638 450 HA ASP 58 HA ASP 58 6.906 6.148 3.868 451 HB2 ASP 58 2HB ASP 58 6.746 8.632 2.577 452 HB3 ASP 58 3HB ASP 58 6.231 8.937 4.234 453 H GLN 59 H GLN 59 3.906 8.068 3.719 454 HA GLN 59 HA GLN 59 3.319 7.993 6.449 455 HB2 GLN 59 2HB GLN 59 2.213 9.255 4.373 456 HB3 GLN 59 3HB GLN 59 1.064 7.930 4.510 457 HG2 GLN 59 2HG GLN 59 0.054 8.921 6.205 458 HG3 GLN 59 3HG GLN 59 1.569 9.017 7.103 459 HE21 GLN 59 1HE2 GLN 59 1.704 11.009 7.860 460 HE22 GLN 59 2HE2 GLN 59 1.481 12.457 6.943 461 H LEU 60 H LEU 60 2.188 5.865 3.832 462 HA LEU 60 HA LEU 60 0.548 4.198 5.317 463 HB2 LEU 60 2HB LEU 60 0.680 4.144 2.885 464 HB3 LEU 60 3HB LEU 60 2.312 3.486 2.978 465 HG LEU 60 HG LEU 60 0.757 1.690 4.425 466 HD11 LEU 60 1HD1 LEU 60 -1.278 1.487 3.538 467 HD12 LEU 60 2HD1 LEU 60 -0.681 1.714 1.894 468 HD13 LEU 60 3HD1 LEU 60 -1.035 3.115 2.905 469 HD21 LEU 60 3HD2 LEU 60 2.126 1.769 1.796 470 HD22 LEU 60 1HD2 LEU 60 1.027 0.424 2.102 471 HD23 LEU 60 2HD2 LEU 60 2.390 0.712 3.183 472 H ARG 61 H ARG 61 4.043 3.988 4.776 473 HA ARG 61 HA ARG 61 4.492 1.539 6.047 474 HB2 ARG 61 2HB ARG 61 6.172 2.682 4.661 475 HB3 ARG 61 3HB ARG 61 6.330 3.934 5.886 476 HG2 ARG 61 2HG ARG 61 6.847 1.792 7.398 477 HG3 ARG 61 3HG ARG 61 7.391 1.180 5.835 478 HD2 ARG 61 2HD ARG 61 8.273 3.792 7.057 479 HD3 ARG 61 3HD ARG 61 9.181 2.284 7.158 480 HE ARG 61 HE ARG 61 8.658 2.798 4.465 481 HH11 ARG 61 1HH1 ARG 61 10.482 4.156 7.101 482 HH12 ARG 61 2HH1 ARG 61 11.699 4.842 6.077 483 HH21 ARG 61 1HH2 ARG 61 10.254 3.696 3.106 484 HH22 ARG 61 2HH2 ARG 61 11.569 4.580 3.805 485 H LEU 62 H LEU 62 4.500 4.838 7.351 486 HA LEU 62 HA LEU 62 5.193 4.080 9.996 487 HB2 LEU 62 2HB LEU 62 4.898 6.454 8.608 488 HB3 LEU 62 3HB LEU 62 3.602 6.504 9.801 489 HG LEU 62 HG LEU 62 5.531 7.646 10.668 490 HD11 LEU 62 1HD1 LEU 62 4.111 5.978 12.079 491 HD12 LEU 62 2HD1 LEU 62 5.578 6.684 12.758 492 HD13 LEU 62 3HD1 LEU 62 5.604 5.040 12.121 493 HD21 LEU 62 3HD2 LEU 62 7.595 6.148 11.140 494 HD22 LEU 62 1HD2 LEU 62 7.382 6.847 9.535 495 HD23 LEU 62 2HD2 LEU 62 6.962 5.158 9.824 496 H VAL 63 H VAL 63 2.125 4.599 8.334 497 HA VAL 63 HA VAL 63 0.427 4.476 10.561 498 HB VAL 63 HB VAL 63 -0.138 3.597 7.726 499 HG11 VAL 63 1HG1 VAL 63 -1.923 2.702 8.840 500 HG12 VAL 63 2HG1 VAL 63 -1.848 3.889 10.143 501 HG13 VAL 63 3HG1 VAL 63 -2.520 4.340 8.576 502 HG21 VAL 63 3HG2 VAL 63 0.341 6.169 8.846 503 HG22 VAL 63 1HG2 VAL 63 -0.103 5.751 7.191 504 HG23 VAL 63 2HG2 VAL 63 -1.359 6.067 8.388 505 H ILE 64 H ILE 64 1.766 1.934 8.508 506 HA ILE 64 HA ILE 64 0.273 -0.203 9.596 507 HB ILE 64 HB ILE 64 2.992 -0.258 8.282 508 HG12 ILE 64 2HG1 ILE 64 0.478 -1.129 6.933 509 HG13 ILE 64 3HG1 ILE 64 0.775 0.599 7.092 510 HG21 ILE 64 1HG2 ILE 64 2.184 -2.664 7.766 511 HG22 ILE 64 2HG2 ILE 64 2.861 -2.307 9.354 512 HG23 ILE 64 3HG2 ILE 64 1.114 -2.419 9.146 513 HD11 ILE 64 3HD1 ILE 64 2.113 0.539 5.340 514 HD12 ILE 64 1HD1 ILE 64 3.151 -0.636 6.148 515 HD13 ILE 64 2HD1 ILE 64 1.793 -1.187 5.165 516 H CYS 65 H CYS 65 3.624 0.841 10.228 517 HA CYS 65 HA CYS 65 4.133 -0.992 12.290 518 HB2 CYS 65 2HB CYS 65 5.538 1.060 10.991 519 HB3 CYS 65 3HB CYS 65 5.539 1.504 12.694 520 HG CYS 65 HG CYS 65 6.373 -1.683 11.936 521 H ASP 66 H ASP 66 2.771 2.261 12.337 522 HA ASP 66 HA ASP 66 2.727 2.533 15.162 523 HB2 ASP 66 2HB ASP 66 2.597 4.478 13.687 524 HB3 ASP 66 3HB ASP 66 1.057 3.908 13.047 525 H LEU 67 H LEU 67 0.094 1.867 12.847 526 HA LEU 67 HA LEU 67 -1.895 1.363 14.734 527 HB2 LEU 67 2HB LEU 67 -2.590 1.687 12.523 528 HB3 LEU 67 3HB LEU 67 -1.483 0.463 11.904 529 HG LEU 67 HG LEU 67 -3.646 -0.443 13.726 530 HD11 LEU 67 1HD1 LEU 67 -4.741 1.175 12.192 531 HD12 LEU 67 2HD1 LEU 67 -5.297 -0.486 11.990 532 HD13 LEU 67 3HD1 LEU 67 -4.166 0.211 10.831 533 HD21 LEU 67 3HD2 LEU 67 -3.595 -2.158 11.680 534 HD22 LEU 67 1HD2 LEU 67 -2.477 -2.260 13.041 535 HD23 LEU 67 2HD2 LEU 67 -1.964 -1.502 11.533 536 H GLN 68 H GLN 68 0.281 -0.918 13.089 537 HA GLN 68 HA GLN 68 -0.688 -3.265 14.246 538 HB2 GLN 68 2HB GLN 68 0.810 -3.380 12.374 539 HB3 GLN 68 3HB GLN 68 2.076 -2.548 13.266 540 HG2 GLN 68 2HG GLN 68 2.249 -4.455 14.789 541 HG3 GLN 68 3HG GLN 68 0.997 -5.291 13.872 542 HE21 GLN 68 1HE2 GLN 68 2.859 -6.866 13.844 543 HE22 GLN 68 2HE2 GLN 68 3.945 -6.759 12.505 544 H GLU 69 H GLU 69 1.649 -0.914 15.428 545 HA GLU 69 HA GLU 69 2.642 -2.386 17.602 546 HB2 GLU 69 2HB GLU 69 2.599 0.451 16.784 547 HB3 GLU 69 3HB GLU 69 2.796 0.167 18.508 548 HG2 GLU 69 2HG GLU 69 4.757 -1.155 18.130 549 HG3 GLU 69 3HG GLU 69 4.517 -1.089 16.385 550 H ARG 70 H ARG 70 0.057 0.068 17.513 551 HA ARG 70 HA ARG 70 -0.698 -0.262 20.217 552 HB2 ARG 70 2HB ARG 70 -1.871 1.059 17.820 553 HB3 ARG 70 3HB ARG 70 -2.937 0.748 19.184 554 HG2 ARG 70 2HG ARG 70 -0.889 1.865 20.489 555 HG3 ARG 70 3HG ARG 70 -0.695 2.648 18.920 556 HD2 ARG 70 2HD ARG 70 -3.126 3.259 19.034 557 HD3 ARG 70 3HD ARG 70 -3.129 2.664 20.694 558 HE ARG 70 HE ARG 70 -2.045 5.146 19.748 559 HH11 ARG 70 1HH1 ARG 70 -1.845 2.708 22.225 560 HH12 ARG 70 2HH1 ARG 70 -1.163 3.777 23.405 561 HH21 ARG 70 1HH2 ARG 70 -1.148 6.564 21.293 562 HH22 ARG 70 2HH2 ARG 70 -0.768 5.971 22.874 563 H ARG 71 H ARG 71 -2.109 -1.511 17.199 564 HA ARG 71 HA ARG 71 -4.237 -2.918 18.306 565 HB2 ARG 71 2HB ARG 71 -2.711 -3.031 15.774 566 HB3 ARG 71 3HB ARG 71 -3.613 -4.482 16.190 567 HG2 ARG 71 2HG ARG 71 -4.885 -2.957 14.750 568 HG3 ARG 71 3HG ARG 71 -5.666 -3.218 16.311 569 HD2 ARG 71 2HD ARG 71 -3.822 -0.951 16.275 570 HD3 ARG 71 3HD ARG 71 -5.178 -0.781 15.161 571 HE ARG 71 HE ARG 71 -6.344 -1.573 17.481 572 HH11 ARG 71 1HH1 ARG 71 -4.169 1.005 16.618 573 HH12 ARG 71 2HH1 ARG 71 -4.761 2.087 17.835 574 HH21 ARG 71 1HH2 ARG 71 -7.131 -0.158 19.087 575 HH22 ARG 71 2HH2 ARG 71 -6.445 1.424 19.239 576 H GLU 72 H GLU 72 -0.918 -4.005 17.656 577 HA GLU 72 HA GLU 72 -1.208 -6.664 18.438 578 HB2 GLU 72 2HB GLU 72 0.781 -5.921 17.292 579 HB3 GLU 72 3HB GLU 72 1.190 -4.836 18.614 580 HG2 GLU 72 2HG GLU 72 2.080 -6.476 19.868 581 HG3 GLU 72 3HG GLU 72 0.897 -7.671 19.339 582 H LYS 73 H LYS 73 -0.246 -3.839 20.370 583 HA LYS 73 HA LYS 73 0.203 -5.118 22.793 584 HB2 LYS 73 2HB LYS 73 0.038 -2.463 21.877 585 HB3 LYS 73 3HB LYS 73 -1.091 -2.576 23.220 586 HG2 LYS 73 2HG LYS 73 0.841 -3.674 24.497 587 HG3 LYS 73 3HG LYS 73 1.868 -3.035 23.211 588 HD2 LYS 73 2HD LYS 73 1.904 -1.071 24.251 589 HD3 LYS 73 3HD LYS 73 0.158 -0.939 24.027 590 HE2 LYS 73 2HE LYS 73 -0.053 -2.378 26.118 591 HE3 LYS 73 3HE LYS 73 1.663 -2.065 26.375 592 HZ1 LYS 73 3HZ LYS 73 -0.020 0.257 25.874 593 HZ2 LYS 73 1HZ LYS 73 1.283 0.072 26.937 594 HZ3 LYS 73 2HZ LYS 73 -0.243 -0.522 27.359 595 H PHE 74 H PHE 74 -2.818 -3.971 21.373 596 HA PHE 74 HA PHE 74 -4.401 -4.586 23.676 597 HB2 PHE 74 2HB PHE 74 -4.783 -3.169 21.292 598 HB3 PHE 74 3HB PHE 74 -5.910 -4.518 21.205 599 HD1 PHE 74 HD2 PHE 74 -6.958 -4.930 23.764 600 HD2 PHE 74 HD1 PHE 74 -5.790 -1.241 21.989 601 HE1 PHE 74 HE2 PHE 74 -8.508 -3.728 25.249 602 HE2 PHE 74 HE1 PHE 74 -7.338 -0.034 23.473 603 HZ PHE 74 HZ PHE 74 -8.700 -1.277 25.104 604 H GLY 75 H GLY 75 -3.292 -6.336 20.897 605 HA2 GLY 75 2HA GLY 75 -3.486 -8.852 21.641 606 HA3 GLY 75 3HA GLY 75 -5.189 -8.514 21.368 607 H SER 76 H SER 76 -4.047 -10.509 19.950 608 HA SER 76 HA SER 76 -3.420 -9.383 17.313 609 HB2 SER 76 2HB SER 76 -3.277 -12.283 17.499 610 HB3 SER 76 3HB SER 76 -2.034 -11.128 17.020 611 HG SER 76 HG SER 76 -1.168 -11.670 18.859 612 H SER 77 H SER 77 -4.684 -9.734 15.552 613 HA SER 77 HA SER 77 -6.931 -11.576 15.712 614 HB2 SER 77 2HB SER 77 -8.600 -10.056 15.797 615 HB3 SER 77 3HB SER 77 -7.368 -8.960 16.422 616 HG SER 77 HG SER 77 -8.692 -8.305 14.493 617 H LYS 78 H LYS 78 -7.589 -12.338 13.746 618 HA LYS 78 HA LYS 78 -5.847 -12.337 11.605 619 HB2 LYS 78 2HB LYS 78 -8.832 -12.811 11.618 620 HB3 LYS 78 3HB LYS 78 -7.777 -13.192 10.263 621 HG2 LYS 78 2HG LYS 78 -6.910 -14.328 12.817 622 HG3 LYS 78 3HG LYS 78 -8.469 -14.922 12.240 623 HD2 LYS 78 2HD LYS 78 -6.852 -16.383 11.335 624 HD3 LYS 78 3HD LYS 78 -7.328 -15.320 10.008 625 HE2 LYS 78 2HE LYS 78 -5.343 -13.996 10.287 626 HE3 LYS 78 3HE LYS 78 -4.903 -14.883 11.746 627 HZ1 LYS 78 3HZ LYS 78 -5.272 -16.475 9.342 628 HZ2 LYS 78 1HZ LYS 78 -4.110 -16.610 10.564 629 HZ3 LYS 78 2HZ LYS 78 -3.926 -15.450 9.348 630 H GLU 79 H GLU 79 -8.478 -10.130 12.317 631 HA GLU 79 HA GLU 79 -8.632 -8.874 9.800 632 HB2 GLU 79 2HB GLU 79 -9.238 -7.725 12.530 633 HB3 GLU 79 3HB GLU 79 -9.758 -7.045 10.994 634 HG2 GLU 79 2HG GLU 79 -11.608 -8.238 11.171 635 HG3 GLU 79 3HG GLU 79 -10.633 -9.689 10.949 636 H ILE 80 H ILE 80 -6.769 -8.090 12.716 637 HA ILE 80 HA ILE 80 -5.551 -5.769 11.595 638 HB ILE 80 HB ILE 80 -4.626 -7.434 13.940 639 HG12 ILE 80 2HG1 ILE 80 -6.911 -6.633 14.267 640 HG13 ILE 80 3HG1 ILE 80 -5.803 -5.757 15.316 641 HG21 ILE 80 1HG2 ILE 80 -2.928 -6.021 14.156 642 HG22 ILE 80 2HG2 ILE 80 -3.370 -5.317 12.602 643 HG23 ILE 80 3HG2 ILE 80 -4.016 -4.634 14.094 644 HD11 ILE 80 3HD1 ILE 80 -5.870 -4.170 13.098 645 HD12 ILE 80 1HD1 ILE 80 -7.520 -4.789 13.173 646 HD13 ILE 80 2HD1 ILE 80 -6.833 -3.937 14.556 647 H ASP 81 H ASP 81 -4.380 -9.074 12.212 648 HA ASP 81 HA ASP 81 -1.801 -8.784 11.226 649 HB2 ASP 81 2HB ASP 81 -3.674 -11.101 11.493 650 HB3 ASP 81 3HB ASP 81 -2.169 -11.320 10.603 651 H MET 82 H MET 82 -4.783 -9.613 9.500 652 HA MET 82 HA MET 82 -3.603 -10.057 6.983 653 HB2 MET 82 2HB MET 82 -6.369 -9.416 7.927 654 HB3 MET 82 3HB MET 82 -6.017 -9.357 6.206 655 HG2 MET 82 2HG MET 82 -5.058 -11.718 6.536 656 HG3 MET 82 3HG MET 82 -5.941 -11.700 8.061 657 HE1 MET 82 3HE MET 82 -8.574 -13.598 7.161 658 HE2 MET 82 1HE MET 82 -7.493 -14.119 5.868 659 HE3 MET 82 2HE MET 82 -6.836 -13.698 7.449 660 H ALA 83 H ALA 83 -5.142 -7.158 8.357 661 HA ALA 83 HA ALA 83 -4.924 -5.454 6.196 662 HB1 ALA 83 1HB ALA 83 -5.576 -3.839 7.620 663 HB2 ALA 83 2HB ALA 83 -5.795 -5.183 8.740 664 HB3 ALA 83 3HB ALA 83 -4.319 -4.221 8.797 665 H ILE 84 H ILE 84 -2.479 -6.310 8.594 666 HA ILE 84 HA ILE 84 -0.537 -4.425 7.753 667 HB ILE 84 HB ILE 84 -0.132 -7.058 9.176 668 HG12 ILE 84 2HG1 ILE 84 -0.170 -4.314 10.416 669 HG13 ILE 84 3HG1 ILE 84 -1.643 -5.259 10.231 670 HG21 ILE 84 1HG2 ILE 84 1.856 -5.258 9.920 671 HG22 ILE 84 2HG2 ILE 84 2.038 -6.674 8.886 672 HG23 ILE 84 3HG2 ILE 84 1.725 -5.093 8.169 673 HD11 ILE 84 3HD1 ILE 84 -0.786 -6.984 11.642 674 HD12 ILE 84 1HD1 ILE 84 0.799 -6.214 11.702 675 HD13 ILE 84 2HD1 ILE 84 -0.589 -5.437 12.465 676 H VAL 85 H VAL 85 -1.083 -7.839 6.960 677 HA VAL 85 HA VAL 85 1.176 -8.142 5.292 678 HB VAL 85 HB VAL 85 -1.438 -9.657 5.238 679 HG11 VAL 85 1HG1 VAL 85 -0.201 -9.939 3.164 680 HG12 VAL 85 2HG1 VAL 85 1.254 -10.358 4.070 681 HG13 VAL 85 3HG1 VAL 85 -0.152 -11.421 4.117 682 HG21 VAL 85 3HG2 VAL 85 0.553 -9.558 7.208 683 HG22 VAL 85 1HG2 VAL 85 -0.769 -10.717 7.073 684 HG23 VAL 85 2HG2 VAL 85 0.798 -11.079 6.349 685 H THR 86 H THR 86 -2.191 -7.277 4.615 686 HA THR 86 HA THR 86 -2.066 -7.266 1.827 687 HB THR 86 HB THR 86 -3.991 -5.727 1.889 688 HG1 THR 86 HG1 THR 86 -3.944 -4.383 3.532 689 HG21 THR 86 3HG2 THR 86 -5.343 -7.428 2.430 690 HG22 THR 86 1HG2 THR 86 -4.778 -7.450 4.100 691 HG23 THR 86 2HG2 THR 86 -3.878 -8.314 2.853 692 H LEU 87 H LEU 87 -1.506 -4.607 4.124 693 HA LEU 87 HA LEU 87 -0.904 -2.665 2.162 694 HB2 LEU 87 2HB LEU 87 -0.164 -2.843 5.076 695 HB3 LEU 87 3HB LEU 87 0.140 -1.430 4.068 696 HG LEU 87 HG LEU 87 -2.548 -2.553 4.850 697 HD11 LEU 87 1HD1 LEU 87 -1.590 -1.346 6.658 698 HD12 LEU 87 2HD1 LEU 87 -2.770 -0.283 5.893 699 HD13 LEU 87 3HD1 LEU 87 -1.049 -0.050 5.591 700 HD21 LEU 87 3HD2 LEU 87 -3.022 -0.129 3.703 701 HD22 LEU 87 1HD2 LEU 87 -3.226 -1.685 2.898 702 HD23 LEU 87 2HD2 LEU 87 -1.737 -0.766 2.674 703 H LYS 88 H LYS 88 1.002 -5.103 3.771 704 HA LYS 88 HA LYS 88 3.549 -4.040 3.029 705 HB2 LYS 88 2HB LYS 88 2.551 -6.252 4.561 706 HB3 LYS 88 3HB LYS 88 3.761 -6.834 3.425 707 HG2 LYS 88 2HG LYS 88 5.104 -4.750 4.340 708 HG3 LYS 88 3HG LYS 88 4.051 -4.996 5.735 709 HD2 LYS 88 2HD LYS 88 5.394 -7.382 4.589 710 HD3 LYS 88 3HD LYS 88 6.393 -6.234 5.483 711 HE2 LYS 88 2HE LYS 88 5.735 -7.605 7.191 712 HE3 LYS 88 3HE LYS 88 4.436 -6.414 7.236 713 HZ1 LYS 88 3HZ LYS 88 3.362 -8.462 7.305 714 HZ2 LYS 88 1HZ LYS 88 4.374 -9.157 6.140 715 HZ3 LYS 88 2HZ LYS 88 3.226 -8.002 5.682 716 H VAL 89 H VAL 89 1.926 -7.037 1.965 717 HA VAL 89 HA VAL 89 3.535 -7.603 -0.200 718 HB VAL 89 HB VAL 89 1.627 -8.852 -1.149 719 HG11 VAL 89 1HG1 VAL 89 2.667 -10.220 0.338 720 HG12 VAL 89 2HG1 VAL 89 2.473 -9.093 1.682 721 HG13 VAL 89 3HG1 VAL 89 1.111 -10.083 1.155 722 HG21 VAL 89 3HG2 VAL 89 -0.377 -7.884 -0.833 723 HG22 VAL 89 1HG2 VAL 89 -0.370 -8.764 0.696 724 HG23 VAL 89 2HG2 VAL 89 0.136 -7.076 0.648 725 H PHE 90 H PHE 90 0.829 -5.369 0.009 726 HA PHE 90 HA PHE 90 0.746 -4.836 -2.807 727 HB2 PHE 90 2HB PHE 90 -1.284 -4.527 -1.583 728 HB3 PHE 90 3HB PHE 90 -0.496 -3.462 -0.423 729 HD1 PHE 90 HD1 PHE 90 -0.380 -3.473 -4.142 730 HD2 PHE 90 HD2 PHE 90 -1.560 -1.420 -0.605 731 HE1 PHE 90 HE1 PHE 90 -1.033 -1.524 -5.495 732 HE2 PHE 90 HE2 PHE 90 -2.216 0.532 -1.952 733 HZ PHE 90 HZ PHE 90 -1.954 0.481 -4.400 734 H ALA 91 H ALA 91 2.362 -3.472 -0.030 735 HA ALA 91 HA ALA 91 3.114 -0.999 -1.161 736 HB1 ALA 91 1HB ALA 91 3.460 -0.904 1.071 737 HB2 ALA 91 2HB ALA 91 3.924 -2.602 1.184 738 HB3 ALA 91 3HB ALA 91 5.085 -1.408 0.606 739 H VAL 92 H VAL 92 4.977 -4.019 -0.783 740 HA VAL 92 HA VAL 92 7.184 -3.099 -2.321 741 HB VAL 92 HB VAL 92 6.441 -5.973 -1.778 742 HG11 VAL 92 1HG1 VAL 92 8.563 -6.545 -2.381 743 HG12 VAL 92 2HG1 VAL 92 8.344 -5.138 -3.424 744 HG13 VAL 92 3HG1 VAL 92 9.237 -4.985 -1.910 745 HG21 VAL 92 3HG2 VAL 92 7.241 -3.872 0.049 746 HG22 VAL 92 1HG2 VAL 92 6.679 -5.509 0.389 747 HG23 VAL 92 2HG2 VAL 92 8.385 -5.214 0.051 748 H ALA 93 H ALA 93 4.656 -5.512 -3.047 749 HA ALA 93 HA ALA 93 5.380 -5.890 -5.736 750 HB1 ALA 93 1HB ALA 93 2.547 -6.201 -4.850 751 HB2 ALA 93 2HB ALA 93 3.511 -7.221 -5.918 752 HB3 ALA 93 3HB ALA 93 3.792 -7.254 -4.177 753 H GLY 94 H GLY 94 3.808 -3.286 -4.190 754 HA2 GLY 94 2HA GLY 94 2.539 -2.366 -6.665 755 HA3 GLY 94 3HA GLY 94 2.324 -1.663 -5.068 756 H LEU 95 H LEU 95 4.313 -0.600 -4.140 757 HA LEU 95 HA LEU 95 5.178 1.441 -5.848 758 HB2 LEU 95 2HB LEU 95 6.141 0.459 -3.182 759 HB3 LEU 95 3HB LEU 95 6.932 1.800 -4.008 760 HG LEU 95 HG LEU 95 5.423 2.686 -2.375 761 HD11 LEU 95 1HD1 LEU 95 4.061 4.109 -3.742 762 HD12 LEU 95 2HD1 LEU 95 4.133 2.967 -5.083 763 HD13 LEU 95 3HD1 LEU 95 5.589 3.823 -4.575 764 HD21 LEU 95 3HD2 LEU 95 3.077 2.182 -2.309 765 HD22 LEU 95 1HD2 LEU 95 3.979 0.669 -2.228 766 HD23 LEU 95 2HD2 LEU 95 3.211 1.157 -3.739 767 H LEU 96 H LEU 96 6.856 -1.477 -4.719 768 HA LEU 96 HA LEU 96 9.158 -0.897 -6.383 769 HB2 LEU 96 2HB LEU 96 8.585 -2.554 -4.114 770 HB3 LEU 96 3HB LEU 96 9.307 -3.528 -5.394 771 HG LEU 96 HG LEU 96 10.997 -2.727 -3.837 772 HD11 LEU 96 1HD1 LEU 96 12.383 -2.681 -5.563 773 HD12 LEU 96 2HD1 LEU 96 11.889 -1.031 -5.943 774 HD13 LEU 96 3HD1 LEU 96 11.019 -2.396 -6.643 775 HD21 LEU 96 3HD2 LEU 96 10.266 0.063 -4.708 776 HD22 LEU 96 1HD2 LEU 96 11.467 -0.412 -3.507 777 HD23 LEU 96 2HD2 LEU 96 9.751 -0.660 -3.183 778 H ASN 97 H ASN 97 6.174 -2.105 -6.978 779 HA ASN 97 HA ASN 97 5.236 -3.422 -8.584 780 HB2 ASN 97 2HB ASN 97 7.791 -2.681 -10.027 781 HB3 ASN 97 3HB ASN 97 6.358 -3.361 -10.792 782 HD21 ASN 97 1HD2 ASN 97 7.932 -0.645 -10.628 783 HD22 ASN 97 2HD2 ASN 97 6.648 0.511 -10.602 784 H MET 98 H MET 98 6.937 -4.732 -6.591 785 HA MET 98 HA MET 98 8.468 -6.779 -7.816 786 HB2 MET 98 2HB MET 98 7.525 -6.129 -5.103 787 HB3 MET 98 3HB MET 98 7.766 -7.845 -5.406 788 HG2 MET 98 2HG MET 98 9.936 -6.072 -6.300 789 HG3 MET 98 3HG MET 98 9.693 -6.176 -4.558 790 HE1 MET 98 3HE MET 98 11.562 -6.957 -7.112 791 HE2 MET 98 1HE MET 98 12.645 -8.085 -6.297 792 HE3 MET 98 2HE MET 98 11.533 -8.670 -7.535 793 H THR 99 H THR 99 7.957 -9.115 -7.651 794 HA THR 99 HA THR 99 5.121 -9.588 -8.297 795 HB THR 99 HB THR 99 7.196 -11.553 -9.127 796 HG1 THR 99 HG1 THR 99 7.675 -10.287 -10.971 797 HG21 THR 99 3HG2 THR 99 5.724 -11.764 -11.071 798 HG22 THR 99 1HG2 THR 99 4.732 -10.436 -10.471 799 HG23 THR 99 2HG2 THR 99 4.818 -11.949 -9.569 800 H VAL 100 H VAL 100 5.702 -9.587 -5.650 801 HA VAL 100 HA VAL 100 6.368 -12.235 -4.725 802 HB VAL 100 HB VAL 100 5.747 -11.338 -2.478 803 HG11 VAL 100 1HG1 VAL 100 7.703 -9.734 -4.120 804 HG12 VAL 100 2HG1 VAL 100 7.625 -9.723 -2.357 805 HG13 VAL 100 3HG1 VAL 100 8.036 -11.209 -3.213 806 HG21 VAL 100 3HG2 VAL 100 4.441 -9.548 -2.324 807 HG22 VAL 100 1HG2 VAL 100 5.714 -8.572 -3.058 808 HG23 VAL 100 2HG2 VAL 100 4.491 -9.334 -4.074 809 H SER 101 H SER 101 5.003 -13.879 -4.590 810 HA SER 101 HA SER 101 2.115 -13.320 -4.604 811 HB2 SER 101 2HB SER 101 3.730 -15.670 -5.580 812 HB3 SER 101 3HB SER 101 1.991 -15.790 -5.313 813 HG SER 101 HG SER 101 3.131 -14.949 -7.466 814 H THR 102 H THR 102 4.190 -13.575 -2.326 815 HA THR 102 HA THR 102 2.440 -15.136 -0.592 816 HB THR 102 HB THR 102 4.163 -16.481 0.357 817 HG1 THR 102 HG1 THR 102 5.985 -15.123 -1.367 818 HG21 THR 102 3HG2 THR 102 4.737 -17.916 -1.447 819 HG22 THR 102 1HG2 THR 102 4.668 -16.595 -2.612 820 HG23 THR 102 2HG2 THR 102 3.185 -17.190 -1.865 821 H ALA 103 H ALA 103 2.187 -14.215 1.355 822 HA ALA 103 HA ALA 103 3.030 -11.652 1.932 823 HB1 ALA 103 1HB ALA 103 2.315 -12.073 4.230 824 HB2 ALA 103 2HB ALA 103 1.165 -12.738 3.069 825 HB3 ALA 103 3HB ALA 103 2.289 -13.807 3.908 826 H ALA 104 H ALA 104 4.651 -14.689 2.532 827 HA ALA 104 HA ALA 104 6.568 -13.747 4.388 828 HB1 ALA 104 1HB ALA 104 7.763 -15.792 3.947 829 HB2 ALA 104 2HB ALA 104 6.034 -16.135 4.028 830 HB3 ALA 104 3HB ALA 104 6.844 -16.051 2.464 831 H ALA 105 H ALA 105 6.587 -14.044 0.858 832 HA ALA 105 HA ALA 105 9.269 -13.250 0.476 833 HB1 ALA 105 1HB ALA 105 8.126 -14.397 -1.281 834 HB2 ALA 105 2HB ALA 105 6.890 -13.142 -1.370 835 HB3 ALA 105 3HB ALA 105 8.544 -12.787 -1.867 836 H ALA 106 H ALA 106 6.249 -11.446 0.690 837 HA ALA 106 HA ALA 106 7.217 -8.948 -0.157 838 HB1 ALA 106 1HB ALA 106 4.914 -9.755 1.591 839 HB2 ALA 106 2HB ALA 106 5.266 -8.064 1.232 840 HB3 ALA 106 3HB ALA 106 4.887 -9.183 -0.077 841 H GLU 107 H GLU 107 6.754 -10.205 3.150 842 HA GLU 107 HA GLU 107 7.906 -7.988 4.451 843 HB2 GLU 107 2HB GLU 107 6.459 -9.608 5.596 844 HB3 GLU 107 3HB GLU 107 7.685 -10.851 5.396 845 HG2 GLU 107 2HG GLU 107 9.117 -8.932 6.648 846 HG3 GLU 107 3HG GLU 107 7.517 -8.655 7.333 847 H ASN 108 H ASN 108 9.271 -10.998 3.232 848 HA ASN 108 HA ASN 108 11.801 -10.846 4.401 849 HB2 ASN 108 2HB ASN 108 11.018 -12.851 3.251 850 HB3 ASN 108 3HB ASN 108 11.010 -11.992 1.714 851 HD21 ASN 108 1HD2 ASN 108 13.158 -12.884 4.380 852 HD22 ASN 108 2HD2 ASN 108 14.560 -13.126 3.398 853 H MET 109 H MET 109 10.632 -9.536 1.315 854 HA MET 109 HA MET 109 13.157 -8.351 0.653 855 HB2 MET 109 2HB MET 109 10.906 -8.995 -0.773 856 HB3 MET 109 3HB MET 109 10.773 -7.245 -0.658 857 HG2 MET 109 2HG MET 109 13.454 -7.920 -1.342 858 HG3 MET 109 3HG MET 109 12.352 -8.772 -2.422 859 HE1 MET 109 3HE MET 109 13.692 -4.619 -2.189 860 HE2 MET 109 1HE MET 109 12.236 -4.568 -1.194 861 HE3 MET 109 2HE MET 109 13.513 -5.728 -0.828 862 H TYR 110 H TYR 110 10.071 -7.159 1.924 863 HA TYR 110 HA TYR 110 10.679 -4.432 1.947 864 HB2 TYR 110 2HB TYR 110 8.447 -5.691 2.448 865 HB3 TYR 110 3HB TYR 110 9.018 -5.678 4.113 866 HD1 TYR 110 HD2 TYR 110 8.839 -3.227 1.286 867 HD2 TYR 110 HD1 TYR 110 8.127 -4.002 5.409 868 HE1 TYR 110 HE2 TYR 110 7.971 -0.942 1.560 869 HE2 TYR 110 HE1 TYR 110 7.256 -1.720 5.693 870 HH TYR 110 HH TYR 110 7.708 0.714 3.447 871 H SER 111 H SER 111 11.523 -6.999 4.170 872 HA SER 111 HA SER 111 12.555 -5.182 6.167 873 HB2 SER 111 2HB SER 111 13.118 -7.159 7.429 874 HB3 SER 111 3HB SER 111 11.511 -7.390 6.742 875 HG SER 111 HG SER 111 13.018 -9.199 6.522 876 H GLN 112 H GLN 112 13.910 -7.554 3.893 877 HA GLN 112 HA GLN 112 16.598 -7.231 4.505 878 HB2 GLN 112 2HB GLN 112 15.503 -8.926 2.935 879 HB3 GLN 112 3HB GLN 112 15.584 -7.673 1.703 880 HG2 GLN 112 2HG GLN 112 17.458 -9.125 1.442 881 HG3 GLN 112 3HG GLN 112 18.033 -7.568 2.036 882 HE21 GLN 112 1HE2 GLN 112 17.134 -10.818 3.079 883 HE22 GLN 112 2HE2 GLN 112 18.229 -10.886 4.414 884 H MET 113 H MET 113 14.468 -5.220 2.601 885 HA MET 113 HA MET 113 16.569 -3.633 1.458 886 HB2 MET 113 2HB MET 113 13.956 -4.027 0.818 887 HB3 MET 113 3HB MET 113 13.864 -2.468 1.627 888 HG2 MET 113 2HG MET 113 15.920 -2.910 -0.484 889 HG3 MET 113 3HG MET 113 14.247 -2.603 -0.942 890 HE1 MET 113 3HE MET 113 16.716 -0.522 -1.817 891 HE2 MET 113 1HE MET 113 17.263 0.476 -0.469 892 HE3 MET 113 2HE MET 113 17.512 -1.270 -0.431 893 H GLY 114 H GLY 114 14.647 -3.555 4.358 894 HA2 GLY 114 2HA GLY 114 15.455 -2.377 6.289 895 HA3 GLY 114 3HA GLY 114 16.155 -1.176 5.214 896 H LEU 115 H LEU 115 12.920 -2.399 4.752 897 HA LEU 115 HA LEU 115 11.887 0.266 5.448 898 HB2 LEU 115 2HB LEU 115 10.565 -1.836 3.745 899 HB3 LEU 115 3HB LEU 115 10.062 -0.160 3.952 900 HG LEU 115 HG LEU 115 12.618 -1.029 2.605 901 HD11 LEU 115 1HD1 LEU 115 9.985 -0.159 1.423 902 HD12 LEU 115 2HD1 LEU 115 10.718 -1.758 1.300 903 HD13 LEU 115 3HD1 LEU 115 11.486 -0.375 0.521 904 HD21 LEU 115 3HD2 LEU 115 11.942 1.507 1.767 905 HD22 LEU 115 1HD2 LEU 115 13.180 1.100 2.955 906 HD23 LEU 115 2HD2 LEU 115 11.554 1.529 3.488 907 H ASP 116 H ASP 116 11.274 -3.198 5.804 908 HA ASP 116 HA ASP 116 8.936 -2.979 7.362 909 HB2 ASP 116 2HB ASP 116 9.959 -5.051 6.184 910 HB3 ASP 116 3HB ASP 116 10.895 -5.239 7.664 911 H THR 117 H THR 117 12.358 -3.111 8.220 912 HA THR 117 HA THR 117 13.473 -2.636 10.147 913 HB THR 117 HB THR 117 11.037 -1.286 11.261 914 HG1 THR 117 HG1 THR 117 11.332 0.425 9.898 915 HG21 THR 117 3HG2 THR 117 12.899 -1.180 12.706 916 HG22 THR 117 1HG2 THR 117 12.855 0.386 11.897 917 HG23 THR 117 2HG2 THR 117 14.011 -0.842 11.380 918 H ARG 118 H ARG 118 11.779 -5.051 9.936 919 HA ARG 118 HA ARG 118 11.658 -5.653 12.804 920 HB2 ARG 118 2HB ARG 118 9.359 -5.169 11.654 921 HB3 ARG 118 3HB ARG 118 9.570 -6.776 10.971 922 HG2 ARG 118 2HG ARG 118 8.305 -7.154 12.875 923 HG3 ARG 118 3HG ARG 118 9.948 -7.532 13.397 924 HD2 ARG 118 2HD ARG 118 10.031 -5.063 14.146 925 HD3 ARG 118 3HD ARG 118 8.273 -5.127 14.020 926 HE ARG 118 HE ARG 118 9.174 -7.305 15.552 927 HH11 ARG 118 1HH1 ARG 118 8.863 -3.842 15.720 928 HH12 ARG 118 2HH1 ARG 118 8.698 -3.809 17.444 929 HH21 ARG 118 1HH2 ARG 118 8.958 -7.276 17.823 930 HH22 ARG 118 2HH2 ARG 118 8.753 -5.763 18.639 931 HA PRO 119 HA PRO 119 14.040 -8.799 10.333 932 HB2 PRO 119 2HB PRO 119 16.200 -8.813 11.978 933 HB3 PRO 119 3HB PRO 119 16.021 -7.676 10.636 934 HG2 PRO 119 2HG PRO 119 15.491 -7.263 13.554 935 HG3 PRO 119 3HG PRO 119 16.296 -6.184 12.399 936 HD2 PRO 119 2HD PRO 119 13.719 -5.846 13.156 937 HD3 PRO 119 3HD PRO 119 14.303 -5.415 11.535 938 H SER 120 H SER 120 14.631 -10.948 10.971 939 HA SER 120 HA SER 120 13.549 -11.758 13.590 940 HB2 SER 120 2HB SER 120 12.722 -12.562 10.951 941 HB3 SER 120 3HB SER 120 13.340 -13.958 11.834 942 HG SER 120 HG SER 120 11.239 -13.822 12.411 943 H MET 121 H MET 121 14.596 -13.433 14.668 944 HA MET 121 HA MET 121 17.381 -13.773 13.932 945 HB2 MET 121 2HB MET 121 15.882 -13.773 16.363 946 HB3 MET 121 3HB MET 121 16.722 -15.313 16.230 947 HG2 MET 121 2HG MET 121 18.263 -12.844 15.667 948 HG3 MET 121 3HG MET 121 17.830 -13.187 17.340 949 HE1 MET 121 3HE MET 121 20.749 -13.825 18.172 950 HE2 MET 121 1HE MET 121 19.098 -14.079 18.739 951 HE3 MET 121 2HE MET 121 20.206 -15.446 18.612 952 H LYS 122 H LYS 122 17.890 -15.321 12.533 953 HA LYS 122 HA LYS 122 18.049 -17.350 11.519 954 HB2 LYS 122 2HB LYS 122 18.083 -17.930 14.138 955 HB3 LYS 122 3HB LYS 122 16.602 -18.767 13.692 956 HG2 LYS 122 2HG LYS 122 17.699 -20.264 12.324 957 HG3 LYS 122 3HG LYS 122 19.086 -19.197 12.094 958 HD2 LYS 122 2HD LYS 122 19.811 -19.591 14.370 959 HD3 LYS 122 3HD LYS 122 18.372 -20.563 14.689 960 HE2 LYS 122 2HE LYS 122 20.214 -22.044 14.288 961 HE3 LYS 122 3HE LYS 122 19.116 -22.136 12.912 962 HZ1 LYS 122 3HZ LYS 122 20.784 -20.220 12.106 963 HZ2 LYS 122 1HZ LYS 122 21.004 -21.860 11.755 964 HZ3 LYS 122 2HZ LYS 122 21.839 -21.152 13.044 965 H GLU 123 H GLU 123 16.601 -19.396 10.958 966 HA GLU 123 HA GLU 123 14.803 -20.127 9.769 967 HB2 GLU 123 2HB GLU 123 13.857 -19.823 12.152 968 HB3 GLU 123 3HB GLU 123 13.073 -18.387 11.507 969 HG2 GLU 123 2HG GLU 123 11.409 -19.661 10.815 970 HG3 GLU 123 3HG GLU 123 12.518 -20.444 9.691 971 H ALA 124 H ALA 124 15.370 -19.073 7.843 972 HA ALA 124 HA ALA 124 13.415 -17.202 6.902 973 HB1 ALA 124 1HB ALA 124 14.637 -15.460 7.782 974 HB2 ALA 124 2HB ALA 124 16.182 -16.273 7.528 975 HB3 ALA 124 3HB ALA 124 15.315 -15.579 6.158 976 H GLY 125 H GLY 125 13.575 -16.816 4.602 977 HA2 GLY 125 2HA GLY 125 15.089 -18.959 3.259 978 HA3 GLY 125 3HA GLY 125 13.594 -18.256 2.661 979 H GLY 126 H GLY 126 14.576 -17.845 0.637 980 HA2 GLY 126 2HA GLY 126 15.403 -16.273 -0.850 981 HA3 GLY 126 3HA GLY 126 15.868 -15.274 0.518 982 H LYS 127 H LYS 127 16.904 -18.573 0.416 983 HA LYS 127 HA LYS 127 19.632 -17.656 -0.217 984 HB2 LYS 127 2HB LYS 127 18.999 -18.624 2.133 985 HB3 LYS 127 3HB LYS 127 19.076 -20.175 1.308 986 HG2 LYS 127 2HG LYS 127 21.397 -18.619 0.670 987 HG3 LYS 127 3HG LYS 127 21.189 -18.712 2.421 988 HD2 LYS 127 2HD LYS 127 21.011 -21.145 0.667 989 HD3 LYS 127 3HD LYS 127 22.552 -20.559 1.297 990 HE2 LYS 127 2HE LYS 127 20.976 -20.567 3.532 991 HE3 LYS 127 3HE LYS 127 20.373 -21.970 2.650 992 HZ1 LYS 127 3HZ LYS 127 23.267 -21.689 2.851 993 HZ2 LYS 127 1HZ LYS 127 22.306 -23.081 2.911 994 HZ3 LYS 127 2HZ LYS 127 22.446 -22.090 4.275 995 H GLU 128 H GLU 128 18.865 -18.008 -2.487 996 HA GLU 128 HA GLU 128 19.912 -20.443 -3.482 997 HB2 GLU 128 2HB GLU 128 17.086 -20.405 -2.886 998 HB3 GLU 128 3HB GLU 128 17.347 -20.622 -4.611 999 HG2 GLU 128 2HG GLU 128 18.038 -22.716 -4.347 1000 HG3 GLU 128 3HG GLU 128 19.105 -22.285 -3.012 1001 H GLU 129 H GLU 129 20.195 -20.417 -5.732 1002 HA GLU 129 HA GLU 129 20.397 -17.850 -6.892 1003 HB2 GLU 129 2HB GLU 129 21.119 -20.565 -7.588 1004 HB3 GLU 129 3HB GLU 129 20.486 -19.707 -8.985 1005 HG2 GLU 129 2HG GLU 129 22.275 -18.370 -9.140 1006 HG3 GLU 129 3HG GLU 129 22.425 -18.193 -7.393 1007 H GLY 130 H GLY 130 18.801 -16.645 -7.665 1008 HA2 GLY 130 2HA GLY 130 16.861 -16.017 -8.717 1009 HA3 GLY 130 3HA GLY 130 17.000 -17.505 -9.642 1010 HA PRO 131 HA PRO 131 13.352 -17.568 -6.604 1011 HB2 PRO 131 2HB PRO 131 11.351 -17.351 -8.425 1012 HB3 PRO 131 3HB PRO 131 12.091 -15.951 -7.639 1013 HG2 PRO 131 2HG PRO 131 12.616 -17.096 -10.355 1014 HG3 PRO 131 3HG PRO 131 12.447 -15.399 -9.870 1015 HD2 PRO 131 2HD PRO 131 14.857 -16.563 -10.281 1016 HD3 PRO 131 3HD PRO 131 14.609 -15.277 -9.082 1017 HA PRO 132 HA PRO 132 12.513 -21.811 -7.399 1018 HB2 PRO 132 2HB PRO 132 9.933 -22.074 -6.596 1019 HB3 PRO 132 3HB PRO 132 11.271 -21.839 -5.465 1020 HG2 PRO 132 2HG PRO 132 9.320 -19.835 -6.534 1021 HG3 PRO 132 3HG PRO 132 9.924 -20.036 -4.879 1022 HD2 PRO 132 2HD PRO 132 10.885 -18.144 -6.560 1023 HD3 PRO 132 3HD PRO 132 11.895 -18.929 -5.329 1024 H GLN 133 H GLN 133 9.869 -19.698 -8.511 1025 HA GLN 133 HA GLN 133 8.782 -21.509 -10.370 1026 HB2 GLN 133 2HB GLN 133 7.989 -19.124 -9.407 1027 HB3 GLN 133 3HB GLN 133 8.604 -18.613 -10.974 1028 HG2 GLN 133 2HG GLN 133 6.326 -19.015 -11.305 1029 HG3 GLN 133 3HG GLN 133 7.145 -20.423 -11.978 1030 HE21 GLN 133 1HE2 GLN 133 5.929 -22.135 -11.635 1031 HE22 GLN 133 2HE2 GLN 133 5.144 -22.546 -10.153 1032 H ALA 134 H ALA 134 8.776 -21.225 -12.745 1033 HA ALA 134 HA ALA 134 11.512 -20.905 -13.694 1034 HB1 ALA 134 1HB ALA 134 9.608 -21.662 -15.729 1035 HB2 ALA 134 2HB ALA 134 11.019 -22.533 -15.126 1036 HB3 ALA 134 3HB ALA 134 9.467 -22.689 -14.302 1037 H TYR 135 H TYR 135 8.277 -19.895 -14.818 1038 HA TYR 135 HA TYR 135 9.535 -17.633 -16.199 1039 HB2 TYR 135 2HB TYR 135 7.786 -19.378 -17.212 1040 HB3 TYR 135 3HB TYR 135 6.638 -18.230 -16.532 1041 HD1 TYR 135 HD2 TYR 135 6.645 -15.869 -17.325 1042 HD2 TYR 135 HD1 TYR 135 9.021 -18.870 -19.182 1043 HE1 TYR 135 HE2 TYR 135 6.912 -14.427 -19.299 1044 HE2 TYR 135 HE1 TYR 135 9.296 -17.436 -21.161 1045 HH TYR 135 HH TYR 135 7.509 -15.138 -22.030 Start of MODEL 14 1 H21 MYR 1 1H2 MYR 1 1.546 10.787 2.625 2 H22 MYR 1 2H2 MYR 1 2.999 10.050 3.270 3 H31 MYR 1 1H3 MYR 1 3.397 12.072 1.011 4 H32 MYR 1 2H3 MYR 1 2.584 10.569 0.571 5 H41 MYR 1 1H4 MYR 1 5.236 10.559 2.151 6 H42 MYR 1 2H4 MYR 1 5.217 10.659 0.389 7 H51 MYR 1 1H5 MYR 1 3.569 8.449 1.720 8 H52 MYR 1 2H5 MYR 1 5.325 8.274 1.697 9 H61 MYR 1 1H6 MYR 1 5.410 7.908 -0.602 10 H62 MYR 1 2H6 MYR 1 4.167 9.110 -0.956 11 H71 MYR 1 1H7 MYR 1 2.363 7.578 -0.575 12 H72 MYR 1 2H7 MYR 1 3.332 6.520 0.454 13 H81 MYR 1 1H8 MYR 1 4.252 5.351 -1.348 14 H82 MYR 1 2H8 MYR 1 4.369 6.785 -2.371 15 H91 MYR 1 1H9 MYR 1 2.694 5.171 -3.287 16 H92 MYR 1 2H9 MYR 1 1.925 6.704 -2.874 17 H101 MYR 1 1H10 MYR 1 0.650 5.789 -1.174 18 H102 MYR 1 2H10 MYR 1 1.929 4.737 -0.590 19 H111 MYR 1 1H11 MYR 1 0.660 4.039 -3.281 20 H112 MYR 1 2H11 MYR 1 -0.342 3.866 -1.849 21 H121 MYR 1 1H12 MYR 1 2.453 2.597 -1.895 22 H122 MYR 1 2H12 MYR 1 1.099 1.787 -2.682 23 H131 MYR 1 1H13 MYR 1 -0.123 2.316 -0.279 24 H132 MYR 1 2H13 MYR 1 1.548 2.319 0.287 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 4.835 12.064 3.507 29 HA2 GLY 2 2HA GLY 2 3.452 14.392 4.638 30 HA3 GLY 2 3HA GLY 2 4.484 13.441 5.696 31 H ASN 3 H ASN 3 4.358 16.036 3.580 32 HA ASN 3 HA ASN 3 5.915 17.469 2.748 33 HB2 ASN 3 2HB ASN 3 6.689 17.126 5.217 34 HB3 ASN 3 3HB ASN 3 8.005 16.205 4.493 35 HD21 ASN 3 1HD2 ASN 3 9.744 17.286 3.904 36 HD22 ASN 3 2HD2 ASN 3 9.843 18.994 3.668 37 H GLY 4 H GLY 4 5.497 15.469 1.061 38 HA2 GLY 4 2HA GLY 4 6.568 14.810 -0.918 39 HA3 GLY 4 3HA GLY 4 8.121 15.106 -0.151 40 H ALA 5 H ALA 5 7.993 12.892 -1.593 41 HA ALA 5 HA ALA 5 7.537 10.710 0.334 42 HB1 ALA 5 1HB ALA 5 6.410 9.708 -1.292 43 HB2 ALA 5 2HB ALA 5 6.821 10.997 -2.424 44 HB3 ALA 5 3HB ALA 5 7.902 9.617 -2.229 45 H SER 6 H SER 6 9.376 10.154 1.301 46 HA SER 6 HA SER 6 11.617 9.256 -0.237 47 HB2 SER 6 2HB SER 6 13.134 10.899 1.221 48 HB3 SER 6 3HB SER 6 12.513 11.366 -0.362 49 HG SER 6 HG SER 6 10.922 12.550 0.615 50 H ARG 7 H ARG 7 10.923 10.512 3.032 51 HA ARG 7 HA ARG 7 12.437 8.436 4.294 52 HB2 ARG 7 2HB ARG 7 11.021 10.853 5.104 53 HB3 ARG 7 3HB ARG 7 10.806 9.535 6.248 54 HG2 ARG 7 2HG ARG 7 12.949 9.601 6.932 55 HG3 ARG 7 3HG ARG 7 13.564 9.982 5.323 56 HD2 ARG 7 2HD ARG 7 12.102 11.943 7.083 57 HD3 ARG 7 3HD ARG 7 13.858 11.802 7.012 58 HE ARG 7 HE ARG 7 12.159 13.089 5.110 59 HH11 ARG 7 1HH1 ARG 7 15.159 11.365 5.495 60 HH12 ARG 7 2HH1 ARG 7 15.902 12.086 4.105 61 HH21 ARG 7 1HH2 ARG 7 13.126 14.045 3.279 62 HH22 ARG 7 2HH2 ARG 7 14.745 13.610 2.846 63 H ASP 8 H ASP 8 8.961 9.245 4.411 64 HA ASP 8 HA ASP 8 8.080 6.977 5.722 65 HB2 ASP 8 2HB ASP 8 6.811 8.904 3.829 66 HB3 ASP 8 3HB ASP 8 5.933 7.431 4.232 67 H TRP 9 H TRP 9 9.005 7.385 2.389 68 HA TRP 9 HA TRP 9 7.851 4.922 1.479 69 HB2 TRP 9 2HB TRP 9 8.164 6.678 -0.132 70 HB3 TRP 9 3HB TRP 9 9.879 6.797 0.252 71 HD1 TRP 9 HD1 TRP 9 11.517 5.103 -0.922 72 HE1 TRP 9 HE1 TRP 9 11.219 3.392 -2.821 73 HE3 TRP 9 HE3 TRP 9 6.409 4.997 -1.127 74 HZ2 TRP 9 HZ2 TRP 9 9.101 2.161 -4.222 75 HZ3 TRP 9 HZ3 TRP 9 5.326 3.526 -2.776 76 HH2 TRP 9 HH2 TRP 9 6.645 2.139 -4.290 77 H LYS 10 H LYS 10 11.267 5.942 1.650 78 HA LYS 10 HA LYS 10 12.413 3.447 1.355 79 HB2 LYS 10 2HB LYS 10 13.391 5.833 2.929 80 HB3 LYS 10 3HB LYS 10 14.380 4.419 2.584 81 HG2 LYS 10 2HG LYS 10 13.165 5.479 0.184 82 HG3 LYS 10 3HG LYS 10 14.130 6.694 1.026 83 HD2 LYS 10 2HD LYS 10 16.087 5.520 0.759 84 HD3 LYS 10 3HD LYS 10 15.264 3.962 0.657 85 HE2 LYS 10 2HE LYS 10 14.301 4.886 -1.558 86 HE3 LYS 10 3HE LYS 10 15.611 6.061 -1.453 87 HZ1 LYS 10 3HZ LYS 10 16.415 4.278 -2.736 88 HZ2 LYS 10 1HZ LYS 10 15.829 3.115 -1.657 89 HZ3 LYS 10 2HZ LYS 10 17.135 4.095 -1.216 90 H MET 11 H MET 11 10.958 4.884 4.179 91 HA MET 11 HA MET 11 12.029 3.042 6.072 92 HB2 MET 11 2HB MET 11 11.114 5.302 6.638 93 HB3 MET 11 3HB MET 11 9.503 4.685 6.301 94 HG2 MET 11 2HG MET 11 9.746 4.587 8.628 95 HG3 MET 11 3HG MET 11 9.948 2.931 8.060 96 HE1 MET 11 3HE MET 11 10.490 4.607 10.580 97 HE2 MET 11 1HE MET 11 11.799 3.643 11.264 98 HE3 MET 11 2HE MET 11 12.099 5.307 10.762 99 H ALA 12 H ALA 12 8.763 3.369 4.669 100 HA ALA 12 HA ALA 12 7.624 1.091 5.738 101 HB1 ALA 12 1HB ALA 12 6.397 1.176 3.338 102 HB2 ALA 12 2HB ALA 12 6.011 2.256 4.679 103 HB3 ALA 12 3HB ALA 12 7.094 2.796 3.396 104 H ILE 13 H ILE 13 9.885 1.394 3.103 105 HA ILE 13 HA ILE 13 9.497 -1.311 2.170 106 HB ILE 13 HB ILE 13 11.654 0.689 1.482 107 HG12 ILE 13 2HG1 ILE 13 9.366 1.396 0.848 108 HG13 ILE 13 3HG1 ILE 13 10.380 1.079 -0.555 109 HG21 ILE 13 1HG2 ILE 13 11.299 -2.115 0.825 110 HG22 ILE 13 2HG2 ILE 13 11.397 -1.095 -0.610 111 HG23 ILE 13 3HG2 ILE 13 12.695 -1.065 0.583 112 HD11 ILE 13 3HD1 ILE 13 9.059 -1.330 0.088 113 HD12 ILE 13 1HD1 ILE 13 7.859 -0.038 0.116 114 HD13 ILE 13 2HD1 ILE 13 8.840 -0.300 -1.326 115 H LYS 14 H LYS 14 12.046 0.472 3.893 116 HA LYS 14 HA LYS 14 13.902 -1.547 4.199 117 HB2 LYS 14 2HB LYS 14 13.325 0.994 5.467 118 HB3 LYS 14 3HB LYS 14 13.942 -0.170 6.633 119 HG2 LYS 14 2HG LYS 14 15.358 0.151 4.034 120 HG3 LYS 14 3HG LYS 14 15.562 1.380 5.285 121 HD2 LYS 14 2HD LYS 14 16.693 -0.027 6.675 122 HD3 LYS 14 3HD LYS 14 15.827 -1.458 6.107 123 HE2 LYS 14 2HE LYS 14 17.268 -1.810 4.379 124 HE3 LYS 14 3HE LYS 14 17.620 -0.094 4.179 125 HZ1 LYS 14 3HZ LYS 14 19.574 -0.901 5.045 126 HZ2 LYS 14 1HZ LYS 14 18.809 -2.023 6.054 127 HZ3 LYS 14 2HZ LYS 14 18.790 -0.379 6.451 128 H ARG 15 H ARG 15 10.869 -1.076 5.853 129 HA ARG 15 HA ARG 15 11.459 -3.202 7.763 130 HB2 ARG 15 2HB ARG 15 9.697 -0.924 7.702 131 HB3 ARG 15 3HB ARG 15 8.778 -2.386 8.032 132 HG2 ARG 15 2HG ARG 15 9.340 -1.923 10.157 133 HG3 ARG 15 3HG ARG 15 10.835 -2.751 9.718 134 HD2 ARG 15 2HD ARG 15 11.521 -0.758 10.753 135 HD3 ARG 15 3HD ARG 15 11.710 -0.466 9.024 136 HE ARG 15 HE ARG 15 10.174 1.207 9.202 137 HH11 ARG 15 1HH1 ARG 15 9.781 -0.949 11.907 138 HH12 ARG 15 2HH1 ARG 15 8.582 0.032 12.683 139 HH21 ARG 15 1HH2 ARG 15 8.596 2.507 10.213 140 HH22 ARG 15 2HH2 ARG 15 7.908 1.997 11.717 141 H CYS 16 H CYS 16 9.409 -2.527 4.987 142 HA CYS 16 HA CYS 16 7.789 -4.828 5.145 143 HB2 CYS 16 2HB CYS 16 7.134 -2.967 3.749 144 HB3 CYS 16 3HB CYS 16 8.589 -3.132 2.774 145 HG CYS 16 HG CYS 16 7.492 -5.974 2.314 146 H SER 17 H SER 17 11.025 -4.316 4.021 147 HA SER 17 HA SER 17 11.361 -6.448 2.271 148 HB2 SER 17 2HB SER 17 13.047 -4.659 2.711 149 HB3 SER 17 3HB SER 17 13.412 -5.433 4.253 150 HG SER 17 HG SER 17 14.490 -6.947 3.245 151 H ASN 18 H ASN 18 11.010 -6.426 5.713 152 HA ASN 18 HA ASN 18 12.222 -8.811 6.442 153 HB2 ASN 18 2HB ASN 18 9.883 -7.272 7.508 154 HB3 ASN 18 3HB ASN 18 10.247 -8.861 8.175 155 HD21 ASN 18 1HD2 ASN 18 10.672 -7.835 10.175 156 HD22 ASN 18 2HD2 ASN 18 12.173 -7.028 10.454 157 H VAL 19 H VAL 19 9.204 -8.246 4.782 158 HA VAL 19 HA VAL 19 7.875 -10.636 5.134 159 HB VAL 19 HB VAL 19 6.776 -10.251 3.015 160 HG11 VAL 19 1HG1 VAL 19 7.096 -8.240 5.042 161 HG12 VAL 19 2HG1 VAL 19 6.774 -7.488 3.478 162 HG13 VAL 19 3HG1 VAL 19 5.656 -8.688 4.128 163 HG21 VAL 19 3HG2 VAL 19 7.659 -8.164 1.703 164 HG22 VAL 19 1HG2 VAL 19 9.190 -8.585 2.470 165 HG23 VAL 19 2HG2 VAL 19 8.373 -9.754 1.433 166 H ALA 20 H ALA 20 8.062 -12.677 4.386 167 HA ALA 20 HA ALA 20 10.322 -13.247 2.579 168 HB1 ALA 20 1HB ALA 20 10.352 -14.034 5.069 169 HB2 ALA 20 2HB ALA 20 9.278 -15.301 4.475 170 HB3 ALA 20 3HB ALA 20 10.892 -15.119 3.789 171 H VAL 21 H VAL 21 10.056 -14.847 1.002 172 HA VAL 21 HA VAL 21 7.561 -14.969 -0.250 173 HB VAL 21 HB VAL 21 9.809 -16.954 -0.600 174 HG11 VAL 21 1HG1 VAL 21 7.350 -16.274 -2.129 175 HG12 VAL 21 2HG1 VAL 21 8.797 -16.737 -3.027 176 HG13 VAL 21 3HG1 VAL 21 8.104 -17.842 -1.839 177 HG21 VAL 21 3HG2 VAL 21 10.847 -14.874 -0.890 178 HG22 VAL 21 1HG2 VAL 21 10.412 -15.376 -2.524 179 HG23 VAL 21 2HG2 VAL 21 9.432 -14.178 -1.679 180 H GLY 22 H GLY 22 8.956 -16.947 2.238 181 HA2 GLY 22 2HA GLY 22 6.521 -18.616 2.192 182 HA3 GLY 22 3HA GLY 22 8.107 -19.328 2.449 183 H VAL 23 H VAL 23 6.657 -20.039 4.377 184 HA VAL 23 HA VAL 23 6.020 -18.290 6.454 185 HB VAL 23 HB VAL 23 5.244 -20.624 6.367 186 HG11 VAL 23 1HG1 VAL 23 7.328 -21.651 5.593 187 HG12 VAL 23 2HG1 VAL 23 8.069 -21.327 7.161 188 HG13 VAL 23 3HG1 VAL 23 6.712 -22.447 7.041 189 HG21 VAL 23 3HG2 VAL 23 6.031 -19.167 8.623 190 HG22 VAL 23 1HG2 VAL 23 4.851 -20.476 8.550 191 HG23 VAL 23 2HG2 VAL 23 6.536 -20.828 8.931 192 H GLY 24 H GLY 24 9.073 -19.702 5.521 193 HA2 GLY 24 2HA GLY 24 10.658 -17.861 6.852 194 HA3 GLY 24 3HA GLY 24 10.455 -19.211 7.958 195 H GLY 25 H GLY 25 12.026 -18.051 5.125 196 HA2 GLY 25 2HA GLY 25 13.265 -20.688 4.682 197 HA3 GLY 25 3HA GLY 25 13.213 -19.385 3.504 198 H LYS 26 H LYS 26 15.590 -20.490 3.823 199 HA LYS 26 HA LYS 26 17.261 -19.674 5.867 200 HB2 LYS 26 2HB LYS 26 17.823 -20.098 2.933 201 HB3 LYS 26 3HB LYS 26 19.091 -19.780 4.110 202 HG2 LYS 26 2HG LYS 26 17.656 -21.847 5.245 203 HG3 LYS 26 3HG LYS 26 17.669 -22.237 3.523 204 HD2 LYS 26 2HD LYS 26 19.638 -23.211 4.161 205 HD3 LYS 26 3HD LYS 26 20.221 -21.595 3.756 206 HE2 LYS 26 2HE LYS 26 21.051 -21.455 5.812 207 HE3 LYS 26 3HE LYS 26 19.398 -21.446 6.423 208 HZ1 LYS 26 3HZ LYS 26 21.372 -23.552 6.482 209 HZ2 LYS 26 1HZ LYS 26 19.829 -24.064 6.013 210 HZ3 LYS 26 2HZ LYS 26 20.046 -23.282 7.497 211 H SER 27 H SER 27 16.402 -17.942 2.895 212 HA SER 27 HA SER 27 16.638 -15.399 4.099 213 HB2 SER 27 2HB SER 27 19.102 -16.238 3.726 214 HB3 SER 27 3HB SER 27 18.794 -15.779 2.052 215 HG SER 27 HG SER 27 19.053 -13.784 2.621 216 H LYS 28 H LYS 28 14.607 -16.450 2.715 217 HA LYS 28 HA LYS 28 14.758 -15.341 0.001 218 HB2 LYS 28 2HB LYS 28 12.836 -17.272 1.296 219 HB3 LYS 28 3HB LYS 28 12.549 -16.560 -0.287 220 HG2 LYS 28 2HG LYS 28 15.175 -17.631 -0.273 221 HG3 LYS 28 3HG LYS 28 14.077 -18.851 0.375 222 HD2 LYS 28 2HD LYS 28 13.009 -19.124 -1.600 223 HD3 LYS 28 3HD LYS 28 13.129 -17.414 -2.020 224 HE2 LYS 28 2HE LYS 28 15.433 -17.693 -2.676 225 HE3 LYS 28 3HE LYS 28 15.426 -19.366 -2.121 226 HZ1 LYS 28 3HZ LYS 28 13.862 -18.250 -4.384 227 HZ2 LYS 28 1HZ LYS 28 13.719 -19.835 -3.810 228 HZ3 LYS 28 2HZ LYS 28 15.176 -19.310 -4.490 229 H LYS 29 H LYS 29 14.697 -13.174 1.044 230 HA LYS 29 HA LYS 29 11.958 -12.401 1.800 231 HB2 LYS 29 2HB LYS 29 14.449 -10.780 2.300 232 HB3 LYS 29 3HB LYS 29 12.862 -10.579 3.031 233 HG2 LYS 29 2HG LYS 29 13.159 -12.778 4.145 234 HG3 LYS 29 3HG LYS 29 14.803 -12.831 3.505 235 HD2 LYS 29 2HD LYS 29 13.804 -10.529 5.162 236 HD3 LYS 29 3HD LYS 29 14.506 -11.976 5.891 237 HE2 LYS 29 2HE LYS 29 16.538 -11.155 5.540 238 HE3 LYS 29 3HE LYS 29 16.230 -11.149 3.804 239 HZ1 LYS 29 3HZ LYS 29 15.820 -8.947 3.794 240 HZ2 LYS 29 1HZ LYS 29 16.775 -8.958 5.190 241 HZ3 LYS 29 2HZ LYS 29 15.088 -8.945 5.319 242 H PHE 30 H PHE 30 11.103 -10.431 0.958 243 HA PHE 30 HA PHE 30 11.878 -9.977 -1.787 244 HB2 PHE 30 2HB PHE 30 9.578 -9.181 -0.058 245 HB3 PHE 30 3HB PHE 30 9.909 -8.228 -1.500 246 HD1 PHE 30 HD1 PHE 30 10.599 -10.006 -3.553 247 HD2 PHE 30 HD2 PHE 30 7.839 -10.629 -0.373 248 HE1 PHE 30 HE1 PHE 30 9.401 -11.662 -4.923 249 HE2 PHE 30 HE2 PHE 30 6.637 -12.287 -1.738 250 HZ PHE 30 HZ PHE 30 7.418 -12.806 -4.015 251 H GLY 31 H GLY 31 11.589 -7.480 -2.435 252 HA2 GLY 31 2HA GLY 31 12.902 -5.699 -0.554 253 HA3 GLY 31 3HA GLY 31 13.858 -6.132 -1.963 254 H GLU 32 H GLU 32 13.404 -3.538 -1.659 255 HA GLU 32 HA GLU 32 11.068 -2.399 -2.587 256 HB2 GLU 32 2HB GLU 32 12.326 -0.443 -3.068 257 HB3 GLU 32 3HB GLU 32 13.110 -1.209 -1.694 258 HG2 GLU 32 2HG GLU 32 14.742 -2.222 -3.282 259 HG3 GLU 32 3HG GLU 32 14.014 -1.252 -4.561 260 H GLY 33 H GLY 33 13.625 -3.976 -4.387 261 HA2 GLY 33 2HA GLY 33 12.962 -3.075 -6.967 262 HA3 GLY 33 3HA GLY 33 13.801 -4.574 -6.595 263 H ASN 34 H ASN 34 11.945 -6.026 -5.253 264 HA ASN 34 HA ASN 34 10.310 -6.997 -7.336 265 HB2 ASN 34 2HB ASN 34 10.357 -7.538 -4.367 266 HB3 ASN 34 3HB ASN 34 9.248 -8.360 -5.460 267 HD21 ASN 34 1HD2 ASN 34 12.444 -8.161 -4.271 268 HD22 ASN 34 2HD2 ASN 34 13.108 -9.470 -5.183 269 H PHE 35 H PHE 35 9.542 -5.137 -4.407 270 HA PHE 35 HA PHE 35 6.774 -5.002 -4.766 271 HB2 PHE 35 2HB PHE 35 8.510 -2.864 -3.519 272 HB3 PHE 35 3HB PHE 35 6.804 -3.162 -3.203 273 HD1 PHE 35 HD1 PHE 35 6.719 -6.058 -2.872 274 HD2 PHE 35 HD2 PHE 35 9.599 -3.234 -1.516 275 HE1 PHE 35 HE1 PHE 35 7.323 -7.567 -1.025 276 HE2 PHE 35 HE2 PHE 35 10.209 -4.738 0.333 277 HZ PHE 35 HZ PHE 35 9.071 -6.908 0.580 278 H ARG 36 H ARG 36 9.298 -2.697 -5.758 279 HA ARG 36 HA ARG 36 7.651 -0.803 -6.955 280 HB2 ARG 36 2HB ARG 36 10.498 -1.628 -7.454 281 HB3 ARG 36 3HB ARG 36 9.738 -0.366 -8.415 282 HG2 ARG 36 2HG ARG 36 9.311 0.928 -6.393 283 HG3 ARG 36 3HG ARG 36 10.053 -0.344 -5.420 284 HD2 ARG 36 2HD ARG 36 11.430 1.261 -7.572 285 HD3 ARG 36 3HD ARG 36 11.601 1.511 -5.835 286 HE ARG 36 HE ARG 36 12.295 -1.086 -6.170 287 HH11 ARG 36 1HH1 ARG 36 13.327 1.892 -7.649 288 HH12 ARG 36 2HH1 ARG 36 14.939 1.334 -7.955 289 HH21 ARG 36 1HH2 ARG 36 14.414 -1.833 -6.567 290 HH22 ARG 36 2HH2 ARG 36 15.555 -0.785 -7.340 291 H TRP 37 H TRP 37 8.988 -3.796 -8.251 292 HA TRP 37 HA TRP 37 8.308 -3.426 -10.941 293 HB2 TRP 37 2HB TRP 37 9.795 -5.208 -10.329 294 HB3 TRP 37 3HB TRP 37 8.575 -5.945 -9.294 295 HD1 TRP 37 HD1 TRP 37 9.555 -5.571 -12.972 296 HE1 TRP 37 HE1 TRP 37 8.253 -7.310 -14.352 297 HE3 TRP 37 HE3 TRP 37 6.419 -7.315 -9.330 298 HZ2 TRP 37 HZ2 TRP 37 6.171 -9.173 -13.951 299 HZ3 TRP 37 HZ3 TRP 37 4.802 -9.075 -9.911 300 HH2 TRP 37 HH2 TRP 37 4.681 -9.984 -12.174 301 H ALA 38 H ALA 38 6.505 -5.089 -8.358 302 HA ALA 38 HA ALA 38 4.233 -5.648 -9.954 303 HB1 ALA 38 1HB ALA 38 4.575 -6.972 -8.018 304 HB2 ALA 38 2HB ALA 38 4.629 -5.552 -6.973 305 HB3 ALA 38 3HB ALA 38 3.111 -6.030 -7.732 306 H ILE 39 H ILE 39 4.773 -3.186 -7.430 307 HA ILE 39 HA ILE 39 2.348 -1.877 -7.580 308 HB ILE 39 HB ILE 39 5.052 -0.620 -7.103 309 HG12 ILE 39 2HG1 ILE 39 3.064 -1.445 -5.001 310 HG13 ILE 39 3HG1 ILE 39 4.242 -2.591 -5.632 311 HG21 ILE 39 1HG2 ILE 39 2.394 0.496 -7.233 312 HG22 ILE 39 2HG2 ILE 39 3.109 0.729 -5.639 313 HG23 ILE 39 3HG2 ILE 39 3.950 1.311 -7.075 314 HD11 ILE 39 3HD1 ILE 39 5.095 -1.659 -3.614 315 HD12 ILE 39 1HD1 ILE 39 6.038 -1.013 -4.958 316 HD13 ILE 39 2HD1 ILE 39 4.803 -0.017 -4.187 317 H ARG 40 H ARG 40 5.326 -1.048 -9.360 318 HA ARG 40 HA ARG 40 4.332 1.052 -10.862 319 HB2 ARG 40 2HB ARG 40 6.718 0.369 -10.752 320 HB3 ARG 40 3HB ARG 40 6.344 -1.008 -11.780 321 HG2 ARG 40 2HG ARG 40 6.120 0.271 -13.655 322 HG3 ARG 40 3HG ARG 40 5.622 1.703 -12.752 323 HD2 ARG 40 2HD ARG 40 7.958 1.874 -11.887 324 HD3 ARG 40 3HD ARG 40 8.402 0.561 -12.976 325 HE ARG 40 HE ARG 40 7.229 2.399 -14.602 326 HH11 ARG 40 1HH1 ARG 40 9.845 2.490 -12.307 327 HH12 ARG 40 2HH1 ARG 40 10.707 3.740 -13.142 328 HH21 ARG 40 1HH2 ARG 40 8.355 4.045 -15.711 329 HH22 ARG 40 2HH2 ARG 40 9.858 4.624 -15.077 330 H MET 41 H MET 41 4.341 -2.412 -11.657 331 HA MET 41 HA MET 41 3.253 -2.311 -14.191 332 HB2 MET 41 2HB MET 41 3.267 -4.316 -12.002 333 HB3 MET 41 3HB MET 41 2.103 -4.565 -13.297 334 HG2 MET 41 2HG MET 41 4.830 -3.939 -14.181 335 HG3 MET 41 3HG MET 41 4.650 -5.466 -13.320 336 HE1 MET 41 3HE MET 41 3.809 -4.307 -17.442 337 HE2 MET 41 1HE MET 41 4.968 -3.807 -16.210 338 HE3 MET 41 2HE MET 41 5.186 -5.340 -17.054 339 H ALA 42 H ALA 42 1.585 -2.256 -11.071 340 HA ALA 42 HA ALA 42 -1.035 -2.226 -12.231 341 HB1 ALA 42 1HB ALA 42 -0.837 -1.179 -9.519 342 HB2 ALA 42 2HB ALA 42 -1.743 -2.560 -10.140 343 HB3 ALA 42 3HB ALA 42 -0.038 -2.738 -9.724 344 H ASN 43 H ASN 43 1.161 0.210 -10.906 345 HA ASN 43 HA ASN 43 -0.555 2.403 -10.923 346 HB2 ASN 43 2HB ASN 43 2.121 1.978 -10.354 347 HB3 ASN 43 3HB ASN 43 2.171 3.073 -11.732 348 HD21 ASN 43 1HD2 ASN 43 1.970 5.158 -11.339 349 HD22 ASN 43 2HD2 ASN 43 1.367 5.859 -9.880 350 H VAL 44 H VAL 44 0.995 0.745 -13.535 351 HA VAL 44 HA VAL 44 0.252 2.877 -15.414 352 HB VAL 44 HB VAL 44 1.972 0.445 -15.920 353 HG11 VAL 44 1HG1 VAL 44 1.464 2.909 -17.586 354 HG12 VAL 44 2HG1 VAL 44 2.614 1.627 -17.973 355 HG13 VAL 44 3HG1 VAL 44 0.885 1.279 -17.930 356 HG21 VAL 44 3HG2 VAL 44 3.366 1.638 -14.567 357 HG22 VAL 44 1HG2 VAL 44 3.706 2.445 -16.098 358 HG23 VAL 44 2HG2 VAL 44 2.595 3.179 -14.941 359 H SER 45 H SER 45 0.321 -0.691 -15.480 360 HA SER 45 HA SER 45 -1.514 -1.060 -17.509 361 HB2 SER 45 2HB SER 45 -1.592 -3.311 -16.883 362 HB3 SER 45 3HB SER 45 -0.044 -2.782 -16.225 363 HG SER 45 HG SER 45 -0.768 -3.310 -14.338 364 H THR 46 H THR 46 -2.094 -0.618 -14.056 365 HA THR 46 HA THR 46 -4.966 -0.323 -14.652 366 HB THR 46 HB THR 46 -5.554 -1.243 -12.538 367 HG1 THR 46 HG1 THR 46 -4.016 -0.526 -11.142 368 HG21 THR 46 3HG2 THR 46 -4.963 -3.475 -12.826 369 HG22 THR 46 1HG2 THR 46 -3.335 -3.077 -13.371 370 HG23 THR 46 2HG2 THR 46 -4.713 -2.798 -14.435 371 H GLY 47 H GLY 47 -3.193 1.824 -14.831 372 HA2 GLY 47 2HA GLY 47 -4.376 3.603 -12.886 373 HA3 GLY 47 3HA GLY 47 -2.640 3.401 -12.701 374 H ARG 48 H ARG 48 -1.592 3.435 -15.112 375 HA ARG 48 HA ARG 48 -0.953 4.768 -16.841 376 HB2 ARG 48 2HB ARG 48 -3.756 4.559 -17.036 377 HB3 ARG 48 3HB ARG 48 -3.376 6.255 -17.302 378 HG2 ARG 48 2HG ARG 48 -3.299 5.376 -19.433 379 HG3 ARG 48 3HG ARG 48 -1.602 5.358 -18.951 380 HD2 ARG 48 2HD ARG 48 -1.801 3.000 -18.338 381 HD3 ARG 48 3HD ARG 48 -3.501 3.019 -18.806 382 HE ARG 48 HE ARG 48 -2.844 2.760 -20.972 383 HH11 ARG 48 1HH1 ARG 48 -0.163 4.022 -19.145 384 HH12 ARG 48 2HH1 ARG 48 0.954 3.920 -20.466 385 HH21 ARG 48 1HH2 ARG 48 -1.383 2.621 -22.719 386 HH22 ARG 48 2HH2 ARG 48 0.259 3.124 -22.498 387 H GLU 49 H GLU 49 -0.940 7.170 -17.578 388 HA GLU 49 HA GLU 49 -0.416 9.334 -17.110 389 HB2 GLU 49 2HB GLU 49 -2.021 9.084 -14.574 390 HB3 GLU 49 3HB GLU 49 -1.715 10.528 -15.530 391 HG2 GLU 49 2HG GLU 49 -2.979 9.028 -17.361 392 HG3 GLU 49 3HG GLU 49 -3.721 8.403 -15.889 393 HA PRO 50 HA PRO 50 3.091 9.206 -14.473 394 HB2 PRO 50 2HB PRO 50 3.471 11.849 -13.985 395 HB3 PRO 50 3HB PRO 50 3.816 11.102 -15.549 396 HG2 PRO 50 2HG PRO 50 1.415 12.668 -14.685 397 HG3 PRO 50 3HG PRO 50 2.317 12.754 -16.209 398 HD2 PRO 50 2HD PRO 50 -0.022 11.410 -15.975 399 HD3 PRO 50 3HD PRO 50 1.269 10.895 -17.080 400 H GLY 51 H GLY 51 0.627 11.521 -13.316 401 HA2 GLY 51 2HA GLY 51 1.431 11.075 -10.562 402 HA3 GLY 51 3HA GLY 51 0.187 12.183 -11.121 403 H ASP 52 H ASP 52 0.840 8.690 -10.889 404 HA ASP 52 HA ASP 52 -1.988 8.327 -10.141 405 HB2 ASP 52 2HB ASP 52 -0.878 7.334 -12.411 406 HB3 ASP 52 3HB ASP 52 -0.572 6.005 -11.296 407 H ILE 53 H ILE 53 -0.026 8.881 -8.251 408 HA ILE 53 HA ILE 53 0.234 6.279 -6.889 409 HB ILE 53 HB ILE 53 2.101 8.624 -6.542 410 HG12 ILE 53 2HG1 ILE 53 2.558 6.053 -8.071 411 HG13 ILE 53 3HG1 ILE 53 2.272 7.626 -8.807 412 HG21 ILE 53 1HG2 ILE 53 3.075 6.009 -5.780 413 HG22 ILE 53 2HG2 ILE 53 3.011 7.504 -4.848 414 HG23 ILE 53 3HG2 ILE 53 1.606 6.441 -4.906 415 HD11 ILE 53 3HD1 ILE 53 4.327 8.475 -7.961 416 HD12 ILE 53 1HD1 ILE 53 4.579 7.035 -6.974 417 HD13 ILE 53 2HD1 ILE 53 4.656 6.924 -8.733 418 HA PRO 54 HA PRO 54 -2.485 8.984 -4.319 419 HB2 PRO 54 2HB PRO 54 -4.152 6.972 -3.582 420 HB3 PRO 54 3HB PRO 54 -4.352 7.883 -5.083 421 HG2 PRO 54 2HG PRO 54 -3.106 5.196 -4.649 422 HG3 PRO 54 3HG PRO 54 -4.206 5.725 -5.935 423 HD2 PRO 54 2HD PRO 54 -1.531 5.525 -6.299 424 HD3 PRO 54 3HD PRO 54 -2.520 6.739 -7.135 425 H GLU 55 H GLU 55 -3.099 8.684 -1.995 426 HA GLU 55 HA GLU 55 -1.253 6.893 -0.571 427 HB2 GLU 55 2HB GLU 55 -1.800 9.748 0.249 428 HB3 GLU 55 3HB GLU 55 -0.665 8.629 0.992 429 HG2 GLU 55 2HG GLU 55 0.787 9.834 -0.255 430 HG3 GLU 55 3HG GLU 55 0.353 8.611 -1.447 431 H THR 56 H THR 56 -3.938 6.352 -1.063 432 HA THR 56 HA THR 56 -5.061 6.566 1.651 433 HB THR 56 HB THR 56 -7.274 6.846 0.818 434 HG1 THR 56 HG1 THR 56 -7.770 6.705 -1.361 435 HG21 THR 56 3HG2 THR 56 -5.486 8.640 -0.825 436 HG22 THR 56 1HG2 THR 56 -5.873 8.888 0.877 437 HG23 THR 56 2HG2 THR 56 -7.148 8.971 -0.339 438 H LEU 57 H LEU 57 -5.871 4.724 2.516 439 HA LEU 57 HA LEU 57 -5.092 2.238 1.565 440 HB2 LEU 57 2HB LEU 57 -6.783 3.262 3.700 441 HB3 LEU 57 3HB LEU 57 -7.323 1.696 3.099 442 HG LEU 57 HG LEU 57 -5.880 1.413 5.022 443 HD11 LEU 57 1HD1 LEU 57 -4.370 -0.190 4.123 444 HD12 LEU 57 2HD1 LEU 57 -4.361 0.609 2.551 445 HD13 LEU 57 3HD1 LEU 57 -5.818 -0.209 3.115 446 HD21 LEU 57 3HD2 LEU 57 -4.528 3.316 5.088 447 HD22 LEU 57 1HD2 LEU 57 -3.989 3.105 3.422 448 HD23 LEU 57 2HD2 LEU 57 -3.411 2.013 4.680 449 H ASP 58 H ASP 58 -7.952 4.102 0.869 450 HA ASP 58 HA ASP 58 -9.546 2.032 -0.201 451 HB2 ASP 58 2HB ASP 58 -9.614 4.917 -1.083 452 HB3 ASP 58 3HB ASP 58 -10.937 3.754 -1.084 453 H GLN 59 H GLN 59 -7.549 4.481 -1.856 454 HA GLN 59 HA GLN 59 -7.876 3.533 -4.446 455 HB2 GLN 59 2HB GLN 59 -6.065 5.346 -3.064 456 HB3 GLN 59 3HB GLN 59 -5.276 4.502 -4.390 457 HG2 GLN 59 2HG GLN 59 -6.151 6.572 -5.200 458 HG3 GLN 59 3HG GLN 59 -7.089 5.250 -5.891 459 HE21 GLN 59 1HE2 GLN 59 -7.461 8.227 -4.923 460 HE22 GLN 59 2HE2 GLN 59 -9.028 8.171 -4.199 461 H LEU 60 H LEU 60 -5.474 2.636 -2.004 462 HA LEU 60 HA LEU 60 -3.949 0.918 -3.626 463 HB2 LEU 60 2HB LEU 60 -3.643 1.876 -1.157 464 HB3 LEU 60 3HB LEU 60 -4.268 0.280 -0.748 465 HG LEU 60 HG LEU 60 -1.873 0.225 -0.663 466 HD11 LEU 60 1HD1 LEU 60 -2.935 -1.137 -3.132 467 HD12 LEU 60 2HD1 LEU 60 -2.916 -1.783 -1.492 468 HD13 LEU 60 3HD1 LEU 60 -1.400 -1.514 -2.351 469 HD21 LEU 60 3HD2 LEU 60 -2.010 1.372 -3.443 470 HD22 LEU 60 1HD2 LEU 60 -0.555 0.646 -2.760 471 HD23 LEU 60 2HD2 LEU 60 -1.259 2.081 -2.012 472 H ARG 61 H ARG 61 -6.498 0.139 -1.255 473 HA ARG 61 HA ARG 61 -6.597 -2.607 -1.754 474 HB2 ARG 61 2HB ARG 61 -7.665 -1.458 0.178 475 HB3 ARG 61 3HB ARG 61 -8.892 -0.828 -0.914 476 HG2 ARG 61 2HG ARG 61 -9.515 -3.172 -1.466 477 HG3 ARG 61 3HG ARG 61 -8.386 -3.712 -0.222 478 HD2 ARG 61 2HD ARG 61 -9.804 -3.209 1.434 479 HD3 ARG 61 3HD ARG 61 -10.223 -1.654 0.715 480 HE ARG 61 HE ARG 61 -11.724 -4.063 0.558 481 HH11 ARG 61 1HH1 ARG 61 -10.870 -1.201 -1.232 482 HH12 ARG 61 2HH1 ARG 61 -12.311 -1.214 -2.193 483 HH21 ARG 61 1HH2 ARG 61 -13.626 -4.090 -0.701 484 HH22 ARG 61 2HH2 ARG 61 -13.879 -2.857 -1.889 485 H LEU 62 H LEU 62 -8.066 0.087 -3.435 486 HA LEU 62 HA LEU 62 -9.898 -1.433 -4.983 487 HB2 LEU 62 2HB LEU 62 -9.737 1.139 -4.511 488 HB3 LEU 62 3HB LEU 62 -8.737 1.135 -5.963 489 HG LEU 62 HG LEU 62 -11.048 1.748 -6.459 490 HD11 LEU 62 1HD1 LEU 62 -9.591 0.405 -8.046 491 HD12 LEU 62 2HD1 LEU 62 -11.328 0.378 -8.348 492 HD13 LEU 62 3HD1 LEU 62 -10.546 -0.998 -7.569 493 HD21 LEU 62 3HD2 LEU 62 -11.669 -0.260 -4.610 494 HD22 LEU 62 1HD2 LEU 62 -12.263 -0.839 -6.167 495 HD23 LEU 62 2HD2 LEU 62 -12.794 0.724 -5.547 496 H VAL 63 H VAL 63 -6.628 -0.207 -5.594 497 HA VAL 63 HA VAL 63 -6.407 -1.049 -8.260 498 HB VAL 63 HB VAL 63 -4.217 -0.770 -6.196 499 HG11 VAL 63 1HG1 VAL 63 -2.897 -0.287 -8.388 500 HG12 VAL 63 2HG1 VAL 63 -3.193 -1.955 -7.894 501 HG13 VAL 63 3HG1 VAL 63 -4.187 -1.217 -9.151 502 HG21 VAL 63 3HG2 VAL 63 -4.360 1.440 -6.433 503 HG22 VAL 63 1HG2 VAL 63 -4.401 1.313 -8.192 504 HG23 VAL 63 2HG2 VAL 63 -5.894 1.177 -7.263 505 H ILE 64 H ILE 64 -5.831 -2.732 -5.223 506 HA ILE 64 HA ILE 64 -4.560 -5.010 -6.292 507 HB ILE 64 HB ILE 64 -6.240 -4.792 -3.792 508 HG12 ILE 64 2HG1 ILE 64 -3.234 -4.761 -3.958 509 HG13 ILE 64 3HG1 ILE 64 -4.174 -3.278 -4.085 510 HG21 ILE 64 1HG2 ILE 64 -4.266 -6.730 -3.457 511 HG22 ILE 64 2HG2 ILE 64 -5.999 -6.996 -3.647 512 HG23 ILE 64 3HG2 ILE 64 -4.941 -7.032 -5.058 513 HD11 ILE 64 3HD1 ILE 64 -4.400 -3.164 -1.890 514 HD12 ILE 64 1HD1 ILE 64 -5.013 -4.816 -1.807 515 HD13 ILE 64 2HD1 ILE 64 -3.275 -4.517 -1.765 516 H CYS 65 H CYS 65 -7.948 -4.568 -5.259 517 HA CYS 65 HA CYS 65 -8.943 -7.016 -6.053 518 HB2 CYS 65 2HB CYS 65 -10.074 -4.347 -5.538 519 HB3 CYS 65 3HB CYS 65 -11.050 -5.362 -6.593 520 HG CYS 65 HG CYS 65 -11.699 -5.363 -3.707 521 H ASP 66 H ASP 66 -8.436 -4.104 -7.979 522 HA ASP 66 HA ASP 66 -9.669 -5.120 -10.337 523 HB2 ASP 66 2HB ASP 66 -7.880 -2.787 -9.731 524 HB3 ASP 66 3HB ASP 66 -8.244 -3.214 -11.401 525 H LEU 67 H LEU 67 -6.282 -4.784 -9.311 526 HA LEU 67 HA LEU 67 -5.071 -5.813 -11.597 527 HB2 LEU 67 2HB LEU 67 -4.088 -4.741 -9.426 528 HB3 LEU 67 3HB LEU 67 -3.970 -6.415 -8.887 529 HG LEU 67 HG LEU 67 -1.854 -5.594 -9.800 530 HD11 LEU 67 1HD1 LEU 67 -1.353 -7.588 -10.703 531 HD12 LEU 67 2HD1 LEU 67 -2.642 -7.489 -11.902 532 HD13 LEU 67 3HD1 LEU 67 -3.009 -7.998 -10.254 533 HD21 LEU 67 3HD2 LEU 67 -2.959 -4.016 -11.431 534 HD22 LEU 67 1HD2 LEU 67 -3.234 -5.415 -12.468 535 HD23 LEU 67 2HD2 LEU 67 -1.588 -4.933 -12.057 536 H GLN 68 H GLN 68 -6.152 -7.507 -8.666 537 HA GLN 68 HA GLN 68 -5.374 -10.083 -9.607 538 HB2 GLN 68 2HB GLN 68 -5.914 -9.167 -7.170 539 HB3 GLN 68 3HB GLN 68 -7.513 -9.789 -7.555 540 HG2 GLN 68 2HG GLN 68 -5.318 -11.634 -8.145 541 HG3 GLN 68 3HG GLN 68 -5.505 -11.230 -6.439 542 HE21 GLN 68 1HE2 GLN 68 -7.083 -12.173 -5.306 543 HE22 GLN 68 2HE2 GLN 68 -8.297 -13.208 -5.968 544 H GLU 69 H GLU 69 -8.186 -8.097 -9.983 545 HA GLU 69 HA GLU 69 -10.022 -10.149 -10.678 546 HB2 GLU 69 2HB GLU 69 -10.896 -8.034 -9.985 547 HB3 GLU 69 3HB GLU 69 -9.985 -7.183 -11.225 548 HG2 GLU 69 2HG GLU 69 -11.351 -8.100 -12.956 549 HG3 GLU 69 3HG GLU 69 -12.166 -9.167 -11.814 550 H ARG 70 H ARG 70 -8.426 -7.717 -12.747 551 HA ARG 70 HA ARG 70 -9.140 -8.890 -15.184 552 HB2 ARG 70 2HB ARG 70 -7.814 -6.603 -14.410 553 HB3 ARG 70 3HB ARG 70 -6.550 -7.525 -15.212 554 HG2 ARG 70 2HG ARG 70 -8.007 -7.739 -17.192 555 HG3 ARG 70 3HG ARG 70 -9.204 -6.725 -16.384 556 HD2 ARG 70 2HD ARG 70 -6.419 -5.709 -16.603 557 HD3 ARG 70 3HD ARG 70 -7.416 -5.719 -18.058 558 HE ARG 70 HE ARG 70 -8.750 -4.544 -15.818 559 HH11 ARG 70 1HH1 ARG 70 -6.462 -3.951 -18.374 560 HH12 ARG 70 2HH1 ARG 70 -6.756 -2.244 -18.418 561 HH21 ARG 70 1HH2 ARG 70 -9.145 -2.298 -15.865 562 HH22 ARG 70 2HH2 ARG 70 -8.282 -1.305 -16.990 563 H ARG 71 H ARG 71 -6.092 -9.140 -13.357 564 HA ARG 71 HA ARG 71 -4.711 -10.822 -15.067 565 HB2 ARG 71 2HB ARG 71 -4.647 -10.484 -12.080 566 HB3 ARG 71 3HB ARG 71 -3.606 -11.652 -12.884 567 HG2 ARG 71 2HG ARG 71 -3.666 -8.695 -13.448 568 HG3 ARG 71 3HG ARG 71 -2.468 -9.529 -12.457 569 HD2 ARG 71 2HD ARG 71 -1.275 -9.830 -14.311 570 HD3 ARG 71 3HD ARG 71 -2.527 -10.948 -14.851 571 HE ARG 71 HE ARG 71 -3.388 -8.400 -15.515 572 HH11 ARG 71 1HH1 ARG 71 -0.736 -10.513 -16.303 573 HH12 ARG 71 2HH1 ARG 71 -0.523 -9.867 -17.896 574 HH21 ARG 71 1HH2 ARG 71 -3.118 -7.540 -17.611 575 HH22 ARG 71 2HH2 ARG 71 -1.878 -8.175 -18.639 576 H GLU 72 H GLU 72 -7.025 -11.645 -12.518 577 HA GLU 72 HA GLU 72 -6.732 -14.421 -12.579 578 HB2 GLU 72 2HB GLU 72 -7.973 -13.391 -10.803 579 HB3 GLU 72 3HB GLU 72 -9.128 -12.701 -11.935 580 HG2 GLU 72 2HG GLU 72 -9.976 -14.662 -10.677 581 HG3 GLU 72 3HG GLU 72 -10.041 -14.844 -12.429 582 H LYS 73 H LYS 73 -9.015 -12.353 -14.360 583 HA LYS 73 HA LYS 73 -10.349 -14.350 -15.763 584 HB2 LYS 73 2HB LYS 73 -9.994 -11.452 -16.007 585 HB3 LYS 73 3HB LYS 73 -10.279 -12.252 -17.547 586 HG2 LYS 73 2HG LYS 73 -12.303 -13.301 -16.565 587 HG3 LYS 73 3HG LYS 73 -12.040 -12.340 -15.108 588 HD2 LYS 73 2HD LYS 73 -12.506 -10.336 -16.197 589 HD3 LYS 73 3HD LYS 73 -12.208 -11.024 -17.795 590 HE2 LYS 73 2HE LYS 73 -14.529 -11.706 -15.992 591 HE3 LYS 73 3HE LYS 73 -14.597 -10.632 -17.389 592 HZ1 LYS 73 3HZ LYS 73 -14.426 -13.543 -17.289 593 HZ2 LYS 73 1HZ LYS 73 -13.590 -12.771 -18.541 594 HZ3 LYS 73 2HZ LYS 73 -15.257 -12.544 -18.372 595 H PHE 74 H PHE 74 -7.282 -12.766 -16.431 596 HA PHE 74 HA PHE 74 -6.974 -13.978 -19.018 597 HB2 PHE 74 2HB PHE 74 -5.941 -11.770 -18.219 598 HB3 PHE 74 3HB PHE 74 -4.762 -12.764 -17.371 599 HD1 PHE 74 HD2 PHE 74 -6.031 -11.762 -20.668 600 HD2 PHE 74 HD1 PHE 74 -3.029 -13.906 -18.546 601 HE1 PHE 74 HE2 PHE 74 -4.696 -11.924 -22.728 602 HE2 PHE 74 HE1 PHE 74 -1.687 -14.070 -20.602 603 HZ PHE 74 HZ PHE 74 -2.521 -13.079 -22.697 604 H GLY 75 H GLY 75 -6.206 -14.814 -15.745 605 HA2 GLY 75 2HA GLY 75 -5.928 -17.334 -15.575 606 HA3 GLY 75 3HA GLY 75 -4.600 -17.099 -16.701 607 H SER 76 H SER 76 -4.081 -18.353 -14.365 608 HA SER 76 HA SER 76 -3.013 -16.371 -12.506 609 HB2 SER 76 2HB SER 76 -2.942 -19.385 -12.264 610 HB3 SER 76 3HB SER 76 -2.655 -18.206 -10.985 611 HG SER 76 HG SER 76 -5.047 -19.053 -12.129 612 H SER 77 H SER 77 -0.800 -16.534 -11.747 613 HA SER 77 HA SER 77 1.162 -18.082 -13.063 614 HB2 SER 77 2HB SER 77 2.053 -16.683 -14.661 615 HB3 SER 77 3HB SER 77 0.355 -16.223 -14.782 616 HG SER 77 HG SER 77 2.160 -14.544 -14.474 617 H LYS 78 H LYS 78 3.281 -17.693 -12.267 618 HA LYS 78 HA LYS 78 3.470 -16.996 -9.604 619 HB2 LYS 78 2HB LYS 78 5.625 -16.960 -11.722 620 HB3 LYS 78 3HB LYS 78 5.934 -16.862 -9.994 621 HG2 LYS 78 2HG LYS 78 5.756 -19.061 -9.743 622 HG3 LYS 78 3HG LYS 78 4.254 -19.124 -10.668 623 HD2 LYS 78 2HD LYS 78 5.565 -20.330 -12.079 624 HD3 LYS 78 3HD LYS 78 5.956 -18.718 -12.681 625 HE2 LYS 78 2HE LYS 78 8.002 -19.927 -12.391 626 HE3 LYS 78 3HE LYS 78 7.911 -18.688 -11.140 627 HZ1 LYS 78 3HZ LYS 78 6.855 -21.323 -10.472 628 HZ2 LYS 78 1HZ LYS 78 7.702 -20.219 -9.509 629 HZ3 LYS 78 2HZ LYS 78 8.536 -21.191 -10.614 630 H GLU 79 H GLU 79 3.899 -14.980 -12.456 631 HA GLU 79 HA GLU 79 4.938 -12.714 -11.113 632 HB2 GLU 79 2HB GLU 79 3.790 -13.271 -13.795 633 HB3 GLU 79 3HB GLU 79 3.804 -11.594 -13.267 634 HG2 GLU 79 2HG GLU 79 6.179 -11.626 -13.007 635 HG3 GLU 79 3HG GLU 79 6.236 -13.362 -13.302 636 H ILE 80 H ILE 80 1.666 -13.746 -11.936 637 HA ILE 80 HA ILE 80 0.380 -11.354 -11.106 638 HB ILE 80 HB ILE 80 -0.741 -14.148 -11.350 639 HG12 ILE 80 2HG1 ILE 80 -1.329 -11.993 -13.314 640 HG13 ILE 80 3HG1 ILE 80 0.277 -12.712 -13.370 641 HG21 ILE 80 1HG2 ILE 80 -2.929 -13.034 -11.467 642 HG22 ILE 80 2HG2 ILE 80 -2.132 -12.775 -9.916 643 HG23 ILE 80 3HG2 ILE 80 -2.148 -11.491 -11.125 644 HD11 ILE 80 3HD1 ILE 80 -1.565 -14.833 -13.192 645 HD12 ILE 80 1HD1 ILE 80 -2.175 -13.711 -14.408 646 HD13 ILE 80 2HD1 ILE 80 -0.549 -14.376 -14.560 647 H ASP 81 H ASP 81 0.532 -14.568 -9.560 648 HA ASP 81 HA ASP 81 -0.691 -13.928 -7.169 649 HB2 ASP 81 2HB ASP 81 -0.253 -16.211 -7.565 650 HB3 ASP 81 3HB ASP 81 1.462 -15.922 -7.843 651 H MET 82 H MET 82 2.648 -13.413 -8.157 652 HA MET 82 HA MET 82 3.599 -12.613 -5.600 653 HB2 MET 82 2HB MET 82 4.629 -12.385 -8.404 654 HB3 MET 82 3HB MET 82 5.424 -11.500 -7.109 655 HG2 MET 82 2HG MET 82 5.862 -13.558 -5.923 656 HG3 MET 82 3HG MET 82 4.978 -14.475 -7.141 657 HE1 MET 82 3HE MET 82 7.764 -15.985 -8.586 658 HE2 MET 82 1HE MET 82 8.316 -15.600 -6.956 659 HE3 MET 82 2HE MET 82 6.625 -16.014 -7.240 660 H ALA 83 H ALA 83 2.430 -10.837 -8.436 661 HA ALA 83 HA ALA 83 2.942 -8.244 -7.568 662 HB1 ALA 83 1HB ALA 83 1.733 -7.562 -9.361 663 HB2 ALA 83 2HB ALA 83 1.913 -9.259 -9.811 664 HB3 ALA 83 3HB ALA 83 0.422 -8.701 -9.052 665 H ILE 84 H ILE 84 0.070 -10.267 -7.039 666 HA ILE 84 HA ILE 84 -1.425 -8.347 -5.623 667 HB ILE 84 HB ILE 84 -1.563 -11.351 -5.338 668 HG12 ILE 84 2HG1 ILE 84 -1.809 -10.696 -7.673 669 HG13 ILE 84 3HG1 ILE 84 -3.363 -11.210 -7.027 670 HG21 ILE 84 1HG2 ILE 84 -3.048 -10.883 -3.746 671 HG22 ILE 84 2HG2 ILE 84 -3.039 -9.165 -4.143 672 HG23 ILE 84 3HG2 ILE 84 -4.092 -10.268 -5.028 673 HD11 ILE 84 3HD1 ILE 84 -2.443 -8.390 -7.512 674 HD12 ILE 84 1HD1 ILE 84 -3.692 -9.277 -8.386 675 HD13 ILE 84 2HD1 ILE 84 -3.948 -8.823 -6.701 676 H VAL 85 H VAL 85 0.656 -10.993 -4.466 677 HA VAL 85 HA VAL 85 0.321 -10.551 -1.726 678 HB VAL 85 HB VAL 85 2.756 -11.630 -3.153 679 HG11 VAL 85 1HG1 VAL 85 3.266 -12.713 -1.004 680 HG12 VAL 85 2HG1 VAL 85 3.295 -10.952 -0.886 681 HG13 VAL 85 3HG1 VAL 85 1.913 -11.857 -0.266 682 HG21 VAL 85 3HG2 VAL 85 1.044 -13.532 -1.780 683 HG22 VAL 85 1HG2 VAL 85 0.198 -12.674 -3.068 684 HG23 VAL 85 2HG2 VAL 85 1.677 -13.565 -3.426 685 H THR 86 H THR 86 2.861 -9.357 -3.916 686 HA THR 86 HA THR 86 4.363 -7.918 -2.088 687 HB THR 86 HB THR 86 5.101 -6.517 -3.987 688 HG1 THR 86 HG1 THR 86 3.484 -6.215 -5.365 689 HG21 THR 86 3HG2 THR 86 5.481 -8.694 -5.554 690 HG22 THR 86 1HG2 THR 86 5.053 -9.463 -4.026 691 HG23 THR 86 2HG2 THR 86 6.418 -8.349 -4.101 692 H LEU 87 H LEU 87 1.454 -6.945 -3.847 693 HA LEU 87 HA LEU 87 1.444 -4.242 -3.070 694 HB2 LEU 87 2HB LEU 87 -0.698 -6.145 -3.951 695 HB3 LEU 87 3HB LEU 87 -1.084 -4.492 -3.477 696 HG LEU 87 HG LEU 87 0.728 -5.306 -5.749 697 HD11 LEU 87 1HD1 LEU 87 -1.599 -5.760 -6.243 698 HD12 LEU 87 2HD1 LEU 87 -1.047 -4.361 -7.162 699 HD13 LEU 87 3HD1 LEU 87 -2.050 -4.134 -5.729 700 HD21 LEU 87 3HD2 LEU 87 1.592 -3.272 -5.078 701 HD22 LEU 87 1HD2 LEU 87 0.028 -2.669 -4.529 702 HD23 LEU 87 2HD2 LEU 87 0.373 -2.781 -6.255 703 H LYS 88 H LYS 88 -0.010 -7.117 -1.599 704 HA LYS 88 HA LYS 88 -1.318 -5.733 0.503 705 HB2 LYS 88 2HB LYS 88 -0.753 -8.542 -0.202 706 HB3 LYS 88 3HB LYS 88 -0.944 -8.230 1.518 707 HG2 LYS 88 2HG LYS 88 -3.147 -8.035 1.330 708 HG3 LYS 88 3HG LYS 88 -3.009 -6.935 -0.044 709 HD2 LYS 88 2HD LYS 88 -2.499 -9.005 -1.440 710 HD3 LYS 88 3HD LYS 88 -3.059 -9.943 -0.053 711 HE2 LYS 88 2HE LYS 88 -5.159 -8.445 -0.183 712 HE3 LYS 88 3HE LYS 88 -4.597 -8.061 -1.809 713 HZ1 LYS 88 3HZ LYS 88 -4.439 -10.781 -1.668 714 HZ2 LYS 88 1HZ LYS 88 -5.659 -9.894 -2.434 715 HZ3 LYS 88 2HZ LYS 88 -5.874 -10.428 -0.844 716 H VAL 89 H VAL 89 1.588 -7.806 0.596 717 HA VAL 89 HA VAL 89 2.373 -7.294 3.189 718 HB VAL 89 HB VAL 89 4.611 -7.954 2.564 719 HG11 VAL 89 1HG1 VAL 89 3.774 -10.009 2.484 720 HG12 VAL 89 2HG1 VAL 89 2.252 -9.408 1.824 721 HG13 VAL 89 3HG1 VAL 89 3.580 -9.824 0.741 722 HG21 VAL 89 3HG2 VAL 89 4.985 -6.608 0.620 723 HG22 VAL 89 1HG2 VAL 89 5.181 -8.299 0.157 724 HG23 VAL 89 2HG2 VAL 89 3.702 -7.435 -0.264 725 H PHE 90 H PHE 90 2.719 -5.288 0.355 726 HA PHE 90 HA PHE 90 4.564 -3.457 1.599 727 HB2 PHE 90 2HB PHE 90 4.746 -3.680 -0.771 728 HB3 PHE 90 3HB PHE 90 3.025 -3.387 -0.996 729 HD1 PHE 90 HD2 PHE 90 5.514 -1.528 1.047 730 HD2 PHE 90 HD1 PHE 90 2.883 -1.481 -2.298 731 HE1 PHE 90 HE2 PHE 90 5.968 0.869 0.728 732 HE2 PHE 90 HE1 PHE 90 3.333 0.916 -2.623 733 HZ PHE 90 HZ PHE 90 4.877 2.094 -1.108 734 H ALA 91 H ALA 91 1.111 -3.539 0.862 735 HA ALA 91 HA ALA 91 0.539 -0.898 1.706 736 HB1 ALA 91 1HB ALA 91 -1.830 -2.063 2.028 737 HB2 ALA 91 2HB ALA 91 -1.177 -1.676 0.436 738 HB3 ALA 91 3HB ALA 91 -1.048 -3.318 1.067 739 H VAL 92 H VAL 92 0.568 -4.010 3.370 740 HA VAL 92 HA VAL 92 -0.475 -2.935 5.825 741 HB VAL 92 HB VAL 92 0.889 -5.582 5.310 742 HG11 VAL 92 1HG1 VAL 92 -0.695 -6.032 7.424 743 HG12 VAL 92 2HG1 VAL 92 0.991 -5.532 7.571 744 HG13 VAL 92 3HG1 VAL 92 -0.299 -4.338 7.712 745 HG21 VAL 92 3HG2 VAL 92 -2.046 -4.890 5.433 746 HG22 VAL 92 1HG2 VAL 92 -1.139 -5.297 3.976 747 HG23 VAL 92 2HG2 VAL 92 -1.372 -6.508 5.237 748 H ALA 93 H ALA 93 2.669 -4.422 5.013 749 HA ALA 93 HA ALA 93 3.976 -3.553 7.348 750 HB1 ALA 93 1HB ALA 93 4.623 -5.332 5.507 751 HB2 ALA 93 2HB ALA 93 5.545 -3.975 4.859 752 HB3 ALA 93 3HB ALA 93 5.849 -4.544 6.500 753 H GLY 94 H GLY 94 3.059 -1.857 4.539 754 HA2 GLY 94 2HA GLY 94 5.088 0.223 4.942 755 HA3 GLY 94 3HA GLY 94 3.995 0.099 3.571 756 H LEU 95 H LEU 95 1.635 0.416 4.115 757 HA LEU 95 HA LEU 95 1.261 2.946 5.246 758 HB2 LEU 95 2HB LEU 95 -0.906 0.883 4.996 759 HB3 LEU 95 3HB LEU 95 -1.049 2.636 4.885 760 HG LEU 95 HG LEU 95 0.207 0.798 2.847 761 HD11 LEU 95 1HD1 LEU 95 -2.339 0.936 3.097 762 HD12 LEU 95 2HD1 LEU 95 -1.650 1.209 1.497 763 HD13 LEU 95 3HD1 LEU 95 -2.177 2.579 2.475 764 HD21 LEU 95 3HD2 LEU 95 1.425 2.600 2.315 765 HD22 LEU 95 1HD2 LEU 95 0.430 3.681 3.290 766 HD23 LEU 95 2HD2 LEU 95 -0.083 3.241 1.661 767 H LEU 96 H LEU 96 0.640 -0.284 6.571 768 HA LEU 96 HA LEU 96 -0.171 0.842 9.124 769 HB2 LEU 96 2HB LEU 96 -0.536 -1.639 7.739 770 HB3 LEU 96 3HB LEU 96 0.149 -1.948 9.333 771 HG LEU 96 HG LEU 96 -2.336 -2.070 9.234 772 HD11 LEU 96 1HD1 LEU 96 -0.677 -0.715 11.120 773 HD12 LEU 96 2HD1 LEU 96 -2.133 -1.668 11.403 774 HD13 LEU 96 3HD1 LEU 96 -2.261 0.060 11.077 775 HD21 LEU 96 3HD2 LEU 96 -2.630 -0.237 7.593 776 HD22 LEU 96 1HD2 LEU 96 -2.169 0.916 8.846 777 HD23 LEU 96 2HD2 LEU 96 -3.633 -0.051 9.033 778 H ASN 97 H ASN 97 2.710 0.286 7.670 779 HA ASN 97 HA ASN 97 4.855 -0.040 8.367 780 HB2 ASN 97 2HB ASN 97 3.816 1.008 11.007 781 HB3 ASN 97 3HB ASN 97 5.477 1.068 10.424 782 HD21 ASN 97 1HD2 ASN 97 6.103 2.696 9.120 783 HD22 ASN 97 2HD2 ASN 97 5.070 3.983 8.606 784 H MET 98 H MET 98 2.986 -2.264 8.700 785 HA MET 98 HA MET 98 3.419 -3.602 11.144 786 HB2 MET 98 2HB MET 98 2.213 -4.197 8.564 787 HB3 MET 98 3HB MET 98 3.040 -5.593 9.242 788 HG2 MET 98 2HG MET 98 1.087 -3.974 10.838 789 HG3 MET 98 3HG MET 98 0.578 -5.298 9.793 790 HE1 MET 98 3HE MET 98 -0.063 -4.970 12.733 791 HE2 MET 98 1HE MET 98 0.721 -6.101 13.837 792 HE3 MET 98 2HE MET 98 1.473 -4.544 13.488 793 H THR 99 H THR 99 4.609 -5.692 11.349 794 HA THR 99 HA THR 99 7.178 -5.577 9.906 795 HB THR 99 HB THR 99 8.265 -6.470 11.934 796 HG1 THR 99 HG1 THR 99 7.127 -6.937 13.696 797 HG21 THR 99 3HG2 THR 99 8.542 -4.418 12.915 798 HG22 THR 99 1HG2 THR 99 6.817 -4.054 12.900 799 HG23 THR 99 2HG2 THR 99 7.759 -3.922 11.414 800 H VAL 100 H VAL 100 5.208 -7.065 8.800 801 HA VAL 100 HA VAL 100 5.258 -9.783 9.732 802 HB VAL 100 HB VAL 100 4.056 -10.279 7.599 803 HG11 VAL 100 1HG1 VAL 100 2.035 -8.851 8.184 804 HG12 VAL 100 2HG1 VAL 100 2.696 -9.858 9.474 805 HG13 VAL 100 3HG1 VAL 100 3.042 -8.128 9.438 806 HG21 VAL 100 3HG2 VAL 100 5.105 -7.732 6.881 807 HG22 VAL 100 1HG2 VAL 100 4.187 -8.867 5.892 808 HG23 VAL 100 2HG2 VAL 100 3.344 -7.644 6.843 809 H SER 101 H SER 101 6.473 -11.457 9.025 810 HA SER 101 HA SER 101 8.533 -10.845 7.009 811 HB2 SER 101 2HB SER 101 8.611 -12.420 9.552 812 HB3 SER 101 3HB SER 101 9.682 -12.886 8.230 813 HG SER 101 HG SER 101 10.688 -11.379 9.601 814 H THR 102 H THR 102 5.712 -12.107 6.915 815 HA THR 102 HA THR 102 6.470 -14.232 5.065 816 HB THR 102 HB THR 102 5.020 -15.885 5.978 817 HG1 THR 102 HG1 THR 102 4.270 -14.037 8.012 818 HG21 THR 102 3HG2 THR 102 7.192 -15.786 7.064 819 HG22 THR 102 1HG2 THR 102 5.956 -16.247 8.233 820 HG23 THR 102 2HG2 THR 102 6.586 -14.600 8.218 821 H ALA 103 H ALA 103 5.302 -14.136 3.254 822 HA ALA 103 HA ALA 103 3.515 -12.118 2.668 823 HB1 ALA 103 1HB ALA 103 2.751 -13.785 0.810 824 HB2 ALA 103 2HB ALA 103 4.390 -13.134 0.798 825 HB3 ALA 103 3HB ALA 103 4.092 -14.761 1.410 826 H ALA 104 H ALA 104 2.921 -15.214 4.158 827 HA ALA 104 HA ALA 104 0.110 -15.280 3.784 828 HB1 ALA 104 1HB ALA 104 2.094 -16.905 5.035 829 HB2 ALA 104 2HB ALA 104 0.751 -16.669 6.154 830 HB3 ALA 104 3HB ALA 104 0.454 -17.333 4.547 831 H ALA 105 H ALA 105 2.176 -14.118 6.420 832 HA ALA 105 HA ALA 105 0.110 -13.443 8.208 833 HB1 ALA 105 1HB ALA 105 1.793 -12.059 9.335 834 HB2 ALA 105 2HB ALA 105 2.419 -13.658 8.930 835 HB3 ALA 105 3HB ALA 105 2.872 -12.260 7.955 836 H ALA 106 H ALA 106 1.729 -11.598 5.663 837 HA ALA 106 HA ALA 106 0.582 -9.096 6.209 838 HB1 ALA 106 1HB ALA 106 1.755 -10.331 3.746 839 HB2 ALA 106 2HB ALA 106 1.027 -8.725 3.696 840 HB3 ALA 106 3HB ALA 106 2.397 -9.039 4.761 841 H GLU 107 H GLU 107 -0.413 -11.587 3.858 842 HA GLU 107 HA GLU 107 -2.724 -10.264 2.971 843 HB2 GLU 107 2HB GLU 107 -1.840 -12.061 1.664 844 HB3 GLU 107 3HB GLU 107 -1.979 -13.187 3.006 845 HG2 GLU 107 2HG GLU 107 -4.413 -13.033 2.888 846 HG3 GLU 107 3HG GLU 107 -4.274 -11.905 1.540 847 H ASN 108 H ASN 108 -2.225 -12.617 5.566 848 HA ASN 108 HA ASN 108 -4.880 -13.065 6.269 849 HB2 ASN 108 2HB ASN 108 -2.255 -13.381 7.562 850 HB3 ASN 108 3HB ASN 108 -3.598 -13.183 8.684 851 HD21 ASN 108 1HD2 ASN 108 -5.132 -14.771 8.858 852 HD22 ASN 108 2HD2 ASN 108 -4.964 -16.327 8.127 853 H MET 109 H MET 109 -2.673 -10.484 7.243 854 HA MET 109 HA MET 109 -4.416 -9.308 9.149 855 HB2 MET 109 2HB MET 109 -1.790 -8.843 8.155 856 HB3 MET 109 3HB MET 109 -2.687 -7.336 8.028 857 HG2 MET 109 2HG MET 109 -3.270 -8.431 10.558 858 HG3 MET 109 3HG MET 109 -1.527 -8.552 10.326 859 HE1 MET 109 3HE MET 109 -4.072 -4.757 10.295 860 HE2 MET 109 1HE MET 109 -3.650 -5.383 8.700 861 HE3 MET 109 2HE MET 109 -4.559 -6.388 9.829 862 H TYR 110 H TYR 110 -3.759 -8.651 5.729 863 HA TYR 110 HA TYR 110 -5.349 -6.368 5.457 864 HB2 TYR 110 2HB TYR 110 -3.693 -7.632 3.797 865 HB3 TYR 110 3HB TYR 110 -5.205 -8.298 3.191 866 HD1 TYR 110 HD2 TYR 110 -3.630 -5.023 4.046 867 HD2 TYR 110 HD1 TYR 110 -6.377 -7.128 1.570 868 HE1 TYR 110 HE2 TYR 110 -3.988 -2.983 2.718 869 HE2 TYR 110 HE1 TYR 110 -6.741 -5.094 0.235 870 HH TYR 110 HH TYR 110 -4.741 -2.367 0.459 871 H SER 111 H SER 111 -6.178 -9.761 5.503 872 HA SER 111 HA SER 111 -8.897 -9.284 4.621 873 HB2 SER 111 2HB SER 111 -7.698 -11.362 3.988 874 HB3 SER 111 3HB SER 111 -7.635 -11.821 5.689 875 HG SER 111 HG SER 111 -9.470 -12.748 5.197 876 H GLN 112 H GLN 112 -7.298 -10.422 7.591 877 HA GLN 112 HA GLN 112 -9.559 -10.667 9.188 878 HB2 GLN 112 2HB GLN 112 -7.217 -11.411 9.746 879 HB3 GLN 112 3HB GLN 112 -6.850 -9.738 10.145 880 HG2 GLN 112 2HG GLN 112 -9.179 -10.354 11.561 881 HG3 GLN 112 3HG GLN 112 -8.126 -11.758 11.733 882 HE21 GLN 112 1HE2 GLN 112 -8.994 -9.579 13.602 883 HE22 GLN 112 2HE2 GLN 112 -7.523 -8.970 14.271 884 H MET 113 H MET 113 -7.788 -7.828 8.212 885 HA MET 113 HA MET 113 -8.977 -6.085 10.156 886 HB2 MET 113 2HB MET 113 -6.762 -5.654 9.108 887 HB3 MET 113 3HB MET 113 -7.574 -5.378 7.573 888 HG2 MET 113 2HG MET 113 -7.966 -3.270 8.102 889 HG3 MET 113 3HG MET 113 -8.774 -3.751 9.592 890 HE1 MET 113 3HE MET 113 -8.112 -1.435 9.980 891 HE2 MET 113 1HE MET 113 -7.327 -1.607 11.550 892 HE3 MET 113 2HE MET 113 -6.479 -0.814 10.222 893 H GLY 114 H GLY 114 -9.743 -7.154 6.924 894 HA2 GLY 114 2HA GLY 114 -12.065 -7.093 6.233 895 HA3 GLY 114 3HA GLY 114 -12.216 -5.552 7.063 896 H LEU 115 H LEU 115 -9.425 -6.258 5.109 897 HA LEU 115 HA LEU 115 -10.327 -4.221 3.192 898 HB2 LEU 115 2HB LEU 115 -7.515 -5.214 3.570 899 HB3 LEU 115 3HB LEU 115 -8.047 -3.760 2.728 900 HG LEU 115 HG LEU 115 -8.068 -4.239 5.706 901 HD11 LEU 115 1HD1 LEU 115 -6.504 -2.308 5.687 902 HD12 LEU 115 2HD1 LEU 115 -6.470 -2.408 3.927 903 HD13 LEU 115 3HD1 LEU 115 -5.867 -3.751 4.897 904 HD21 LEU 115 3HD2 LEU 115 -8.703 -1.729 5.642 905 HD22 LEU 115 1HD2 LEU 115 -9.962 -2.941 5.401 906 HD23 LEU 115 2HD2 LEU 115 -9.281 -2.089 4.014 907 H ASP 116 H ASP 116 -9.254 -7.514 3.512 908 HA ASP 116 HA ASP 116 -9.085 -7.878 0.626 909 HB2 ASP 116 2HB ASP 116 -7.472 -8.940 2.305 910 HB3 ASP 116 3HB ASP 116 -8.795 -10.026 2.721 911 H THR 117 H THR 117 -10.229 -9.739 -0.363 912 HA THR 117 HA THR 117 -13.009 -9.523 0.017 913 HB THR 117 HB THR 117 -13.229 -11.346 -1.590 914 HG1 THR 117 HG1 THR 117 -10.550 -11.777 -0.871 915 HG21 THR 117 3HG2 THR 117 -11.809 -8.929 -2.020 916 HG22 THR 117 1HG2 THR 117 -12.777 -9.846 -3.174 917 HG23 THR 117 2HG2 THR 117 -11.052 -10.176 -3.011 918 H ARG 118 H ARG 118 -14.377 -11.631 0.220 919 HA ARG 118 HA ARG 118 -14.246 -12.507 2.855 920 HB2 ARG 118 2HB ARG 118 -15.744 -13.313 0.430 921 HB3 ARG 118 3HB ARG 118 -15.664 -14.502 1.723 922 HG2 ARG 118 2HG ARG 118 -16.941 -13.261 3.138 923 HG3 ARG 118 3HG ARG 118 -16.409 -11.726 2.449 924 HD2 ARG 118 2HD ARG 118 -17.811 -13.203 0.451 925 HD3 ARG 118 3HD ARG 118 -18.788 -13.159 1.918 926 HE ARG 118 HE ARG 118 -18.307 -11.005 0.143 927 HH11 ARG 118 1HH1 ARG 118 -18.691 -11.753 3.522 928 HH12 ARG 118 2HH1 ARG 118 -19.285 -10.179 3.937 929 HH21 ARG 118 1HH2 ARG 118 -19.088 -8.929 0.677 930 HH22 ARG 118 2HH2 ARG 118 -19.512 -8.574 2.318 931 HA PRO 119 HA PRO 119 -11.356 -15.802 3.027 932 HB2 PRO 119 2HB PRO 119 -12.607 -17.599 4.631 933 HB3 PRO 119 3HB PRO 119 -11.941 -16.076 5.232 934 HG2 PRO 119 2HG PRO 119 -14.770 -16.761 4.532 935 HG3 PRO 119 3HG PRO 119 -14.150 -15.853 5.923 936 HD2 PRO 119 2HD PRO 119 -15.219 -14.640 3.751 937 HD3 PRO 119 3HD PRO 119 -13.916 -13.908 4.709 938 H SER 120 H SER 120 -10.871 -17.133 1.407 939 HA SER 120 HA SER 120 -12.987 -18.839 0.286 940 HB2 SER 120 2HB SER 120 -10.392 -18.525 -1.132 941 HB3 SER 120 3HB SER 120 -12.028 -18.624 -1.783 942 HG SER 120 HG SER 120 -10.553 -16.444 -1.232 943 H MET 121 H MET 121 -11.850 -19.664 2.674 944 HA MET 121 HA MET 121 -10.840 -22.238 1.914 945 HB2 MET 121 2HB MET 121 -8.894 -20.358 2.204 946 HB3 MET 121 3HB MET 121 -8.999 -20.983 3.845 947 HG2 MET 121 2HG MET 121 -7.411 -22.360 2.955 948 HG3 MET 121 3HG MET 121 -8.871 -23.303 2.661 949 HE1 MET 121 3HE MET 121 -5.741 -21.918 1.321 950 HE2 MET 121 1HE MET 121 -6.006 -21.544 -0.383 951 HE3 MET 121 2HE MET 121 -6.632 -20.465 0.864 952 H LYS 122 H LYS 122 -11.347 -23.753 3.407 953 HA LYS 122 HA LYS 122 -12.458 -22.784 5.958 954 HB2 LYS 122 2HB LYS 122 -13.812 -24.875 5.944 955 HB3 LYS 122 3HB LYS 122 -14.175 -23.793 4.606 956 HG2 LYS 122 2HG LYS 122 -13.036 -25.164 3.059 957 HG3 LYS 122 3HG LYS 122 -12.290 -26.116 4.345 958 HD2 LYS 122 2HD LYS 122 -15.108 -26.217 4.694 959 HD3 LYS 122 3HD LYS 122 -14.754 -26.570 3.001 960 HE2 LYS 122 2HE LYS 122 -13.146 -27.892 5.139 961 HE3 LYS 122 3HE LYS 122 -14.772 -28.482 4.796 962 HZ1 LYS 122 3HZ LYS 122 -12.459 -29.113 3.441 963 HZ2 LYS 122 1HZ LYS 122 -13.312 -28.092 2.395 964 HZ3 LYS 122 2HZ LYS 122 -14.042 -29.499 2.984 965 H GLU 123 H GLU 123 -9.870 -22.981 6.172 966 HA GLU 123 HA GLU 123 -9.448 -25.499 7.625 967 HB2 GLU 123 2HB GLU 123 -7.631 -24.229 5.592 968 HB3 GLU 123 3HB GLU 123 -6.996 -25.286 6.845 969 HG2 GLU 123 2HG GLU 123 -9.282 -26.316 5.291 970 HG3 GLU 123 3HG GLU 123 -7.751 -26.149 4.434 971 H ALA 124 H ALA 124 -9.197 -24.984 9.688 972 HA ALA 124 HA ALA 124 -7.406 -22.768 10.385 973 HB1 ALA 124 1HB ALA 124 -9.576 -21.787 10.571 974 HB2 ALA 124 2HB ALA 124 -10.183 -23.170 11.482 975 HB3 ALA 124 3HB ALA 124 -8.981 -22.099 12.202 976 H GLY 125 H GLY 125 -6.965 -22.818 12.843 977 HA2 GLY 125 2HA GLY 125 -6.568 -24.049 14.809 978 HA3 GLY 125 3HA GLY 125 -7.069 -25.510 13.969 979 H GLY 126 H GLY 126 -4.621 -24.724 15.588 980 HA2 GLY 126 2HA GLY 126 -2.575 -25.978 15.380 981 HA3 GLY 126 3HA GLY 126 -2.673 -25.766 13.639 982 H LYS 127 H LYS 127 -0.661 -25.056 15.860 983 HA LYS 127 HA LYS 127 -0.423 -22.293 16.096 984 HB2 LYS 127 2HB LYS 127 1.389 -24.611 16.374 985 HB3 LYS 127 3HB LYS 127 2.175 -23.064 16.091 986 HG2 LYS 127 2HG LYS 127 0.393 -22.401 18.028 987 HG3 LYS 127 3HG LYS 127 0.782 -24.067 18.464 988 HD2 LYS 127 2HD LYS 127 2.353 -22.738 19.610 989 HD3 LYS 127 3HD LYS 127 3.224 -23.397 18.223 990 HE2 LYS 127 2HE LYS 127 3.120 -21.348 17.060 991 HE3 LYS 127 3HE LYS 127 1.901 -20.699 18.156 992 HZ1 LYS 127 3HZ LYS 127 3.831 -21.117 19.884 993 HZ2 LYS 127 1HZ LYS 127 3.733 -19.685 18.988 994 HZ3 LYS 127 2HZ LYS 127 4.792 -20.912 18.507 995 H GLU 128 H GLU 128 -0.341 -20.848 14.512 996 HA GLU 128 HA GLU 128 0.456 -21.489 11.855 997 HB2 GLU 128 2HB GLU 128 -0.184 -18.888 13.238 998 HB3 GLU 128 3HB GLU 128 0.295 -18.961 11.548 999 HG2 GLU 128 2HG GLU 128 -1.635 -20.651 11.306 1000 HG3 GLU 128 3HG GLU 128 -2.188 -20.001 12.848 1001 H GLU 129 H GLU 129 1.849 -19.156 14.172 1002 HA GLU 129 HA GLU 129 4.513 -20.028 13.758 1003 HB2 GLU 129 2HB GLU 129 3.895 -18.788 11.579 1004 HB3 GLU 129 3HB GLU 129 3.980 -17.326 12.551 1005 HG2 GLU 129 2HG GLU 129 6.319 -18.844 13.054 1006 HG3 GLU 129 3HG GLU 129 6.085 -18.758 11.309 1007 H GLY 130 H GLY 130 6.046 -18.852 15.027 1008 HA2 GLY 130 2HA GLY 130 6.076 -16.603 16.367 1009 HA3 GLY 130 3HA GLY 130 4.753 -17.391 17.214 1010 HA PRO 131 HA PRO 131 8.730 -20.005 18.124 1011 HB2 PRO 131 2HB PRO 131 11.092 -18.881 17.401 1012 HB3 PRO 131 3HB PRO 131 10.173 -19.953 16.338 1013 HG2 PRO 131 2HG PRO 131 10.300 -16.962 16.360 1014 HG3 PRO 131 3HG PRO 131 10.332 -18.073 14.978 1015 HD2 PRO 131 2HD PRO 131 8.096 -16.742 15.727 1016 HD3 PRO 131 3HD PRO 131 8.045 -18.359 14.995 1017 HA PRO 132 HA PRO 132 9.785 -17.879 21.826 1018 HB2 PRO 132 2HB PRO 132 12.115 -19.065 22.557 1019 HB3 PRO 132 3HB PRO 132 10.550 -19.881 22.655 1020 HG2 PRO 132 2HG PRO 132 12.668 -20.094 20.550 1021 HG3 PRO 132 3HG PRO 132 11.703 -21.379 21.301 1022 HD2 PRO 132 2HD PRO 132 11.128 -20.365 18.857 1023 HD3 PRO 132 3HD PRO 132 9.874 -20.960 19.963 1024 H GLN 133 H GLN 133 11.048 -16.230 22.700 1025 HA GLN 133 HA GLN 133 13.059 -15.108 20.866 1026 HB2 GLN 133 2HB GLN 133 10.765 -13.946 22.055 1027 HB3 GLN 133 3HB GLN 133 12.168 -13.196 22.804 1028 HG2 GLN 133 2HG GLN 133 12.853 -13.163 20.165 1029 HG3 GLN 133 3HG GLN 133 11.108 -12.924 20.098 1030 HE21 GLN 133 1HE2 GLN 133 10.577 -10.875 20.018 1031 HE22 GLN 133 2HE2 GLN 133 11.386 -9.574 20.816 1032 H ALA 134 H ALA 134 15.034 -15.619 21.561 1033 HA ALA 134 HA ALA 134 15.623 -15.268 24.429 1034 HB1 ALA 134 1HB ALA 134 17.564 -16.989 23.410 1035 HB2 ALA 134 2HB ALA 134 16.222 -17.407 24.477 1036 HB3 ALA 134 3HB ALA 134 16.039 -17.559 22.729 1037 H TYR 135 H TYR 135 16.874 -15.061 21.128 1038 HA TYR 135 HA TYR 135 19.163 -13.501 22.060 1039 HB2 TYR 135 2HB TYR 135 18.642 -15.231 19.809 1040 HB3 TYR 135 3HB TYR 135 19.215 -13.662 19.253 1041 HD1 TYR 135 HD1 TYR 135 20.040 -16.480 21.529 1042 HD2 TYR 135 HD2 TYR 135 21.493 -13.107 19.381 1043 HE1 TYR 135 HE1 TYR 135 22.348 -17.144 22.059 1044 HE2 TYR 135 HE2 TYR 135 23.805 -13.762 19.905 1045 HH TYR 135 HH TYR 135 24.749 -15.521 22.174 Start of MODEL 15 1 H21 MYR 1 1H2 MYR 1 2.313 9.469 7.878 2 H22 MYR 1 2H2 MYR 1 1.766 10.078 6.328 3 H31 MYR 1 1H3 MYR 1 -0.448 9.209 6.609 4 H32 MYR 1 2H3 MYR 1 -0.400 9.361 8.366 5 H41 MYR 1 1H4 MYR 1 -0.005 7.099 8.425 6 H42 MYR 1 2H4 MYR 1 1.643 7.468 7.908 7 H51 MYR 1 1H5 MYR 1 -0.537 7.227 5.767 8 H52 MYR 1 2H5 MYR 1 0.069 5.750 6.519 9 H61 MYR 1 1H6 MYR 1 2.479 6.575 5.944 10 H62 MYR 1 2H6 MYR 1 1.733 7.865 4.998 11 H71 MYR 1 1H7 MYR 1 0.359 5.591 4.046 12 H72 MYR 1 2H7 MYR 1 1.958 4.925 4.387 13 H81 MYR 1 1H8 MYR 1 2.547 7.393 3.090 14 H82 MYR 1 2H8 MYR 1 1.108 6.827 2.238 15 H91 MYR 1 1H9 MYR 1 3.016 4.590 2.682 16 H92 MYR 1 2H9 MYR 1 3.815 5.933 1.863 17 H101 MYR 1 1H10 MYR 1 2.391 5.840 -0.033 18 H102 MYR 1 2H10 MYR 1 1.054 5.100 0.832 19 H111 MYR 1 1H11 MYR 1 3.659 3.511 0.488 20 H112 MYR 1 2H11 MYR 1 2.617 3.743 -0.906 21 H121 MYR 1 1H12 MYR 1 1.031 2.857 1.452 22 H122 MYR 1 2H12 MYR 1 2.334 1.725 1.091 23 H131 MYR 1 1H13 MYR 1 1.294 2.308 -1.488 24 H132 MYR 1 2H13 MYR 1 -0.151 2.314 -0.475 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 2.266 10.801 9.698 29 HA2 GLY 2 2HA GLY 2 0.643 13.153 9.819 30 HA3 GLY 2 3HA GLY 2 1.910 12.703 10.951 31 H ASN 3 H ASN 3 1.008 14.847 8.539 32 HA ASN 3 HA ASN 3 2.060 16.549 7.457 33 HB2 ASN 3 2HB ASN 3 4.070 16.121 9.677 34 HB3 ASN 3 3HB ASN 3 4.073 17.503 8.586 35 HD21 ASN 3 1HD2 ASN 3 2.817 16.169 11.430 36 HD22 ASN 3 2HD2 ASN 3 1.675 17.412 11.797 37 H GLY 4 H GLY 4 2.448 15.432 5.531 38 HA2 GLY 4 2HA GLY 4 3.858 14.881 3.785 39 HA3 GLY 4 3HA GLY 4 5.224 15.154 4.856 40 H ALA 5 H ALA 5 5.951 13.216 3.552 41 HA ALA 5 HA ALA 5 5.409 10.826 5.137 42 HB1 ALA 5 1HB ALA 5 3.896 10.365 3.431 43 HB2 ALA 5 2HB ALA 5 4.941 11.053 2.187 44 HB3 ALA 5 3HB ALA 5 5.353 9.507 2.928 45 H SER 6 H SER 6 7.130 9.426 5.290 46 HA SER 6 HA SER 6 9.366 9.391 3.587 47 HB2 SER 6 2HB SER 6 11.000 10.408 5.290 48 HB3 SER 6 3HB SER 6 10.013 11.530 4.353 49 HG SER 6 HG SER 6 10.131 11.215 7.009 50 H ARG 7 H ARG 7 9.191 9.376 7.144 51 HA ARG 7 HA ARG 7 10.693 7.078 7.527 52 HB2 ARG 7 2HB ARG 7 9.619 6.962 9.766 53 HB3 ARG 7 3HB ARG 7 10.212 8.567 9.362 54 HG2 ARG 7 2HG ARG 7 8.200 9.222 10.096 55 HG3 ARG 7 3HG ARG 7 7.667 8.749 8.482 56 HD2 ARG 7 2HD ARG 7 6.149 7.651 9.834 57 HD3 ARG 7 3HD ARG 7 7.364 6.404 9.554 58 HE ARG 7 HE ARG 7 8.103 7.740 11.866 59 HH11 ARG 7 1HH1 ARG 7 5.434 5.807 10.743 60 HH12 ARG 7 2HH1 ARG 7 5.055 5.184 12.315 61 HH21 ARG 7 1HH2 ARG 7 7.613 6.927 13.940 62 HH22 ARG 7 2HH2 ARG 7 6.294 5.823 14.133 63 H ASP 8 H ASP 8 7.193 7.423 7.128 64 HA ASP 8 HA ASP 8 6.557 4.704 7.573 65 HB2 ASP 8 2HB ASP 8 5.166 7.114 6.761 66 HB3 ASP 8 3HB ASP 8 4.614 5.720 5.835 67 H TRP 9 H TRP 9 7.600 6.488 4.756 68 HA TRP 9 HA TRP 9 6.946 4.448 2.862 69 HB2 TRP 9 2HB TRP 9 7.116 6.713 2.078 70 HB3 TRP 9 3HB TRP 9 8.756 6.863 2.703 71 HD1 TRP 9 HD1 TRP 9 10.692 6.208 1.110 72 HE1 TRP 9 HE1 TRP 9 10.826 5.242 -1.271 73 HE3 TRP 9 HE3 TRP 9 5.769 5.002 0.446 74 HZ2 TRP 9 HZ2 TRP 9 9.076 4.118 -3.180 75 HZ3 TRP 9 HZ3 TRP 9 5.081 3.985 -1.687 76 HH2 TRP 9 HH2 TRP 9 6.702 3.553 -3.461 77 H LYS 10 H LYS 10 10.129 5.680 3.910 78 HA LYS 10 HA LYS 10 11.687 3.669 2.841 79 HB2 LYS 10 2HB LYS 10 12.504 5.795 3.891 80 HB3 LYS 10 3HB LYS 10 12.222 5.067 5.467 81 HG2 LYS 10 2HG LYS 10 13.907 3.449 5.130 82 HG3 LYS 10 3HG LYS 10 14.027 3.828 3.410 83 HD2 LYS 10 2HD LYS 10 14.994 5.967 3.881 84 HD3 LYS 10 3HD LYS 10 14.684 5.783 5.609 85 HE2 LYS 10 2HE LYS 10 16.308 3.679 4.308 86 HE3 LYS 10 3HE LYS 10 17.057 5.265 4.482 87 HZ1 LYS 10 3HZ LYS 10 16.205 3.376 6.558 88 HZ2 LYS 10 1HZ LYS 10 16.169 5.031 6.908 89 HZ3 LYS 10 2HZ LYS 10 17.622 4.294 6.454 90 H MET 11 H MET 11 9.753 3.648 5.744 91 HA MET 11 HA MET 11 10.913 1.336 6.922 92 HB2 MET 11 2HB MET 11 9.591 2.953 8.216 93 HB3 MET 11 3HB MET 11 8.156 2.518 7.298 94 HG2 MET 11 2HG MET 11 7.898 1.318 9.246 95 HG3 MET 11 3HG MET 11 8.605 0.131 8.152 96 HE1 MET 11 3HE MET 11 10.487 2.117 11.795 97 HE2 MET 11 1HE MET 11 9.136 2.711 10.827 98 HE3 MET 11 2HE MET 11 8.930 1.289 11.850 99 H ALA 12 H ALA 12 7.822 1.787 5.195 100 HA ALA 12 HA ALA 12 7.021 -0.853 5.083 101 HB1 ALA 12 1HB ALA 12 6.559 1.456 3.225 102 HB2 ALA 12 2HB ALA 12 5.863 -0.134 2.911 103 HB3 ALA 12 3HB ALA 12 5.452 0.731 4.391 104 H ILE 13 H ILE 13 9.442 0.800 3.185 105 HA ILE 13 HA ILE 13 9.673 -1.204 1.164 106 HB ILE 13 HB ILE 13 11.608 0.961 1.993 107 HG12 ILE 13 2HG1 ILE 13 9.416 1.751 1.131 108 HG13 ILE 13 3HG1 ILE 13 10.757 2.182 0.075 109 HG21 ILE 13 1HG2 ILE 13 12.377 0.498 -0.469 110 HG22 ILE 13 2HG2 ILE 13 12.993 -0.478 0.864 111 HG23 ILE 13 3HG2 ILE 13 11.697 -1.099 -0.157 112 HD11 ILE 13 3HD1 ILE 13 9.724 -0.335 -0.750 113 HD12 ILE 13 1HD1 ILE 13 8.389 0.803 -0.573 114 HD13 ILE 13 2HD1 ILE 13 9.750 1.197 -1.623 115 H LYS 14 H LYS 14 11.701 -0.335 3.963 116 HA LYS 14 HA LYS 14 13.586 -2.367 3.710 117 HB2 LYS 14 2HB LYS 14 13.236 -0.299 5.426 118 HB3 LYS 14 3HB LYS 14 12.802 -1.648 6.469 119 HG2 LYS 14 2HG LYS 14 14.968 -1.888 6.874 120 HG3 LYS 14 3HG LYS 14 15.129 -2.482 5.220 121 HD2 LYS 14 2HD LYS 14 15.423 -0.089 4.502 122 HD3 LYS 14 3HD LYS 14 15.513 0.337 6.213 123 HE2 LYS 14 2HE LYS 14 17.510 -0.842 6.518 124 HE3 LYS 14 3HE LYS 14 17.295 -1.768 5.034 125 HZ1 LYS 14 3HZ LYS 14 18.998 0.024 4.910 126 HZ2 LYS 14 1HZ LYS 14 17.757 1.161 5.080 127 HZ3 LYS 14 2HZ LYS 14 17.788 0.137 3.734 128 H ARG 15 H ARG 15 10.311 -2.485 4.810 129 HA ARG 15 HA ARG 15 10.557 -4.978 6.215 130 HB2 ARG 15 2HB ARG 15 8.628 -2.959 6.032 131 HB3 ARG 15 3HB ARG 15 7.870 -4.379 5.323 132 HG2 ARG 15 2HG ARG 15 7.319 -4.384 7.618 133 HG3 ARG 15 3HG ARG 15 8.539 -5.639 7.391 134 HD2 ARG 15 2HD ARG 15 10.184 -3.667 7.984 135 HD3 ARG 15 3HD ARG 15 8.747 -3.003 8.761 136 HE ARG 15 HE ARG 15 9.138 -5.701 9.526 137 HH11 ARG 15 1HH1 ARG 15 10.378 -2.489 10.046 138 HH12 ARG 15 2HH1 ARG 15 10.959 -2.831 11.642 139 HH21 ARG 15 1HH2 ARG 15 9.899 -6.163 11.626 140 HH22 ARG 15 2HH2 ARG 15 10.687 -4.922 12.539 141 H CYS 16 H CYS 16 8.952 -4.030 3.172 142 HA CYS 16 HA CYS 16 8.361 -6.651 2.342 143 HB2 CYS 16 2HB CYS 16 7.809 -5.702 0.218 144 HB3 CYS 16 3HB CYS 16 7.336 -4.533 1.445 145 HG CYS 16 HG CYS 16 9.453 -4.198 -1.077 146 H SER 17 H SER 17 11.300 -4.940 2.424 147 HA SER 17 HA SER 17 12.692 -5.906 0.230 148 HB2 SER 17 2HB SER 17 13.429 -4.227 2.060 149 HB3 SER 17 3HB SER 17 13.998 -5.651 2.929 150 HG SER 17 HG SER 17 15.084 -4.380 0.781 151 H ASN 18 H ASN 18 11.697 -7.542 3.118 152 HA ASN 18 HA ASN 18 13.373 -9.860 2.487 153 HB2 ASN 18 2HB ASN 18 12.990 -8.788 4.874 154 HB3 ASN 18 3HB ASN 18 11.543 -9.792 4.850 155 HD21 ASN 18 1HD2 ASN 18 13.617 -10.117 6.678 156 HD22 ASN 18 2HD2 ASN 18 14.371 -11.644 6.390 157 H VAL 19 H VAL 19 11.260 -9.246 0.712 158 HA VAL 19 HA VAL 19 9.339 -11.412 1.265 159 HB VAL 19 HB VAL 19 9.035 -9.017 -0.552 160 HG11 VAL 19 1HG1 VAL 19 7.120 -11.274 0.030 161 HG12 VAL 19 2HG1 VAL 19 6.733 -9.816 -0.886 162 HG13 VAL 19 3HG1 VAL 19 7.929 -10.956 -1.505 163 HG21 VAL 19 3HG2 VAL 19 7.217 -9.572 1.729 164 HG22 VAL 19 1HG2 VAL 19 8.824 -8.940 2.090 165 HG23 VAL 19 2HG2 VAL 19 7.734 -8.033 1.041 166 H ALA 20 H ALA 20 8.980 -12.992 -0.253 167 HA ALA 20 HA ALA 20 10.893 -13.064 -2.491 168 HB1 ALA 20 1HB ALA 20 9.538 -15.527 -1.506 169 HB2 ALA 20 2HB ALA 20 11.137 -15.327 -2.224 170 HB3 ALA 20 3HB ALA 20 10.853 -14.837 -0.554 171 H VAL 21 H VAL 21 10.204 -13.652 -4.539 172 HA VAL 21 HA VAL 21 7.672 -12.836 -5.354 173 HB VAL 21 HB VAL 21 8.165 -13.803 -7.514 174 HG11 VAL 21 1HG1 VAL 21 10.901 -13.048 -7.021 175 HG12 VAL 21 2HG1 VAL 21 9.642 -12.188 -7.908 176 HG13 VAL 21 3HG1 VAL 21 9.792 -11.979 -6.163 177 HG21 VAL 21 3HG2 VAL 21 10.041 -15.479 -5.929 178 HG22 VAL 21 1HG2 VAL 21 8.981 -15.923 -7.267 179 HG23 VAL 21 2HG2 VAL 21 10.488 -15.064 -7.584 180 H GLY 22 H GLY 22 8.747 -15.888 -4.117 181 HA2 GLY 22 2HA GLY 22 6.003 -16.857 -4.151 182 HA3 GLY 22 3HA GLY 22 7.164 -17.819 -5.054 183 H VAL 23 H VAL 23 5.923 -19.131 -3.133 184 HA VAL 23 HA VAL 23 7.599 -19.036 -0.730 185 HB VAL 23 HB VAL 23 5.155 -19.066 -0.404 186 HG11 VAL 23 1HG1 VAL 23 3.874 -21.085 -0.904 187 HG12 VAL 23 2HG1 VAL 23 4.548 -20.379 -2.375 188 HG13 VAL 23 3HG1 VAL 23 5.295 -21.807 -1.657 189 HG21 VAL 23 3HG2 VAL 23 5.726 -21.689 0.690 190 HG22 VAL 23 1HG2 VAL 23 7.073 -20.572 0.911 191 HG23 VAL 23 2HG2 VAL 23 5.471 -20.153 1.518 192 H GLY 24 H GLY 24 6.843 -21.016 -3.499 193 HA2 GLY 24 2HA GLY 24 9.137 -22.692 -2.940 194 HA3 GLY 24 3HA GLY 24 7.593 -23.530 -2.881 195 H GLY 25 H GLY 25 9.019 -21.062 -5.032 196 HA2 GLY 25 2HA GLY 25 8.563 -22.913 -7.279 197 HA3 GLY 25 3HA GLY 25 7.985 -21.256 -7.368 198 H LYS 26 H LYS 26 9.787 -19.596 -6.823 199 HA LYS 26 HA LYS 26 12.295 -20.451 -8.109 200 HB2 LYS 26 2HB LYS 26 10.990 -17.758 -8.510 201 HB3 LYS 26 3HB LYS 26 12.408 -18.388 -9.337 202 HG2 LYS 26 2HG LYS 26 10.918 -20.187 -10.278 203 HG3 LYS 26 3HG LYS 26 9.552 -19.272 -9.636 204 HD2 LYS 26 2HD LYS 26 9.703 -18.512 -11.826 205 HD3 LYS 26 3HD LYS 26 10.586 -17.280 -10.923 206 HE2 LYS 26 2HE LYS 26 12.039 -17.682 -12.658 207 HE3 LYS 26 3HE LYS 26 12.648 -18.803 -11.442 208 HZ1 LYS 26 3HZ LYS 26 10.638 -19.690 -13.406 209 HZ2 LYS 26 1HZ LYS 26 11.765 -20.612 -12.543 210 HZ3 LYS 26 2HZ LYS 26 12.275 -19.638 -13.829 211 H SER 27 H SER 27 14.136 -19.829 -7.131 212 HA SER 27 HA SER 27 13.946 -18.570 -4.548 213 HB2 SER 27 2HB SER 27 15.532 -20.497 -5.292 214 HB3 SER 27 3HB SER 27 16.543 -19.198 -5.924 215 HG SER 27 HG SER 27 16.266 -20.038 -3.391 216 H LYS 28 H LYS 28 13.044 -16.574 -5.685 217 HA LYS 28 HA LYS 28 15.261 -14.696 -6.064 218 HB2 LYS 28 2HB LYS 28 12.830 -14.809 -7.859 219 HB3 LYS 28 3HB LYS 28 14.125 -13.622 -7.947 220 HG2 LYS 28 2HG LYS 28 15.619 -15.770 -8.233 221 HG3 LYS 28 3HG LYS 28 14.097 -16.472 -8.786 222 HD2 LYS 28 2HD LYS 28 13.884 -14.813 -10.503 223 HD3 LYS 28 3HD LYS 28 15.265 -13.912 -9.872 224 HE2 LYS 28 2HE LYS 28 16.793 -15.408 -10.702 225 HE3 LYS 28 3HE LYS 28 15.659 -16.757 -10.655 226 HZ1 LYS 28 3HZ LYS 28 15.422 -16.433 -12.826 227 HZ2 LYS 28 1HZ LYS 28 16.234 -14.949 -12.788 228 HZ3 LYS 28 2HZ LYS 28 14.576 -15.015 -12.460 229 H LYS 29 H LYS 29 15.013 -12.867 -4.941 230 HA LYS 29 HA LYS 29 12.417 -12.399 -3.648 231 HB2 LYS 29 2HB LYS 29 13.755 -10.938 -2.097 232 HB3 LYS 29 3HB LYS 29 14.162 -12.648 -2.041 233 HG2 LYS 29 2HG LYS 29 16.218 -12.333 -2.994 234 HG3 LYS 29 3HG LYS 29 15.721 -10.870 -3.846 235 HD2 LYS 29 2HD LYS 29 16.041 -9.528 -2.007 236 HD3 LYS 29 3HD LYS 29 15.782 -10.849 -0.865 237 HE2 LYS 29 2HE LYS 29 17.951 -11.420 -0.857 238 HE3 LYS 29 3HE LYS 29 18.107 -11.217 -2.602 239 HZ1 LYS 29 3HZ LYS 29 18.683 -9.032 -2.391 240 HZ2 LYS 29 1HZ LYS 29 19.346 -9.637 -0.956 241 HZ3 LYS 29 2HZ LYS 29 17.863 -8.823 -0.926 242 H PHE 30 H PHE 30 11.875 -10.067 -3.245 243 HA PHE 30 HA PHE 30 12.297 -8.567 -5.726 244 HB2 PHE 30 2HB PHE 30 10.162 -8.561 -3.623 245 HB3 PHE 30 3HB PHE 30 10.382 -7.143 -4.642 246 HD1 PHE 30 HD2 PHE 30 10.859 -8.053 -7.255 247 HD2 PHE 30 HD1 PHE 30 8.365 -9.807 -4.286 248 HE1 PHE 30 HE2 PHE 30 9.510 -9.112 -9.019 249 HE2 PHE 30 HE1 PHE 30 7.012 -10.870 -6.045 250 HZ PHE 30 HZ PHE 30 7.583 -10.522 -8.415 251 H GLY 31 H GLY 31 11.985 -6.034 -5.187 252 HA2 GLY 31 2HA GLY 31 13.438 -5.203 -2.827 253 HA3 GLY 31 3HA GLY 31 14.332 -5.015 -4.328 254 H GLU 32 H GLU 32 13.968 -2.772 -2.995 255 HA GLU 32 HA GLU 32 11.575 -1.373 -3.343 256 HB2 GLU 32 2HB GLU 32 12.853 0.636 -2.944 257 HB3 GLU 32 3HB GLU 32 13.446 -0.639 -1.890 258 HG2 GLU 32 2HG GLU 32 15.389 -0.949 -3.199 259 HG3 GLU 32 3HG GLU 32 14.748 0.043 -4.508 260 H GLY 33 H GLY 33 14.062 -2.187 -5.599 261 HA2 GLY 33 2HA GLY 33 13.552 -0.154 -7.521 262 HA3 GLY 33 3HA GLY 33 14.383 -1.674 -7.818 263 H ASN 34 H ASN 34 12.696 -3.619 -7.600 264 HA ASN 34 HA ASN 34 10.987 -3.376 -9.829 265 HB2 ASN 34 2HB ASN 34 10.802 -5.510 -7.700 266 HB3 ASN 34 3HB ASN 34 10.341 -5.637 -9.395 267 HD21 ASN 34 1HD2 ASN 34 11.867 -6.078 -10.913 268 HD22 ASN 34 2HD2 ASN 34 13.509 -6.459 -10.535 269 H PHE 35 H PHE 35 10.351 -3.410 -6.344 270 HA PHE 35 HA PHE 35 7.573 -3.421 -6.404 271 HB2 PHE 35 2HB PHE 35 9.648 -2.613 -4.468 272 HB3 PHE 35 3HB PHE 35 8.073 -1.863 -4.231 273 HD1 PHE 35 HD2 PHE 35 8.895 -5.277 -5.445 274 HD2 PHE 35 HD1 PHE 35 7.206 -2.896 -2.347 275 HE1 PHE 35 HE2 PHE 35 8.100 -7.314 -4.317 276 HE2 PHE 35 HE1 PHE 35 6.409 -4.930 -1.214 277 HZ PHE 35 HZ PHE 35 6.854 -7.143 -2.200 278 H ARG 36 H ARG 36 9.808 -0.666 -6.497 279 HA ARG 36 HA ARG 36 7.854 1.355 -6.511 280 HB2 ARG 36 2HB ARG 36 10.721 1.217 -7.380 281 HB3 ARG 36 3HB ARG 36 9.768 2.657 -7.716 282 HG2 ARG 36 2HG ARG 36 9.424 3.076 -5.410 283 HG3 ARG 36 3HG ARG 36 10.062 1.493 -4.961 284 HD2 ARG 36 2HD ARG 36 12.097 2.362 -4.798 285 HD3 ARG 36 3HD ARG 36 12.038 2.817 -6.500 286 HE ARG 36 HE ARG 36 10.657 4.683 -4.843 287 HH11 ARG 36 1HH1 ARG 36 13.812 3.711 -5.948 288 HH12 ARG 36 2HH1 ARG 36 14.515 5.279 -5.728 289 HH21 ARG 36 1HH2 ARG 36 11.571 6.751 -4.548 290 HH22 ARG 36 2HH2 ARG 36 13.240 7.008 -4.931 291 H TRP 37 H TRP 37 9.464 -0.372 -9.151 292 HA TRP 37 HA TRP 37 8.485 1.068 -11.307 293 HB2 TRP 37 2HB TRP 37 10.165 -0.605 -11.662 294 HB3 TRP 37 3HB TRP 37 9.111 -1.876 -11.047 295 HD1 TRP 37 HD1 TRP 37 9.812 0.181 -14.173 296 HE1 TRP 37 HE1 TRP 37 8.516 -0.837 -16.149 297 HE3 TRP 37 HE3 TRP 37 6.967 -3.210 -11.615 298 HZ2 TRP 37 HZ2 TRP 37 6.547 -2.816 -16.569 299 HZ3 TRP 37 HZ3 TRP 37 5.401 -4.627 -12.879 300 HH2 TRP 37 HH2 TRP 37 5.197 -4.432 -15.304 301 H ALA 38 H ALA 38 6.989 -1.621 -9.551 302 HA ALA 38 HA ALA 38 4.707 -1.839 -11.210 303 HB1 ALA 38 1HB ALA 38 3.741 -3.144 -9.374 304 HB2 ALA 38 2HB ALA 38 5.394 -3.643 -9.732 305 HB3 ALA 38 3HB ALA 38 5.063 -2.635 -8.323 306 H ILE 39 H ILE 39 5.076 -0.370 -7.977 307 HA ILE 39 HA ILE 39 2.535 0.704 -7.741 308 HB ILE 39 HB ILE 39 5.111 1.894 -6.705 309 HG12 ILE 39 2HG1 ILE 39 3.171 0.165 -5.182 310 HG13 ILE 39 3HG1 ILE 39 4.499 -0.533 -6.104 311 HG21 ILE 39 1HG2 ILE 39 2.289 2.642 -6.404 312 HG22 ILE 39 2HG2 ILE 39 3.195 2.536 -4.895 313 HG23 ILE 39 3HG2 ILE 39 3.750 3.604 -6.184 314 HD11 ILE 39 3HD1 ILE 39 6.070 0.839 -4.764 315 HD12 ILE 39 1HD1 ILE 39 4.704 1.363 -3.780 316 HD13 ILE 39 2HD1 ILE 39 5.161 -0.341 -3.820 317 H ARG 40 H ARG 40 5.462 2.344 -8.951 318 HA ARG 40 HA ARG 40 4.347 4.781 -9.607 319 HB2 ARG 40 2HB ARG 40 6.771 4.228 -9.698 320 HB3 ARG 40 3HB ARG 40 6.480 3.330 -11.181 321 HG2 ARG 40 2HG ARG 40 5.461 5.595 -11.999 322 HG3 ARG 40 3HG ARG 40 6.457 6.268 -10.708 323 HD2 ARG 40 2HD ARG 40 7.659 4.337 -12.641 324 HD3 ARG 40 3HD ARG 40 7.413 6.013 -13.130 325 HE ARG 40 HE ARG 40 8.714 5.938 -10.633 326 HH11 ARG 40 1HH1 ARG 40 9.288 5.288 -14.005 327 HH12 ARG 40 2HH1 ARG 40 10.986 5.622 -13.914 328 HH21 ARG 40 1HH2 ARG 40 10.948 6.380 -10.501 329 HH22 ARG 40 2HH2 ARG 40 11.929 6.242 -11.920 330 H MET 41 H MET 41 4.596 1.883 -11.653 331 HA MET 41 HA MET 41 3.480 2.878 -13.977 332 HB2 MET 41 2HB MET 41 4.462 0.682 -13.932 333 HB3 MET 41 3HB MET 41 3.271 0.119 -12.768 334 HG2 MET 41 2HG MET 41 1.513 0.350 -14.429 335 HG3 MET 41 3HG MET 41 2.683 0.963 -15.595 336 HE1 MET 41 3HE MET 41 2.444 -2.132 -13.060 337 HE2 MET 41 1HE MET 41 0.976 -2.019 -14.032 338 HE3 MET 41 2HE MET 41 2.081 -3.374 -14.259 339 H ALA 42 H ALA 42 1.852 1.574 -11.118 340 HA ALA 42 HA ALA 42 -0.774 1.744 -12.192 341 HB1 ALA 42 1HB ALA 42 -1.353 0.692 -10.316 342 HB2 ALA 42 2HB ALA 42 0.366 0.655 -9.922 343 HB3 ALA 42 3HB ALA 42 -0.653 1.953 -9.301 344 H ASN 43 H ASN 43 1.087 3.841 -10.004 345 HA ASN 43 HA ASN 43 -0.873 5.759 -9.525 346 HB2 ASN 43 2HB ASN 43 1.632 5.427 -8.639 347 HB3 ASN 43 3HB ASN 43 1.935 6.693 -9.825 348 HD21 ASN 43 1HD2 ASN 43 2.570 7.793 -7.779 349 HD22 ASN 43 2HD2 ASN 43 1.342 8.663 -6.930 350 H VAL 44 H VAL 44 1.004 5.149 -12.354 351 HA VAL 44 HA VAL 44 0.420 7.753 -13.522 352 HB VAL 44 HB VAL 44 1.838 5.384 -14.750 353 HG11 VAL 44 1HG1 VAL 44 1.573 8.256 -15.626 354 HG12 VAL 44 2HG1 VAL 44 2.700 7.098 -16.337 355 HG13 VAL 44 3HG1 VAL 44 0.961 6.826 -16.455 356 HG21 VAL 44 3HG2 VAL 44 3.618 5.934 -13.540 357 HG22 VAL 44 1HG2 VAL 44 3.584 7.556 -14.231 358 HG23 VAL 44 2HG2 VAL 44 2.698 7.211 -12.746 359 H SER 45 H SER 45 0.017 4.387 -14.641 360 HA SER 45 HA SER 45 -1.767 4.870 -16.684 361 HB2 SER 45 2HB SER 45 -0.857 2.689 -16.527 362 HB3 SER 45 3HB SER 45 -1.431 2.481 -14.873 363 HG SER 45 HG SER 45 -3.204 2.847 -17.044 364 H THR 46 H THR 46 -2.351 4.732 -13.249 365 HA THR 46 HA THR 46 -5.163 5.449 -13.749 366 HB THR 46 HB THR 46 -5.918 4.167 -11.883 367 HG1 THR 46 HG1 THR 46 -3.267 3.275 -11.397 368 HG21 THR 46 3HG2 THR 46 -5.635 2.888 -13.941 369 HG22 THR 46 1HG2 THR 46 -5.310 1.875 -12.536 370 HG23 THR 46 2HG2 THR 46 -3.972 2.510 -13.494 371 H GLY 47 H GLY 47 -3.368 7.435 -13.521 372 HA2 GLY 47 2HA GLY 47 -4.326 8.984 -11.405 373 HA3 GLY 47 3HA GLY 47 -2.793 8.296 -10.892 374 H ARG 48 H ARG 48 -1.414 8.340 -13.322 375 HA ARG 48 HA ARG 48 -0.119 9.694 -14.613 376 HB2 ARG 48 2HB ARG 48 -2.573 10.427 -15.269 377 HB3 ARG 48 3HB ARG 48 -2.108 11.916 -14.459 378 HG2 ARG 48 2HG ARG 48 -1.412 12.482 -16.520 379 HG3 ARG 48 3HG ARG 48 0.029 11.581 -16.044 380 HD2 ARG 48 2HD ARG 48 -0.447 9.830 -17.411 381 HD3 ARG 48 3HD ARG 48 -2.190 10.028 -17.235 382 HE ARG 48 HE ARG 48 -1.225 12.209 -18.679 383 HH11 ARG 48 1HH1 ARG 48 -1.542 8.759 -19.029 384 HH12 ARG 48 2HH1 ARG 48 -1.682 8.816 -20.755 385 HH21 ARG 48 1HH2 ARG 48 -1.408 12.297 -20.951 386 HH22 ARG 48 2HH2 ARG 48 -1.604 10.829 -21.847 387 H GLU 49 H GLU 49 0.556 9.666 -11.998 388 HA GLU 49 HA GLU 49 1.987 12.091 -11.695 389 HB2 GLU 49 2HB GLU 49 -0.204 12.922 -10.959 390 HB3 GLU 49 3HB GLU 49 -0.287 11.646 -9.753 391 HG2 GLU 49 2HG GLU 49 1.191 12.662 -8.365 392 HG3 GLU 49 3HG GLU 49 2.073 13.431 -9.684 393 HA PRO 50 HA PRO 50 3.638 8.306 -9.575 394 HB2 PRO 50 2HB PRO 50 6.097 8.458 -10.715 395 HB3 PRO 50 3HB PRO 50 4.734 7.632 -11.479 396 HG2 PRO 50 2HG PRO 50 5.811 10.378 -11.988 397 HG3 PRO 50 3HG PRO 50 5.276 9.153 -13.153 398 HD2 PRO 50 2HD PRO 50 3.723 11.249 -12.426 399 HD3 PRO 50 3HD PRO 50 3.048 9.665 -12.858 400 H GLY 51 H GLY 51 4.434 11.634 -9.779 401 HA2 GLY 51 2HA GLY 51 6.562 11.494 -7.802 402 HA3 GLY 51 3HA GLY 51 5.949 12.948 -8.575 403 H ASP 52 H ASP 52 4.346 10.403 -6.671 404 HA ASP 52 HA ASP 52 4.043 11.873 -4.315 405 HB2 ASP 52 2HB ASP 52 2.661 13.451 -5.383 406 HB3 ASP 52 3HB ASP 52 1.839 12.217 -6.335 407 H ILE 53 H ILE 53 4.457 9.830 -3.465 408 HA ILE 53 HA ILE 53 3.198 7.447 -4.050 409 HB ILE 53 HB ILE 53 3.653 6.847 -1.612 410 HG12 ILE 53 2HG1 ILE 53 5.279 9.357 -1.510 411 HG13 ILE 53 3HG1 ILE 53 3.578 9.426 -1.064 412 HG21 ILE 53 1HG2 ILE 53 6.171 7.014 -1.983 413 HG22 ILE 53 2HG2 ILE 53 5.229 6.162 -3.205 414 HG23 ILE 53 3HG2 ILE 53 5.773 7.812 -3.504 415 HD11 ILE 53 3HD1 ILE 53 4.289 8.905 0.977 416 HD12 ILE 53 1HD1 ILE 53 4.460 7.266 0.352 417 HD13 ILE 53 2HD1 ILE 53 5.855 8.345 0.390 418 HA PRO 54 HA PRO 54 -0.939 7.679 -2.601 419 HB2 PRO 54 2HB PRO 54 -1.337 5.148 -1.703 420 HB3 PRO 54 3HB PRO 54 -1.223 5.551 -3.420 421 HG2 PRO 54 2HG PRO 54 0.868 4.429 -1.596 422 HG3 PRO 54 3HG PRO 54 0.473 3.969 -3.262 423 HD2 PRO 54 2HD PRO 54 2.572 5.566 -2.650 424 HD3 PRO 54 3HD PRO 54 1.656 5.731 -4.162 425 H GLU 55 H GLU 55 -2.268 6.627 -0.581 426 HA GLU 55 HA GLU 55 -0.856 6.653 1.908 427 HB2 GLU 55 2HB GLU 55 -1.929 9.143 0.868 428 HB3 GLU 55 3HB GLU 55 -2.659 8.719 2.410 429 HG2 GLU 55 2HG GLU 55 -0.406 8.490 3.381 430 HG3 GLU 55 3HG GLU 55 0.282 9.009 1.843 431 H THR 56 H THR 56 -4.119 7.781 1.064 432 HA THR 56 HA THR 56 -5.418 6.260 3.024 433 HB THR 56 HB THR 56 -7.479 6.884 2.010 434 HG1 THR 56 HG1 THR 56 -7.689 7.325 -0.113 435 HG21 THR 56 3HG2 THR 56 -5.650 8.719 2.746 436 HG22 THR 56 1HG2 THR 56 -7.282 9.133 2.225 437 HG23 THR 56 2HG2 THR 56 -5.941 9.232 1.084 438 H LEU 57 H LEU 57 -5.873 4.166 3.144 439 HA LEU 57 HA LEU 57 -5.061 2.252 1.331 440 HB2 LEU 57 2HB LEU 57 -6.252 2.254 3.810 441 HB3 LEU 57 3HB LEU 57 -7.466 1.483 2.791 442 HG LEU 57 HG LEU 57 -5.831 -0.207 2.119 443 HD11 LEU 57 1HD1 LEU 57 -3.996 1.413 3.854 444 HD12 LEU 57 2HD1 LEU 57 -3.760 0.879 2.190 445 HD13 LEU 57 3HD1 LEU 57 -3.693 -0.290 3.508 446 HD21 LEU 57 3HD2 LEU 57 -5.613 -1.335 4.303 447 HD22 LEU 57 1HD2 LEU 57 -7.227 -0.679 4.032 448 HD23 LEU 57 2HD2 LEU 57 -6.103 0.161 5.100 449 H ASP 58 H ASP 58 -8.018 4.099 1.407 450 HA ASP 58 HA ASP 58 -9.535 2.505 -0.366 451 HB2 ASP 58 2HB ASP 58 -9.711 5.482 0.153 452 HB3 ASP 58 3HB ASP 58 -10.942 4.506 -0.644 453 H GLN 59 H GLN 59 -7.424 5.307 -0.894 454 HA GLN 59 HA GLN 59 -7.861 5.523 -3.668 455 HB2 GLN 59 2HB GLN 59 -5.700 6.456 -1.812 456 HB3 GLN 59 3HB GLN 59 -5.504 6.642 -3.550 457 HG2 GLN 59 2HG GLN 59 -8.030 7.599 -2.324 458 HG3 GLN 59 3HG GLN 59 -6.562 8.534 -2.047 459 HE21 GLN 59 1HE2 GLN 59 -5.231 8.448 -4.332 460 HE22 GLN 59 2HE2 GLN 59 -6.151 9.116 -5.632 461 H LEU 60 H LEU 60 -5.316 3.874 -1.817 462 HA LEU 60 HA LEU 60 -3.910 2.894 -4.062 463 HB2 LEU 60 2HB LEU 60 -2.862 3.019 -1.897 464 HB3 LEU 60 3HB LEU 60 -4.046 1.904 -1.219 465 HG LEU 60 HG LEU 60 -2.989 0.358 -3.163 466 HD11 LEU 60 1HD1 LEU 60 -0.898 2.351 -2.372 467 HD12 LEU 60 2HD1 LEU 60 -1.313 1.750 -3.977 468 HD13 LEU 60 3HD1 LEU 60 -0.464 0.706 -2.838 469 HD21 LEU 60 3HD2 LEU 60 -1.900 0.738 -0.376 470 HD22 LEU 60 1HD2 LEU 60 -1.665 -0.687 -1.388 471 HD23 LEU 60 2HD2 LEU 60 -3.282 -0.262 -0.827 472 H ARG 61 H ARG 61 -6.210 1.275 -1.870 473 HA ARG 61 HA ARG 61 -6.297 -1.200 -3.087 474 HB2 ARG 61 2HB ARG 61 -8.382 0.380 -1.603 475 HB3 ARG 61 3HB ARG 61 -8.735 -1.222 -2.237 476 HG2 ARG 61 2HG ARG 61 -7.151 -2.243 -0.833 477 HG3 ARG 61 3HG ARG 61 -6.401 -0.698 -0.426 478 HD2 ARG 61 2HD ARG 61 -7.660 -1.135 1.460 479 HD3 ARG 61 3HD ARG 61 -8.744 -0.108 0.523 480 HE ARG 61 HE ARG 61 -9.154 -2.877 -0.022 481 HH11 ARG 61 1HH1 ARG 61 -9.853 -0.332 2.249 482 HH12 ARG 61 2HH1 ARG 61 -11.314 -1.066 2.821 483 HH21 ARG 61 1HH2 ARG 61 -11.076 -3.853 0.723 484 HH22 ARG 61 2HH2 ARG 61 -12.008 -3.070 1.953 485 H LEU 62 H LEU 62 -7.948 1.772 -3.993 486 HA LEU 62 HA LEU 62 -9.632 0.602 -5.961 487 HB2 LEU 62 2HB LEU 62 -8.946 3.289 -5.031 488 HB3 LEU 62 3HB LEU 62 -9.318 3.204 -6.751 489 HG LEU 62 HG LEU 62 -11.285 3.815 -5.457 490 HD11 LEU 62 1HD1 LEU 62 -12.660 2.614 -6.759 491 HD12 LEU 62 2HD1 LEU 62 -12.034 1.072 -6.177 492 HD13 LEU 62 3HD1 LEU 62 -11.168 1.958 -7.433 493 HD21 LEU 62 3HD2 LEU 62 -12.091 1.533 -4.151 494 HD22 LEU 62 1HD2 LEU 62 -11.428 2.981 -3.392 495 HD23 LEU 62 2HD2 LEU 62 -10.370 1.622 -3.773 496 H VAL 63 H VAL 63 -6.442 2.112 -6.048 497 HA VAL 63 HA VAL 63 -6.115 2.235 -8.826 498 HB VAL 63 HB VAL 63 -3.995 1.809 -6.715 499 HG11 VAL 63 1HG1 VAL 63 -2.578 1.588 -8.415 500 HG12 VAL 63 2HG1 VAL 63 -3.851 1.919 -9.591 501 HG13 VAL 63 3HG1 VAL 63 -2.951 3.251 -8.865 502 HG21 VAL 63 3HG2 VAL 63 -4.239 4.454 -7.906 503 HG22 VAL 63 1HG2 VAL 63 -5.686 3.960 -7.027 504 HG23 VAL 63 2HG2 VAL 63 -4.122 3.982 -6.211 505 H ILE 64 H ILE 64 -5.567 -0.387 -6.538 506 HA ILE 64 HA ILE 64 -4.259 -2.129 -8.357 507 HB ILE 64 HB ILE 64 -5.813 -2.815 -5.859 508 HG12 ILE 64 2HG1 ILE 64 -2.825 -2.519 -6.187 509 HG13 ILE 64 3HG1 ILE 64 -3.861 -1.217 -5.614 510 HG21 ILE 64 1HG2 ILE 64 -4.469 -4.443 -7.845 511 HG22 ILE 64 2HG2 ILE 64 -3.814 -4.692 -6.227 512 HG23 ILE 64 3HG2 ILE 64 -5.537 -4.923 -6.527 513 HD11 ILE 64 3HD1 ILE 64 -4.343 -3.632 -4.129 514 HD12 ILE 64 1HD1 ILE 64 -2.635 -3.194 -4.095 515 HD13 ILE 64 2HD1 ILE 64 -3.854 -2.036 -3.560 516 H CYS 65 H CYS 65 -7.599 -2.132 -7.100 517 HA CYS 65 HA CYS 65 -8.548 -4.202 -8.727 518 HB2 CYS 65 2HB CYS 65 -9.602 -2.745 -6.696 519 HB3 CYS 65 3HB CYS 65 -10.468 -2.055 -8.063 520 HG CYS 65 HG CYS 65 -10.562 -5.287 -8.419 521 H ASP 66 H ASP 66 -8.652 -0.683 -9.202 522 HA ASP 66 HA ASP 66 -10.054 -0.652 -11.611 523 HB2 ASP 66 2HB ASP 66 -9.517 1.349 -10.216 524 HB3 ASP 66 3HB ASP 66 -7.856 1.258 -10.795 525 H LEU 67 H LEU 67 -6.547 -0.783 -11.047 526 HA LEU 67 HA LEU 67 -5.819 -0.841 -13.775 527 HB2 LEU 67 2HB LEU 67 -4.215 -0.226 -12.101 528 HB3 LEU 67 3HB LEU 67 -4.382 -1.788 -11.303 529 HG LEU 67 HG LEU 67 -3.560 -2.242 -13.991 530 HD11 LEU 67 1HD1 LEU 67 -1.268 -1.112 -13.673 531 HD12 LEU 67 2HD1 LEU 67 -2.120 -0.038 -12.565 532 HD13 LEU 67 3HD1 LEU 67 -2.618 -0.136 -14.254 533 HD21 LEU 67 3HD2 LEU 67 -2.328 -2.604 -11.273 534 HD22 LEU 67 1HD2 LEU 67 -1.518 -3.113 -12.755 535 HD23 LEU 67 2HD2 LEU 67 -3.074 -3.818 -12.313 536 H GLN 68 H GLN 68 -5.881 -3.483 -11.375 537 HA GLN 68 HA GLN 68 -5.338 -5.575 -13.113 538 HB2 GLN 68 2HB GLN 68 -5.293 -5.919 -10.732 539 HB3 GLN 68 3HB GLN 68 -7.003 -5.529 -10.594 540 HG2 GLN 68 2HG GLN 68 -6.226 -7.798 -12.342 541 HG3 GLN 68 3HG GLN 68 -6.130 -8.017 -10.595 542 HE21 GLN 68 1HE2 GLN 68 -7.789 -9.674 -11.399 543 HE22 GLN 68 2HE2 GLN 68 -9.441 -9.174 -11.326 544 H GLU 69 H GLU 69 -8.275 -3.790 -12.630 545 HA GLU 69 HA GLU 69 -10.064 -5.671 -13.776 546 HB2 GLU 69 2HB GLU 69 -10.157 -2.817 -12.997 547 HB3 GLU 69 3HB GLU 69 -11.306 -3.316 -14.230 548 HG2 GLU 69 2HG GLU 69 -11.436 -5.279 -12.246 549 HG3 GLU 69 3HG GLU 69 -11.371 -3.738 -11.393 550 H ARG 70 H ARG 70 -8.788 -2.620 -15.121 551 HA ARG 70 HA ARG 70 -9.678 -3.099 -17.744 552 HB2 ARG 70 2HB ARG 70 -8.669 -0.949 -16.502 553 HB3 ARG 70 3HB ARG 70 -7.222 -1.478 -17.350 554 HG2 ARG 70 2HG ARG 70 -8.167 -1.130 -19.442 555 HG3 ARG 70 3HG ARG 70 -9.813 -1.156 -18.808 556 HD2 ARG 70 2HD ARG 70 -8.226 0.942 -17.598 557 HD3 ARG 70 3HD ARG 70 -8.271 1.088 -19.355 558 HE ARG 70 HE ARG 70 -10.449 1.497 -17.524 559 HH11 ARG 70 1HH1 ARG 70 -9.565 0.707 -20.797 560 HH12 ARG 70 2HH1 ARG 70 -11.069 1.241 -21.471 561 HH21 ARG 70 1HH2 ARG 70 -12.433 2.205 -18.399 562 HH22 ARG 70 2HH2 ARG 70 -12.699 2.094 -20.106 563 H ARG 71 H ARG 71 -6.516 -3.631 -16.218 564 HA ARG 71 HA ARG 71 -5.119 -4.518 -18.453 565 HB2 ARG 71 2HB ARG 71 -4.841 -4.848 -15.520 566 HB3 ARG 71 3HB ARG 71 -3.963 -5.995 -16.523 567 HG2 ARG 71 2HG ARG 71 -2.601 -4.056 -15.893 568 HG3 ARG 71 3HG ARG 71 -2.809 -4.192 -17.640 569 HD2 ARG 71 2HD ARG 71 -4.844 -2.570 -16.287 570 HD3 ARG 71 3HD ARG 71 -3.207 -1.921 -16.193 571 HE ARG 71 HE ARG 71 -4.891 -1.950 -18.476 572 HH11 ARG 71 1HH1 ARG 71 -1.566 -2.262 -17.492 573 HH12 ARG 71 2HH1 ARG 71 -0.930 -1.698 -19.002 574 HH21 ARG 71 1HH2 ARG 71 -4.066 -1.205 -20.468 575 HH22 ARG 71 2HH2 ARG 71 -2.353 -1.096 -20.693 576 H GLU 72 H GLU 72 -7.052 -6.378 -16.126 577 HA GLU 72 HA GLU 72 -6.569 -8.925 -17.153 578 HB2 GLU 72 2HB GLU 72 -7.652 -8.686 -15.029 579 HB3 GLU 72 3HB GLU 72 -8.985 -7.792 -15.745 580 HG2 GLU 72 2HG GLU 72 -9.640 -9.811 -16.988 581 HG3 GLU 72 3HG GLU 72 -8.341 -10.697 -16.192 582 H LYS 73 H LYS 73 -9.171 -6.634 -17.939 583 HA LYS 73 HA LYS 73 -10.561 -8.184 -19.773 584 HB2 LYS 73 2HB LYS 73 -10.582 -5.491 -18.912 585 HB3 LYS 73 3HB LYS 73 -10.500 -5.455 -20.669 586 HG2 LYS 73 2HG LYS 73 -12.456 -7.014 -20.705 587 HG3 LYS 73 3HG LYS 73 -12.587 -6.787 -18.960 588 HD2 LYS 73 2HD LYS 73 -13.185 -4.548 -19.172 589 HD3 LYS 73 3HD LYS 73 -12.521 -4.426 -20.803 590 HE2 LYS 73 2HE LYS 73 -14.492 -6.407 -20.937 591 HE3 LYS 73 3HE LYS 73 -15.185 -5.119 -19.952 592 HZ1 LYS 73 3HZ LYS 73 -15.553 -4.921 -22.406 593 HZ2 LYS 73 1HZ LYS 73 -13.896 -4.626 -22.575 594 HZ3 LYS 73 2HZ LYS 73 -14.857 -3.562 -21.678 595 H PHE 74 H PHE 74 -7.701 -6.169 -20.236 596 HA PHE 74 HA PHE 74 -7.623 -6.546 -23.074 597 HB2 PHE 74 2HB PHE 74 -6.108 -5.072 -21.071 598 HB3 PHE 74 3HB PHE 74 -5.063 -5.806 -22.283 599 HD1 PHE 74 HD2 PHE 74 -5.384 -5.249 -24.682 600 HD2 PHE 74 HD1 PHE 74 -7.462 -3.207 -21.579 601 HE1 PHE 74 HE2 PHE 74 -5.907 -3.420 -26.241 602 HE2 PHE 74 HE1 PHE 74 -7.990 -1.374 -23.134 603 HZ PHE 74 HZ PHE 74 -7.211 -1.479 -25.468 604 H GLY 75 H GLY 75 -6.423 -8.253 -20.306 605 HA2 GLY 75 2HA GLY 75 -6.014 -10.686 -21.074 606 HA3 GLY 75 3HA GLY 75 -4.731 -9.944 -22.019 607 H SER 76 H SER 76 -4.060 -11.902 -20.286 608 HA SER 76 HA SER 76 -3.100 -10.600 -17.846 609 HB2 SER 76 2HB SER 76 -4.161 -13.105 -18.265 610 HB3 SER 76 3HB SER 76 -2.429 -13.433 -18.213 611 HG SER 76 HG SER 76 -4.137 -12.563 -16.214 612 H SER 77 H SER 77 -0.894 -10.740 -17.209 613 HA SER 77 HA SER 77 1.092 -11.649 -19.088 614 HB2 SER 77 2HB SER 77 1.781 -9.687 -19.974 615 HB3 SER 77 3HB SER 77 0.193 -9.087 -19.496 616 HG SER 77 HG SER 77 2.457 -8.140 -18.714 617 H LYS 78 H LYS 78 2.966 -12.155 -18.088 618 HA LYS 78 HA LYS 78 3.112 -12.425 -15.341 619 HB2 LYS 78 2HB LYS 78 4.546 -13.665 -16.891 620 HB3 LYS 78 3HB LYS 78 5.397 -12.183 -17.307 621 HG2 LYS 78 2HG LYS 78 6.671 -12.245 -15.463 622 HG3 LYS 78 3HG LYS 78 5.347 -12.810 -14.441 623 HD2 LYS 78 2HD LYS 78 5.611 -15.065 -15.512 624 HD3 LYS 78 3HD LYS 78 7.071 -14.451 -16.292 625 HE2 LYS 78 2HE LYS 78 7.840 -15.547 -14.370 626 HE3 LYS 78 3HE LYS 78 7.857 -13.836 -13.943 627 HZ1 LYS 78 3HZ LYS 78 6.435 -14.209 -12.302 628 HZ2 LYS 78 1HZ LYS 78 6.606 -15.870 -12.575 629 HZ3 LYS 78 2HZ LYS 78 5.351 -15.015 -13.319 630 H GLU 79 H GLU 79 3.990 -9.707 -17.351 631 HA GLU 79 HA GLU 79 5.493 -8.310 -15.377 632 HB2 GLU 79 2HB GLU 79 4.572 -7.840 -18.098 633 HB3 GLU 79 3HB GLU 79 4.477 -6.390 -17.109 634 HG2 GLU 79 2HG GLU 79 6.833 -6.623 -16.526 635 HG3 GLU 79 3HG GLU 79 6.932 -8.086 -17.504 636 H ILE 80 H ILE 80 2.163 -7.950 -16.583 637 HA ILE 80 HA ILE 80 1.421 -5.881 -14.827 638 HB ILE 80 HB ILE 80 -0.343 -7.966 -16.118 639 HG12 ILE 80 2HG1 ILE 80 0.109 -5.142 -17.060 640 HG13 ILE 80 3HG1 ILE 80 1.145 -6.463 -17.589 641 HG21 ILE 80 1HG2 ILE 80 -0.952 -5.382 -14.714 642 HG22 ILE 80 2HG2 ILE 80 -2.070 -6.113 -15.865 643 HG23 ILE 80 3HG2 ILE 80 -1.614 -6.986 -14.403 644 HD11 ILE 80 3HD1 ILE 80 -1.453 -5.687 -18.525 645 HD12 ILE 80 1HD1 ILE 80 -0.309 -6.843 -19.209 646 HD13 ILE 80 2HD1 ILE 80 -1.464 -7.365 -17.982 647 H ASP 81 H ASP 81 0.724 -9.375 -14.650 648 HA ASP 81 HA ASP 81 -0.569 -9.393 -12.197 649 HB2 ASP 81 2HB ASP 81 1.009 -11.426 -13.722 650 HB3 ASP 81 3HB ASP 81 0.514 -11.794 -12.072 651 H MET 82 H MET 82 2.893 -9.586 -12.905 652 HA MET 82 HA MET 82 3.820 -10.098 -10.325 653 HB2 MET 82 2HB MET 82 5.290 -10.261 -12.237 654 HB3 MET 82 3HB MET 82 5.105 -8.545 -12.576 655 HG2 MET 82 2HG MET 82 6.021 -8.845 -9.901 656 HG3 MET 82 3HG MET 82 7.033 -9.823 -10.960 657 HE1 MET 82 3HE MET 82 9.168 -8.183 -12.654 658 HE2 MET 82 1HE MET 82 7.737 -9.095 -13.136 659 HE3 MET 82 2HE MET 82 7.962 -7.442 -13.707 660 H ALA 83 H ALA 83 3.282 -6.986 -11.958 661 HA ALA 83 HA ALA 83 4.152 -5.297 -9.929 662 HB1 ALA 83 1HB ALA 83 2.079 -3.899 -11.051 663 HB2 ALA 83 2HB ALA 83 3.728 -3.965 -11.674 664 HB3 ALA 83 3HB ALA 83 2.498 -5.051 -12.320 665 H ILE 84 H ILE 84 0.921 -6.662 -10.481 666 HA ILE 84 HA ILE 84 -0.436 -5.366 -8.425 667 HB ILE 84 HB ILE 84 -0.903 -8.173 -9.439 668 HG12 ILE 84 2HG1 ILE 84 -2.302 -5.634 -10.282 669 HG13 ILE 84 3HG1 ILE 84 -0.906 -6.279 -11.138 670 HG21 ILE 84 1HG2 ILE 84 -2.210 -6.581 -7.405 671 HG22 ILE 84 2HG2 ILE 84 -3.323 -7.049 -8.690 672 HG23 ILE 84 3HG2 ILE 84 -2.420 -8.284 -7.813 673 HD11 ILE 84 3HD1 ILE 84 -3.633 -6.956 -11.438 674 HD12 ILE 84 1HD1 ILE 84 -2.237 -7.598 -12.303 675 HD13 ILE 84 2HD1 ILE 84 -2.787 -8.374 -10.818 676 H VAL 85 H VAL 85 1.362 -8.425 -8.366 677 HA VAL 85 HA VAL 85 0.799 -9.189 -5.747 678 HB VAL 85 HB VAL 85 3.351 -9.649 -7.297 679 HG11 VAL 85 1HG1 VAL 85 3.756 -10.086 -4.981 680 HG12 VAL 85 2HG1 VAL 85 2.245 -10.986 -4.833 681 HG13 VAL 85 3HG1 VAL 85 3.569 -11.636 -5.801 682 HG21 VAL 85 3HG2 VAL 85 2.262 -11.164 -8.510 683 HG22 VAL 85 1HG2 VAL 85 1.568 -11.904 -7.068 684 HG23 VAL 85 2HG2 VAL 85 0.761 -10.535 -7.832 685 H THR 86 H THR 86 3.478 -7.210 -6.988 686 HA THR 86 HA THR 86 4.770 -6.792 -4.535 687 HB THR 86 HB THR 86 5.985 -5.035 -5.583 688 HG1 THR 86 HG1 THR 86 4.524 -3.719 -6.521 689 HG21 THR 86 3HG2 THR 86 5.798 -7.531 -6.689 690 HG22 THR 86 1HG2 THR 86 6.999 -6.317 -7.125 691 HG23 THR 86 2HG2 THR 86 5.529 -6.488 -8.085 692 H LEU 87 H LEU 87 2.026 -5.208 -6.019 693 HA LEU 87 HA LEU 87 1.982 -2.928 -4.329 694 HB2 LEU 87 2HB LEU 87 0.288 -4.122 -6.379 695 HB3 LEU 87 3HB LEU 87 -0.629 -3.331 -5.099 696 HG LEU 87 HG LEU 87 1.479 -2.041 -6.831 697 HD11 LEU 87 1HD1 LEU 87 -1.009 -2.660 -7.608 698 HD12 LEU 87 2HD1 LEU 87 -0.164 -1.205 -8.135 699 HD13 LEU 87 3HD1 LEU 87 -1.325 -1.118 -6.811 700 HD21 LEU 87 3HD2 LEU 87 1.576 -0.974 -4.729 701 HD22 LEU 87 1HD2 LEU 87 -0.177 -1.009 -4.543 702 HD23 LEU 87 2HD2 LEU 87 0.561 0.054 -5.742 703 H LYS 88 H LYS 88 0.536 -6.132 -4.142 704 HA LYS 88 HA LYS 88 -1.118 -5.595 -1.896 705 HB2 LYS 88 2HB LYS 88 -0.295 -7.958 -3.451 706 HB3 LYS 88 3HB LYS 88 -0.674 -8.285 -1.765 707 HG2 LYS 88 2HG LYS 88 -2.883 -7.483 -2.006 708 HG3 LYS 88 3HG LYS 88 -2.528 -6.775 -3.584 709 HD2 LYS 88 2HD LYS 88 -1.891 -9.314 -4.112 710 HD3 LYS 88 3HD LYS 88 -3.081 -9.590 -2.838 711 HE2 LYS 88 2HE LYS 88 -4.735 -8.318 -4.063 712 HE3 LYS 88 3HE LYS 88 -3.547 -7.908 -5.299 713 HZ1 LYS 88 3HZ LYS 88 -4.676 -10.584 -4.703 714 HZ2 LYS 88 1HZ LYS 88 -3.345 -10.345 -5.721 715 HZ3 LYS 88 2HZ LYS 88 -4.849 -9.685 -6.126 716 H VAL 89 H VAL 89 1.867 -7.543 -2.113 717 HA VAL 89 HA VAL 89 2.303 -7.908 0.586 718 HB VAL 89 HB VAL 89 4.477 -7.473 -1.465 719 HG11 VAL 89 1HG1 VAL 89 4.714 -7.811 1.237 720 HG12 VAL 89 2HG1 VAL 89 4.850 -9.466 0.641 721 HG13 VAL 89 3HG1 VAL 89 5.950 -8.221 0.048 722 HG21 VAL 89 3HG2 VAL 89 2.442 -9.455 -1.387 723 HG22 VAL 89 1HG2 VAL 89 3.809 -9.323 -2.493 724 HG23 VAL 89 2HG2 VAL 89 3.978 -10.225 -0.987 725 H PHE 90 H PHE 90 3.264 -5.180 -1.450 726 HA PHE 90 HA PHE 90 4.774 -3.827 0.518 727 HB2 PHE 90 2HB PHE 90 5.102 -3.226 -1.772 728 HB3 PHE 90 3HB PHE 90 3.392 -2.866 -1.988 729 HD1 PHE 90 HD2 PHE 90 5.953 -1.835 0.525 730 HD2 PHE 90 HD1 PHE 90 3.066 -0.632 -2.361 731 HE1 PHE 90 HE2 PHE 90 6.384 0.522 1.082 732 HE2 PHE 90 HE1 PHE 90 3.493 1.728 -1.810 733 HZ PHE 90 HZ PHE 90 5.153 2.308 -0.086 734 H ALA 91 H ALA 91 1.367 -3.767 -0.359 735 HA ALA 91 HA ALA 91 0.629 -1.531 1.200 736 HB1 ALA 91 1HB ALA 91 -1.639 -2.241 0.872 737 HB2 ALA 91 2HB ALA 91 -0.744 -2.511 -0.624 738 HB3 ALA 91 3HB ALA 91 -1.114 -3.869 0.440 739 H VAL 92 H VAL 92 0.359 -5.024 1.862 740 HA VAL 92 HA VAL 92 -0.570 -4.678 4.524 741 HB VAL 92 HB VAL 92 0.807 -7.119 3.402 742 HG11 VAL 92 1HG1 VAL 92 0.132 -6.682 5.950 743 HG12 VAL 92 2HG1 VAL 92 -1.415 -7.281 5.350 744 HG13 VAL 92 3HG1 VAL 92 0.036 -8.272 5.195 745 HG21 VAL 92 3HG2 VAL 92 -1.905 -7.586 3.286 746 HG22 VAL 92 1HG2 VAL 92 -1.758 -5.918 2.731 747 HG23 VAL 92 2HG2 VAL 92 -0.862 -7.201 1.917 748 H ALA 93 H ALA 93 2.578 -5.823 3.289 749 HA ALA 93 HA ALA 93 3.878 -5.808 5.781 750 HB1 ALA 93 1HB ALA 93 5.450 -5.309 3.308 751 HB2 ALA 93 2HB ALA 93 5.762 -6.417 4.645 752 HB3 ALA 93 3HB ALA 93 4.545 -6.818 3.433 753 H GLY 94 H GLY 94 2.940 -3.246 3.740 754 HA2 GLY 94 2HA GLY 94 4.951 -1.414 4.824 755 HA3 GLY 94 3HA GLY 94 3.818 -1.058 3.529 756 H LEU 95 H LEU 95 1.482 -0.961 4.199 757 HA LEU 95 HA LEU 95 1.143 0.973 6.196 758 HB2 LEU 95 2HB LEU 95 -0.774 -0.814 4.736 759 HB3 LEU 95 3HB LEU 95 -1.326 0.327 5.961 760 HG LEU 95 HG LEU 95 -1.657 1.307 3.806 761 HD11 LEU 95 1HD1 LEU 95 -0.716 3.363 4.199 762 HD12 LEU 95 2HD1 LEU 95 0.830 2.683 4.705 763 HD13 LEU 95 3HD1 LEU 95 -0.561 2.613 5.788 764 HD21 LEU 95 3HD2 LEU 95 0.266 -0.186 2.834 765 HD22 LEU 95 1HD2 LEU 95 1.252 1.240 3.161 766 HD23 LEU 95 2HD2 LEU 95 -0.140 1.359 2.085 767 H LEU 96 H LEU 96 0.455 -2.510 6.220 768 HA LEU 96 HA LEU 96 -0.321 -2.428 9.010 769 HB2 LEU 96 2HB LEU 96 -0.625 -4.240 6.799 770 HB3 LEU 96 3HB LEU 96 0.024 -5.092 8.199 771 HG LEU 96 HG LEU 96 -1.895 -4.317 9.534 772 HD11 LEU 96 1HD1 LEU 96 -3.592 -3.550 7.339 773 HD12 LEU 96 2HD1 LEU 96 -2.206 -2.468 7.469 774 HD13 LEU 96 3HD1 LEU 96 -3.267 -2.711 8.856 775 HD21 LEU 96 3HD2 LEU 96 -3.184 -6.048 8.869 776 HD22 LEU 96 1HD2 LEU 96 -1.804 -6.388 7.825 777 HD23 LEU 96 2HD2 LEU 96 -3.205 -5.529 7.183 778 H ASN 97 H ASN 97 2.564 -2.373 7.455 779 HA ASN 97 HA ASN 97 4.714 -2.911 7.985 780 HB2 ASN 97 2HB ASN 97 3.742 -1.559 10.042 781 HB3 ASN 97 3HB ASN 97 3.972 -3.094 10.874 782 HD21 ASN 97 1HD2 ASN 97 5.757 -1.086 8.549 783 HD22 ASN 97 2HD2 ASN 97 7.271 -1.180 9.376 784 H MET 98 H MET 98 2.853 -5.124 7.505 785 HA MET 98 HA MET 98 3.223 -7.255 9.274 786 HB2 MET 98 2HB MET 98 1.948 -6.863 6.830 787 HB3 MET 98 3HB MET 98 3.144 -8.108 6.496 788 HG2 MET 98 2HG MET 98 1.200 -9.257 7.105 789 HG3 MET 98 3HG MET 98 2.246 -9.324 8.522 790 HE1 MET 98 3HE MET 98 -0.034 -8.627 11.144 791 HE2 MET 98 1HE MET 98 -0.530 -9.868 9.993 792 HE3 MET 98 2HE MET 98 1.181 -9.630 10.350 793 H THR 99 H THR 99 4.403 -9.345 8.480 794 HA THR 99 HA THR 99 7.094 -8.643 7.521 795 HB THR 99 HB THR 99 6.821 -10.757 9.610 796 HG1 THR 99 HG1 THR 99 6.941 -7.959 10.156 797 HG21 THR 99 3HG2 THR 99 8.921 -9.099 8.402 798 HG22 THR 99 1HG2 THR 99 9.018 -10.709 9.115 799 HG23 THR 99 2HG2 THR 99 9.048 -9.282 10.151 800 H VAL 100 H VAL 100 5.238 -9.641 5.811 801 HA VAL 100 HA VAL 100 5.375 -12.515 5.672 802 HB VAL 100 HB VAL 100 4.253 -12.215 3.461 803 HG11 VAL 100 1HG1 VAL 100 2.135 -11.317 4.408 804 HG12 VAL 100 2HG1 VAL 100 2.901 -12.547 5.416 805 HG13 VAL 100 3HG1 VAL 100 3.032 -10.842 5.850 806 HG21 VAL 100 3HG2 VAL 100 4.239 -10.255 2.413 807 HG22 VAL 100 1HG2 VAL 100 3.501 -9.469 3.809 808 HG23 VAL 100 2HG2 VAL 100 5.256 -9.603 3.697 809 H SER 101 H SER 101 6.716 -13.751 4.480 810 HA SER 101 HA SER 101 8.799 -12.356 2.935 811 HB2 SER 101 2HB SER 101 8.848 -14.842 4.616 812 HB3 SER 101 3HB SER 101 10.023 -14.636 3.317 813 HG SER 101 HG SER 101 9.610 -12.963 5.566 814 H THR 102 H THR 102 6.028 -13.597 2.252 815 HA THR 102 HA THR 102 6.919 -14.737 -0.277 816 HB THR 102 HB THR 102 5.545 -16.703 -0.147 817 HG1 THR 102 HG1 THR 102 4.880 -16.123 2.541 818 HG21 THR 102 3HG2 THR 102 6.696 -17.972 1.538 819 HG22 THR 102 1HG2 THR 102 7.076 -16.510 2.447 820 HG23 THR 102 2HG2 THR 102 7.822 -16.790 0.874 821 H ALA 103 H ALA 103 5.692 -14.065 -1.928 822 HA ALA 103 HA ALA 103 3.791 -12.081 -1.706 823 HB1 ALA 103 1HB ALA 103 4.713 -12.307 -3.818 824 HB2 ALA 103 2HB ALA 103 4.414 -14.044 -3.875 825 HB3 ALA 103 3HB ALA 103 3.073 -12.913 -4.049 826 H ALA 104 H ALA 104 3.380 -15.546 -1.530 827 HA ALA 104 HA ALA 104 0.559 -15.590 -1.855 828 HB1 ALA 104 1HB ALA 104 2.663 -17.493 -1.189 829 HB2 ALA 104 2HB ALA 104 1.142 -17.814 -0.354 830 HB3 ALA 104 3HB ALA 104 1.178 -17.720 -2.114 831 H ALA 105 H ALA 105 2.685 -15.405 0.965 832 HA ALA 105 HA ALA 105 0.686 -15.652 2.935 833 HB1 ALA 105 1HB ALA 105 2.762 -15.953 3.836 834 HB2 ALA 105 2HB ALA 105 3.488 -14.659 2.882 835 HB3 ALA 105 3HB ALA 105 2.487 -14.268 4.281 836 H ALA 106 H ALA 106 2.003 -12.855 1.230 837 HA ALA 106 HA ALA 106 0.726 -10.863 2.763 838 HB1 ALA 106 1HB ALA 106 2.202 -11.001 0.246 839 HB2 ALA 106 2HB ALA 106 0.968 -9.741 0.278 840 HB3 ALA 106 3HB ALA 106 2.227 -9.773 1.513 841 H GLU 107 H GLU 107 -0.163 -12.208 -0.423 842 HA GLU 107 HA GLU 107 -2.614 -10.869 -0.644 843 HB2 GLU 107 2HB GLU 107 -1.333 -12.107 -2.462 844 HB3 GLU 107 3HB GLU 107 -2.032 -13.585 -1.815 845 HG2 GLU 107 2HG GLU 107 -4.242 -12.036 -2.116 846 HG3 GLU 107 3HG GLU 107 -3.241 -11.489 -3.460 847 H ASN 108 H ASN 108 -1.822 -14.058 0.677 848 HA ASN 108 HA ASN 108 -4.394 -14.997 1.146 849 HB2 ASN 108 2HB ASN 108 -2.314 -16.337 1.401 850 HB3 ASN 108 3HB ASN 108 -1.964 -15.461 2.888 851 HD21 ASN 108 1HD2 ASN 108 -4.832 -17.008 1.476 852 HD22 ASN 108 2HD2 ASN 108 -5.223 -17.944 2.875 853 H MET 109 H MET 109 -2.350 -12.915 3.147 854 HA MET 109 HA MET 109 -4.221 -12.788 5.309 855 HB2 MET 109 2HB MET 109 -1.821 -12.448 5.672 856 HB3 MET 109 3HB MET 109 -1.862 -11.013 4.656 857 HG2 MET 109 2HG MET 109 -1.847 -10.344 6.950 858 HG3 MET 109 3HG MET 109 -3.422 -9.968 6.255 859 HE1 MET 109 3HE MET 109 -4.913 -9.757 7.688 860 HE2 MET 109 1HE MET 109 -5.887 -11.227 7.690 861 HE3 MET 109 2HE MET 109 -5.210 -10.617 9.200 862 H TYR 110 H TYR 110 -3.377 -10.676 2.596 863 HA TYR 110 HA TYR 110 -5.002 -8.500 3.295 864 HB2 TYR 110 2HB TYR 110 -3.183 -8.786 1.418 865 HB3 TYR 110 3HB TYR 110 -4.566 -9.227 0.424 866 HD1 TYR 110 HD1 TYR 110 -4.021 -6.617 3.048 867 HD2 TYR 110 HD2 TYR 110 -5.147 -7.480 -0.963 868 HE1 TYR 110 HE1 TYR 110 -4.505 -4.234 2.678 869 HE2 TYR 110 HE2 TYR 110 -5.633 -5.100 -1.345 870 HH TYR 110 HH TYR 110 -5.408 -2.735 1.277 871 H SER 111 H SER 111 -5.740 -11.563 1.833 872 HA SER 111 HA SER 111 -8.409 -10.706 1.042 873 HB2 SER 111 2HB SER 111 -7.575 -12.159 -0.568 874 HB3 SER 111 3HB SER 111 -6.771 -13.181 0.623 875 HG SER 111 HG SER 111 -8.537 -14.310 0.837 876 H GLN 112 H GLN 112 -6.893 -13.008 3.279 877 HA GLN 112 HA GLN 112 -9.189 -14.105 4.388 878 HB2 GLN 112 2HB GLN 112 -6.856 -14.891 4.789 879 HB3 GLN 112 3HB GLN 112 -6.612 -13.510 5.851 880 HG2 GLN 112 2HG GLN 112 -7.156 -15.044 7.414 881 HG3 GLN 112 3HG GLN 112 -8.784 -14.505 7.006 882 HE21 GLN 112 1HE2 GLN 112 -7.375 -17.128 7.875 883 HE22 GLN 112 2HE2 GLN 112 -8.104 -18.310 6.847 884 H MET 113 H MET 113 -7.716 -10.997 4.907 885 HA MET 113 HA MET 113 -9.248 -10.422 7.286 886 HB2 MET 113 2HB MET 113 -6.928 -9.391 6.138 887 HB3 MET 113 3HB MET 113 -8.111 -8.102 5.958 888 HG2 MET 113 2HG MET 113 -7.880 -9.439 8.598 889 HG3 MET 113 3HG MET 113 -6.608 -8.322 8.107 890 HE1 MET 113 3HE MET 113 -7.024 -6.081 9.761 891 HE2 MET 113 1HE MET 113 -8.572 -6.161 10.604 892 HE3 MET 113 2HE MET 113 -7.540 -7.588 10.520 893 H GLY 114 H GLY 114 -9.554 -9.962 3.856 894 HA2 GLY 114 2HA GLY 114 -11.727 -9.617 2.893 895 HA3 GLY 114 3HA GLY 114 -12.171 -8.698 4.323 896 H LEU 115 H LEU 115 -9.083 -8.180 2.832 897 HA LEU 115 HA LEU 115 -9.950 -5.487 2.076 898 HB2 LEU 115 2HB LEU 115 -7.151 -6.590 2.222 899 HB3 LEU 115 3HB LEU 115 -7.618 -4.899 2.054 900 HG LEU 115 HG LEU 115 -8.411 -6.468 4.481 901 HD11 LEU 115 1HD1 LEU 115 -5.831 -4.943 4.198 902 HD12 LEU 115 2HD1 LEU 115 -5.951 -6.700 4.118 903 HD13 LEU 115 3HD1 LEU 115 -6.397 -5.853 5.598 904 HD21 LEU 115 3HD2 LEU 115 -8.452 -3.683 3.580 905 HD22 LEU 115 1HD2 LEU 115 -7.828 -3.908 5.214 906 HD23 LEU 115 2HD2 LEU 115 -9.435 -4.501 4.796 907 H ASP 116 H ASP 116 -8.670 -8.450 0.745 908 HA ASP 116 HA ASP 116 -8.195 -7.294 -1.865 909 HB2 ASP 116 2HB ASP 116 -7.090 -9.412 -0.596 910 HB3 ASP 116 3HB ASP 116 -8.304 -10.238 -1.570 911 H THR 117 H THR 117 -9.103 -8.927 -3.707 912 HA THR 117 HA THR 117 -11.940 -9.451 -3.244 913 HB THR 117 HB THR 117 -11.359 -8.045 -5.786 914 HG1 THR 117 HG1 THR 117 -11.671 -6.000 -4.584 915 HG21 THR 117 3HG2 THR 117 -13.582 -7.851 -5.795 916 HG22 THR 117 1HG2 THR 117 -13.581 -7.092 -4.204 917 HG23 THR 117 2HG2 THR 117 -13.610 -8.850 -4.343 918 H ARG 118 H ARG 118 -12.633 -11.234 -4.264 919 HA ARG 118 HA ARG 118 -12.573 -13.164 -5.469 920 HB2 ARG 118 2HB ARG 118 -11.627 -11.064 -7.344 921 HB3 ARG 118 3HB ARG 118 -11.379 -12.735 -7.833 922 HG2 ARG 118 2HG ARG 118 -13.849 -13.081 -7.341 923 HG3 ARG 118 3HG ARG 118 -13.963 -11.321 -7.272 924 HD2 ARG 118 2HD ARG 118 -12.584 -12.478 -9.620 925 HD3 ARG 118 3HD ARG 118 -14.326 -12.733 -9.521 926 HE ARG 118 HE ARG 118 -13.704 -10.018 -9.040 927 HH11 ARG 118 1HH1 ARG 118 -13.876 -12.372 -11.598 928 HH12 ARG 118 2HH1 ARG 118 -14.205 -11.200 -12.831 929 HH21 ARG 118 1HH2 ARG 118 -14.137 -8.466 -10.654 930 HH22 ARG 118 2HH2 ARG 118 -14.352 -8.978 -12.293 931 HA PRO 119 HA PRO 119 -8.141 -13.890 -4.217 932 HB2 PRO 119 2HB PRO 119 -8.714 -15.805 -2.380 933 HB3 PRO 119 3HB PRO 119 -8.691 -14.080 -1.995 934 HG2 PRO 119 2HG PRO 119 -11.026 -15.857 -2.590 935 HG3 PRO 119 3HG PRO 119 -10.857 -14.614 -1.337 936 HD2 PRO 119 2HD PRO 119 -12.190 -14.176 -3.652 937 HD3 PRO 119 3HD PRO 119 -11.301 -12.894 -2.806 938 H SER 120 H SER 120 -7.128 -16.209 -3.962 939 HA SER 120 HA SER 120 -8.293 -17.921 -6.060 940 HB2 SER 120 2HB SER 120 -5.444 -18.318 -5.666 941 HB3 SER 120 3HB SER 120 -6.328 -17.947 -7.146 942 HG SER 120 HG SER 120 -6.081 -15.817 -6.779 943 H MET 121 H MET 121 -7.455 -20.231 -5.920 944 HA MET 121 HA MET 121 -6.883 -21.124 -3.208 945 HB2 MET 121 2HB MET 121 -9.511 -21.220 -4.344 946 HB3 MET 121 3HB MET 121 -8.912 -22.862 -4.155 947 HG2 MET 121 2HG MET 121 -8.816 -20.851 -1.932 948 HG3 MET 121 3HG MET 121 -10.216 -21.879 -2.223 949 HE1 MET 121 3HE MET 121 -8.926 -24.868 -2.919 950 HE2 MET 121 1HE MET 121 -9.220 -25.340 -1.245 951 HE3 MET 121 2HE MET 121 -10.345 -24.259 -2.067 952 H LYS 122 H LYS 122 -5.434 -22.711 -3.250 953 HA LYS 122 HA LYS 122 -5.446 -24.723 -5.318 954 HB2 LYS 122 2HB LYS 122 -3.107 -24.306 -6.014 955 HB3 LYS 122 3HB LYS 122 -4.191 -22.995 -6.461 956 HG2 LYS 122 2HG LYS 122 -3.167 -22.360 -3.918 957 HG3 LYS 122 3HG LYS 122 -1.805 -22.910 -4.897 958 HD2 LYS 122 2HD LYS 122 -3.025 -21.321 -6.682 959 HD3 LYS 122 3HD LYS 122 -3.519 -20.516 -5.190 960 HE2 LYS 122 2HE LYS 122 -0.899 -20.908 -4.684 961 HE3 LYS 122 3HE LYS 122 -0.856 -20.744 -6.439 962 HZ1 LYS 122 3HZ LYS 122 -0.641 -18.580 -5.737 963 HZ2 LYS 122 1HZ LYS 122 -1.677 -18.775 -4.414 964 HZ3 LYS 122 2HZ LYS 122 -2.313 -18.675 -5.979 965 H GLU 123 H GLU 123 -3.237 -26.065 -4.987 966 HA GLU 123 HA GLU 123 -3.410 -27.051 -2.303 967 HB2 GLU 123 2HB GLU 123 -1.555 -27.809 -4.567 968 HB3 GLU 123 3HB GLU 123 -1.697 -28.681 -3.047 969 HG2 GLU 123 2HG GLU 123 -4.144 -28.238 -4.678 970 HG3 GLU 123 3HG GLU 123 -2.984 -29.463 -5.190 971 H ALA 124 H ALA 124 -1.256 -27.605 -1.158 972 HA ALA 124 HA ALA 124 0.969 -25.885 -1.470 973 HB1 ALA 124 1HB ALA 124 -0.180 -25.100 1.081 974 HB2 ALA 124 2HB ALA 124 0.521 -24.109 -0.198 975 HB3 ALA 124 3HB ALA 124 -1.169 -24.603 -0.291 976 H GLY 125 H GLY 125 2.681 -26.752 -0.449 977 HA2 GLY 125 2HA GLY 125 2.332 -28.285 1.994 978 HA3 GLY 125 3HA GLY 125 2.840 -29.214 0.591 979 H GLY 126 H GLY 126 3.741 -26.661 2.827 980 HA2 GLY 126 2HA GLY 126 6.178 -27.061 3.523 981 HA3 GLY 126 3HA GLY 126 6.506 -26.794 1.817 982 H LYS 127 H LYS 127 5.859 -25.337 4.858 983 HA LYS 127 HA LYS 127 6.193 -22.684 3.627 984 HB2 LYS 127 2HB LYS 127 4.110 -23.642 5.494 985 HB3 LYS 127 3HB LYS 127 4.809 -22.073 5.873 986 HG2 LYS 127 2HG LYS 127 3.988 -21.091 3.963 987 HG3 LYS 127 3HG LYS 127 3.873 -22.625 3.097 988 HD2 LYS 127 2HD LYS 127 1.652 -22.074 3.563 989 HD3 LYS 127 3HD LYS 127 2.073 -23.236 4.824 990 HE2 LYS 127 2HE LYS 127 2.610 -21.278 6.303 991 HE3 LYS 127 3HE LYS 127 1.919 -20.236 5.060 992 HZ1 LYS 127 3HZ LYS 127 0.383 -20.895 6.911 993 HZ2 LYS 127 1HZ LYS 127 0.416 -22.470 6.295 994 HZ3 LYS 127 2HZ LYS 127 -0.193 -21.206 5.351 995 H GLU 128 H GLU 128 7.827 -21.526 4.426 996 HA GLU 128 HA GLU 128 8.650 -21.689 7.164 997 HB2 GLU 128 2HB GLU 128 10.964 -22.451 6.690 998 HB3 GLU 128 3HB GLU 128 9.755 -23.695 6.403 999 HG2 GLU 128 2HG GLU 128 10.072 -22.355 3.965 1000 HG3 GLU 128 3HG GLU 128 11.696 -22.595 4.608 1001 H GLU 129 H GLU 129 9.787 -19.907 7.783 1002 HA GLU 129 HA GLU 129 11.105 -18.227 5.834 1003 HB2 GLU 129 2HB GLU 129 9.744 -16.208 6.595 1004 HB3 GLU 129 3HB GLU 129 8.959 -17.323 5.485 1005 HG2 GLU 129 2HG GLU 129 7.458 -18.033 7.030 1006 HG3 GLU 129 3HG GLU 129 8.562 -17.785 8.382 1007 H GLY 130 H GLY 130 12.398 -16.571 6.789 1008 HA2 GLY 130 2HA GLY 130 13.169 -15.387 8.752 1009 HA3 GLY 130 3HA GLY 130 12.688 -16.776 9.716 1010 HA PRO 131 HA PRO 131 16.747 -18.025 7.376 1011 HB2 PRO 131 2HB PRO 131 18.109 -15.995 6.195 1012 HB3 PRO 131 3HB PRO 131 16.888 -16.953 5.349 1013 HG2 PRO 131 2HG PRO 131 16.636 -14.251 6.613 1014 HG3 PRO 131 3HG PRO 131 16.007 -14.821 5.056 1015 HD2 PRO 131 2HD PRO 131 14.459 -14.626 7.269 1016 HD3 PRO 131 3HD PRO 131 14.198 -15.868 6.027 1017 HA PRO 132 HA PRO 132 19.459 -16.863 10.636 1018 HB2 PRO 132 2HB PRO 132 21.913 -17.334 9.573 1019 HB3 PRO 132 3HB PRO 132 20.801 -18.629 10.033 1020 HG2 PRO 132 2HG PRO 132 21.339 -17.467 7.327 1021 HG3 PRO 132 3HG PRO 132 21.145 -19.166 7.797 1022 HD2 PRO 132 2HD PRO 132 19.155 -17.737 6.643 1023 HD3 PRO 132 3HD PRO 132 18.844 -19.026 7.823 1024 H GLN 133 H GLN 133 19.551 -14.767 11.190 1025 HA GLN 133 HA GLN 133 20.209 -12.592 11.286 1026 HB2 GLN 133 2HB GLN 133 22.472 -14.010 10.662 1027 HB3 GLN 133 3HB GLN 133 22.420 -12.820 9.368 1028 HG2 GLN 133 2HG GLN 133 23.632 -11.674 10.910 1029 HG3 GLN 133 3HG GLN 133 22.008 -11.157 11.360 1030 HE21 GLN 133 1HE2 GLN 133 24.317 -11.171 13.031 1031 HE22 GLN 133 2HE2 GLN 133 23.995 -12.243 14.346 1032 H ALA 134 H ALA 134 20.771 -10.629 9.818 1033 HA ALA 134 HA ALA 134 19.393 -10.915 7.232 1034 HB1 ALA 134 1HB ALA 134 18.940 -8.309 8.338 1035 HB2 ALA 134 2HB ALA 134 17.769 -9.527 7.833 1036 HB3 ALA 134 3HB ALA 134 18.407 -9.547 9.476 1037 H TYR 135 H TYR 135 20.113 -9.597 5.565 1038 HA TYR 135 HA TYR 135 22.795 -8.522 5.948 1039 HB2 TYR 135 2HB TYR 135 21.524 -9.910 3.862 1040 HB3 TYR 135 3HB TYR 135 21.796 -8.283 3.248 1041 HD1 TYR 135 HD1 TYR 135 23.458 -11.274 4.640 1042 HD2 TYR 135 HD2 TYR 135 23.984 -7.525 2.697 1043 HE1 TYR 135 HE1 TYR 135 25.807 -11.846 4.186 1044 HE2 TYR 135 HE2 TYR 135 26.334 -8.087 2.237 1045 HH TYR 135 HH TYR 135 27.581 -11.216 2.596 Start of MODEL 16 1 H21 MYR 1 1H2 MYR 1 3.953 12.011 -6.418 2 H22 MYR 1 2H2 MYR 1 2.212 11.884 -6.267 3 H31 MYR 1 1H3 MYR 1 3.519 11.947 -3.574 4 H32 MYR 1 2H3 MYR 1 4.214 10.675 -4.580 5 H41 MYR 1 1H4 MYR 1 1.162 10.953 -4.473 6 H42 MYR 1 2H4 MYR 1 1.992 10.236 -3.090 7 H51 MYR 1 1H5 MYR 1 3.008 9.091 -5.644 8 H52 MYR 1 2H5 MYR 1 1.253 8.932 -5.538 9 H61 MYR 1 1H6 MYR 1 1.860 6.979 -4.399 10 H62 MYR 1 2H6 MYR 1 1.779 8.080 -3.022 11 H71 MYR 1 1H7 MYR 1 4.222 8.402 -3.009 12 H72 MYR 1 2H7 MYR 1 4.405 7.615 -4.578 13 H81 MYR 1 1H8 MYR 1 5.069 6.093 -2.686 14 H82 MYR 1 2H8 MYR 1 3.749 5.413 -3.640 15 H91 MYR 1 1H9 MYR 1 2.680 7.093 -1.437 16 H92 MYR 1 2H9 MYR 1 3.789 5.878 -0.800 17 H101 MYR 1 1H10 MYR 1 1.608 5.098 -2.819 18 H102 MYR 1 2H10 MYR 1 1.203 5.257 -1.117 19 H111 MYR 1 1H11 MYR 1 2.951 3.494 -0.550 20 H112 MYR 1 2H11 MYR 1 3.403 3.411 -2.246 21 H121 MYR 1 1H12 MYR 1 1.915 1.686 -2.429 22 H122 MYR 1 2H12 MYR 1 0.657 2.922 -2.451 23 H131 MYR 1 1H13 MYR 1 -0.142 2.315 -0.375 24 H132 MYR 1 2H13 MYR 1 1.469 2.320 0.345 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 1.956 14.078 -7.048 29 HA2 GLY 2 2HA GLY 2 2.659 16.126 -5.051 30 HA3 GLY 2 3HA GLY 2 3.034 16.394 -6.747 31 H ASN 3 H ASN 3 0.133 14.807 -5.546 32 HA ASN 3 HA ASN 3 -2.075 15.296 -5.791 33 HB2 ASN 3 2HB ASN 3 -1.341 17.137 -4.210 34 HB3 ASN 3 3HB ASN 3 -1.251 18.196 -5.614 35 HD21 ASN 3 1HD2 ASN 3 -2.854 19.548 -4.844 36 HD22 ASN 3 2HD2 ASN 3 -4.519 19.086 -4.811 37 H GLY 4 H GLY 4 -1.297 14.591 -8.113 38 HA2 GLY 4 2HA GLY 4 -2.904 15.659 -10.010 39 HA3 GLY 4 3HA GLY 4 -1.471 16.673 -10.111 40 H ALA 5 H ALA 5 -2.885 13.659 -10.918 41 HA ALA 5 HA ALA 5 -2.190 11.884 -12.165 42 HB1 ALA 5 1HB ALA 5 -0.340 12.501 -13.868 43 HB2 ALA 5 2HB ALA 5 -1.912 13.293 -13.984 44 HB3 ALA 5 3HB ALA 5 -0.550 14.140 -13.250 45 H SER 6 H SER 6 -1.408 10.605 -10.478 46 HA SER 6 HA SER 6 1.423 10.817 -9.790 47 HB2 SER 6 2HB SER 6 -0.779 9.083 -8.643 48 HB3 SER 6 3HB SER 6 0.884 9.116 -8.058 49 HG SER 6 HG SER 6 -0.662 11.471 -8.227 50 H ARG 7 H ARG 7 2.553 9.986 -11.492 51 HA ARG 7 HA ARG 7 1.840 7.735 -13.005 52 HB2 ARG 7 2HB ARG 7 3.715 9.606 -13.301 53 HB3 ARG 7 3HB ARG 7 4.723 8.352 -12.593 54 HG2 ARG 7 2HG ARG 7 4.718 7.125 -14.461 55 HG3 ARG 7 3HG ARG 7 3.002 7.411 -14.760 56 HD2 ARG 7 2HD ARG 7 4.287 8.384 -16.547 57 HD3 ARG 7 3HD ARG 7 3.569 9.675 -15.584 58 HE ARG 7 HE ARG 7 6.081 9.263 -14.535 59 HH11 ARG 7 1HH1 ARG 7 4.742 10.157 -17.622 60 HH12 ARG 7 2HH1 ARG 7 6.113 11.109 -18.088 61 HH21 ARG 7 1HH2 ARG 7 7.892 10.513 -15.137 62 HH22 ARG 7 2HH2 ARG 7 7.904 11.310 -16.674 63 H ASP 8 H ASP 8 4.172 8.022 -10.326 64 HA ASP 8 HA ASP 8 4.967 5.380 -10.167 65 HB2 ASP 8 2HB ASP 8 4.760 7.597 -8.170 66 HB3 ASP 8 3HB ASP 8 5.142 5.974 -7.602 67 H TRP 9 H TRP 9 2.045 6.899 -8.956 68 HA TRP 9 HA TRP 9 1.189 4.668 -7.397 69 HB2 TRP 9 2HB TRP 9 0.379 6.927 -6.925 70 HB3 TRP 9 3HB TRP 9 -0.383 7.001 -8.511 71 HD1 TRP 9 HD1 TRP 9 -2.689 5.730 -8.829 72 HE1 TRP 9 HE1 TRP 9 -4.364 4.715 -7.160 73 HE3 TRP 9 HE3 TRP 9 0.254 5.693 -4.649 74 HZ2 TRP 9 HZ2 TRP 9 -4.430 3.994 -4.431 75 HZ3 TRP 9 HZ3 TRP 9 -0.691 4.825 -2.549 76 HH2 TRP 9 HH2 TRP 9 -2.985 3.994 -2.445 77 H LYS 10 H LYS 10 -0.053 6.007 -10.465 78 HA LYS 10 HA LYS 10 -1.833 3.995 -11.093 79 HB2 LYS 10 2HB LYS 10 -0.210 5.879 -12.768 80 HB3 LYS 10 3HB LYS 10 -1.195 4.646 -13.545 81 HG2 LYS 10 2HG LYS 10 -2.343 6.543 -11.525 82 HG3 LYS 10 3HG LYS 10 -2.218 6.957 -13.236 83 HD2 LYS 10 2HD LYS 10 -3.363 4.541 -13.448 84 HD3 LYS 10 3HD LYS 10 -3.990 5.022 -11.869 85 HE2 LYS 10 2HE LYS 10 -5.599 6.005 -13.105 86 HE3 LYS 10 3HE LYS 10 -4.404 7.292 -13.260 87 HZ1 LYS 10 3HZ LYS 10 -4.237 6.925 -15.430 88 HZ2 LYS 10 1HZ LYS 10 -5.587 5.913 -15.308 89 HZ3 LYS 10 2HZ LYS 10 -4.029 5.259 -15.223 90 H MET 11 H MET 11 1.645 4.031 -11.392 91 HA MET 11 HA MET 11 1.846 1.744 -13.081 92 HB2 MET 11 2HB MET 11 3.801 3.207 -11.322 93 HB3 MET 11 3HB MET 11 4.253 1.739 -12.178 94 HG2 MET 11 2HG MET 11 2.961 3.767 -13.846 95 HG3 MET 11 3HG MET 11 4.505 4.257 -13.153 96 HE1 MET 11 3HE MET 11 5.979 4.165 -15.827 97 HE2 MET 11 1HE MET 11 4.942 3.260 -16.931 98 HE3 MET 11 2HE MET 11 4.242 4.473 -15.858 99 H ALA 12 H ALA 12 2.374 2.219 -9.588 100 HA ALA 12 HA ALA 12 2.951 -0.392 -8.884 101 HB1 ALA 12 1HB ALA 12 3.262 1.216 -7.221 102 HB2 ALA 12 2HB ALA 12 1.620 1.838 -7.385 103 HB3 ALA 12 3HB ALA 12 1.895 0.263 -6.641 104 H ILE 13 H ILE 13 -0.140 1.083 -9.596 105 HA ILE 13 HA ILE 13 -1.735 -1.052 -8.569 106 HB ILE 13 HB ILE 13 -2.450 1.086 -10.578 107 HG12 ILE 13 2HG1 ILE 13 -1.746 1.954 -8.367 108 HG13 ILE 13 3HG1 ILE 13 -3.448 2.260 -8.694 109 HG21 ILE 13 1HG2 ILE 13 -4.376 0.021 -10.850 110 HG22 ILE 13 2HG2 ILE 13 -3.866 -1.237 -9.725 111 HG23 ILE 13 3HG2 ILE 13 -4.700 0.197 -9.125 112 HD11 ILE 13 3HD1 ILE 13 -2.988 1.539 -6.379 113 HD12 ILE 13 1HD1 ILE 13 -4.102 0.475 -7.237 114 HD13 ILE 13 2HD1 ILE 13 -2.421 -0.007 -7.008 115 H LYS 14 H LYS 14 -0.885 -0.043 -11.881 116 HA LYS 14 HA LYS 14 -2.118 -2.074 -13.284 117 HB2 LYS 14 2HB LYS 14 -0.955 -0.063 -14.246 118 HB3 LYS 14 3HB LYS 14 0.573 -0.891 -13.979 119 HG2 LYS 14 2HG LYS 14 -0.721 -2.785 -15.366 120 HG3 LYS 14 3HG LYS 14 -1.498 -1.344 -16.026 121 HD2 LYS 14 2HD LYS 14 0.273 -1.408 -17.437 122 HD3 LYS 14 3HD LYS 14 1.059 -0.544 -16.114 123 HE2 LYS 14 2HE LYS 14 2.604 -2.168 -16.291 124 HE3 LYS 14 3HE LYS 14 1.451 -3.111 -15.348 125 HZ1 LYS 14 3HZ LYS 14 0.995 -4.425 -17.081 126 HZ2 LYS 14 1HZ LYS 14 2.448 -3.851 -17.731 127 HZ3 LYS 14 2HZ LYS 14 0.979 -3.152 -18.195 128 H ARG 15 H ARG 15 0.833 -2.158 -11.428 129 HA ARG 15 HA ARG 15 1.744 -4.669 -12.470 130 HB2 ARG 15 2HB ARG 15 2.554 -3.397 -9.857 131 HB3 ARG 15 3HB ARG 15 3.469 -4.546 -10.823 132 HG2 ARG 15 2HG ARG 15 2.940 -2.331 -12.480 133 HG3 ARG 15 3HG ARG 15 3.482 -1.698 -10.925 134 HD2 ARG 15 2HD ARG 15 5.544 -2.723 -11.077 135 HD3 ARG 15 3HD ARG 15 4.961 -3.962 -12.187 136 HE ARG 15 HE ARG 15 4.906 -1.321 -13.306 137 HH11 ARG 15 1HH1 ARG 15 6.887 -4.121 -12.707 138 HH12 ARG 15 2HH1 ARG 15 7.982 -3.786 -14.007 139 HH21 ARG 15 1HH2 ARG 15 6.341 -0.870 -15.020 140 HH22 ARG 15 2HH2 ARG 15 7.671 -1.936 -15.322 141 H CYS 16 H CYS 16 0.288 -3.656 -9.380 142 HA CYS 16 HA CYS 16 0.097 -6.228 -8.270 143 HB2 CYS 16 2HB CYS 16 -0.162 -3.973 -7.095 144 HB3 CYS 16 3HB CYS 16 -1.819 -3.973 -7.688 145 HG CYS 16 HG CYS 16 -0.452 -6.281 -5.561 146 H SER 17 H SER 17 -1.679 -4.731 -10.764 147 HA SER 17 HA SER 17 -4.201 -5.886 -10.508 148 HB2 SER 17 2HB SER 17 -3.298 -4.144 -12.226 149 HB3 SER 17 3HB SER 17 -2.908 -5.561 -13.200 150 HG SER 17 HG SER 17 -4.989 -5.964 -13.485 151 H ASN 18 H ASN 18 -1.176 -7.299 -11.369 152 HA ASN 18 HA ASN 18 -2.451 -9.706 -12.430 153 HB2 ASN 18 2HB ASN 18 -0.080 -8.394 -13.060 154 HB3 ASN 18 3HB ASN 18 0.446 -9.818 -12.168 155 HD21 ASN 18 1HD2 ASN 18 -0.288 -11.898 -12.922 156 HD22 ASN 18 2HD2 ASN 18 -0.610 -12.128 -14.604 157 H VAL 19 H VAL 19 -2.758 -9.006 -9.637 158 HA VAL 19 HA VAL 19 -1.250 -11.189 -8.354 159 HB VAL 19 HB VAL 19 -2.554 -8.783 -7.073 160 HG11 VAL 19 1HG1 VAL 19 -2.671 -10.166 -5.303 161 HG12 VAL 19 2HG1 VAL 19 -1.512 -11.307 -5.986 162 HG13 VAL 19 3HG1 VAL 19 -0.942 -9.847 -5.176 163 HG21 VAL 19 3HG2 VAL 19 -0.308 -8.030 -6.603 164 HG22 VAL 19 1HG2 VAL 19 0.367 -9.480 -7.345 165 HG23 VAL 19 2HG2 VAL 19 -0.484 -8.296 -8.337 166 H ALA 20 H ALA 20 -2.323 -12.725 -7.147 167 HA ALA 20 HA ALA 20 -5.152 -13.026 -7.755 168 HB1 ALA 20 1HB ALA 20 -3.681 -15.027 -6.123 169 HB2 ALA 20 2HB ALA 20 -4.892 -15.263 -7.384 170 HB3 ALA 20 3HB ALA 20 -3.236 -14.843 -7.820 171 H VAL 21 H VAL 21 -6.774 -12.755 -6.346 172 HA VAL 21 HA VAL 21 -6.429 -11.383 -3.939 173 HB VAL 21 HB VAL 21 -8.790 -13.081 -4.759 174 HG11 VAL 21 1HG1 VAL 21 -8.278 -11.257 -2.490 175 HG12 VAL 21 2HG1 VAL 21 -9.850 -11.117 -3.280 176 HG13 VAL 21 3HG1 VAL 21 -9.337 -12.663 -2.601 177 HG21 VAL 21 3HG2 VAL 21 -9.220 -11.547 -6.306 178 HG22 VAL 21 1HG2 VAL 21 -9.265 -10.302 -5.058 179 HG23 VAL 21 2HG2 VAL 21 -7.747 -10.681 -5.871 180 H GLY 22 H GLY 22 -6.319 -14.773 -4.643 181 HA2 GLY 22 2HA GLY 22 -5.562 -15.310 -1.884 182 HA3 GLY 22 3HA GLY 22 -6.996 -16.146 -2.461 183 H VAL 23 H VAL 23 -5.014 -17.704 -1.612 184 HA VAL 23 HA VAL 23 -3.308 -18.447 -3.846 185 HB VAL 23 HB VAL 23 -2.371 -18.477 -1.577 186 HG11 VAL 23 1HG1 VAL 23 -3.319 -19.491 0.181 187 HG12 VAL 23 2HG1 VAL 23 -4.778 -19.521 -0.812 188 HG13 VAL 23 3HG1 VAL 23 -3.723 -20.934 -0.749 189 HG21 VAL 23 3HG2 VAL 23 -2.582 -21.172 -2.914 190 HG22 VAL 23 1HG2 VAL 23 -1.364 -19.930 -3.205 191 HG23 VAL 23 2HG2 VAL 23 -1.413 -20.771 -1.656 192 H GLY 24 H GLY 24 -6.221 -19.518 -2.258 193 HA2 GLY 24 2HA GLY 24 -6.425 -21.686 -4.250 194 HA3 GLY 24 3HA GLY 24 -6.838 -21.969 -2.566 195 H GLY 25 H GLY 25 -8.234 -19.682 -1.932 196 HA2 GLY 25 2HA GLY 25 -10.731 -20.213 -3.298 197 HA3 GLY 25 3HA GLY 25 -10.504 -19.170 -1.902 198 H LYS 26 H LYS 26 -12.002 -18.725 -4.401 199 HA LYS 26 HA LYS 26 -12.383 -17.085 -5.933 200 HB2 LYS 26 2HB LYS 26 -11.114 -15.775 -3.623 201 HB3 LYS 26 3HB LYS 26 -11.031 -14.854 -5.119 202 HG2 LYS 26 2HG LYS 26 -13.614 -16.007 -4.129 203 HG3 LYS 26 3HG LYS 26 -13.015 -14.443 -3.570 204 HD2 LYS 26 2HD LYS 26 -12.781 -14.451 -6.381 205 HD3 LYS 26 3HD LYS 26 -14.382 -15.090 -6.001 206 HE2 LYS 26 2HE LYS 26 -13.421 -12.649 -4.584 207 HE3 LYS 26 3HE LYS 26 -13.976 -12.504 -6.251 208 HZ1 LYS 26 3HZ LYS 26 -15.781 -12.099 -4.723 209 HZ2 LYS 26 1HZ LYS 26 -15.543 -13.600 -3.979 210 HZ3 LYS 26 2HZ LYS 26 -16.077 -13.526 -5.581 211 H SER 27 H SER 27 -11.219 -18.140 -7.600 212 HA SER 27 HA SER 27 -8.431 -17.515 -8.015 213 HB2 SER 27 2HB SER 27 -8.589 -18.937 -9.969 214 HB3 SER 27 3HB SER 27 -9.418 -19.727 -8.628 215 HG SER 27 HG SER 27 -11.023 -19.830 -9.980 216 H LYS 28 H LYS 28 -9.211 -15.127 -7.936 217 HA LYS 28 HA LYS 28 -9.411 -14.228 -10.719 218 HB2 LYS 28 2HB LYS 28 -11.570 -14.093 -9.034 219 HB3 LYS 28 3HB LYS 28 -10.835 -12.511 -8.808 220 HG2 LYS 28 2HG LYS 28 -11.508 -11.793 -10.807 221 HG3 LYS 28 3HG LYS 28 -11.026 -13.291 -11.607 222 HD2 LYS 28 2HD LYS 28 -13.125 -14.288 -10.456 223 HD3 LYS 28 3HD LYS 28 -13.620 -12.604 -10.277 224 HE2 LYS 28 2HE LYS 28 -13.428 -12.286 -12.689 225 HE3 LYS 28 3HE LYS 28 -12.901 -13.958 -12.876 226 HZ1 LYS 28 3HZ LYS 28 -15.567 -12.964 -12.065 227 HZ2 LYS 28 1HZ LYS 28 -15.093 -14.567 -11.807 228 HZ3 LYS 28 2HZ LYS 28 -15.173 -13.951 -13.380 229 H LYS 29 H LYS 29 -8.588 -12.089 -11.087 230 HA LYS 29 HA LYS 29 -6.444 -11.420 -9.223 231 HB2 LYS 29 2HB LYS 29 -7.032 -10.460 -12.029 232 HB3 LYS 29 3HB LYS 29 -5.652 -9.942 -11.069 233 HG2 LYS 29 2HG LYS 29 -4.606 -11.996 -11.219 234 HG3 LYS 29 3HG LYS 29 -6.108 -12.848 -11.585 235 HD2 LYS 29 2HD LYS 29 -6.154 -11.585 -13.768 236 HD3 LYS 29 3HD LYS 29 -4.516 -11.042 -13.397 237 HE2 LYS 29 2HE LYS 29 -4.182 -13.661 -13.014 238 HE3 LYS 29 3HE LYS 29 -5.506 -13.725 -14.176 239 HZ1 LYS 29 3HZ LYS 29 -3.528 -11.869 -15.005 240 HZ2 LYS 29 1HZ LYS 29 -4.118 -13.234 -15.813 241 HZ3 LYS 29 2HZ LYS 29 -2.829 -13.384 -14.728 242 H PHE 30 H PHE 30 -6.116 -9.329 -8.402 243 HA PHE 30 HA PHE 30 -8.547 -7.913 -7.807 244 HB2 PHE 30 2HB PHE 30 -5.756 -7.890 -6.852 245 HB3 PHE 30 3HB PHE 30 -6.579 -6.335 -6.786 246 HD1 PHE 30 HD2 PHE 30 -9.212 -6.783 -5.971 247 HD2 PHE 30 HD1 PHE 30 -5.729 -8.947 -4.828 248 HE1 PHE 30 HE2 PHE 30 -10.322 -7.460 -3.882 249 HE2 PHE 30 HE1 PHE 30 -6.834 -9.628 -2.737 250 HZ PHE 30 HZ PHE 30 -9.133 -8.883 -2.262 251 H GLY 31 H GLY 31 -8.188 -5.344 -7.777 252 HA2 GLY 31 2HA GLY 31 -6.960 -4.415 -10.251 253 HA3 GLY 31 3HA GLY 31 -8.709 -4.275 -10.157 254 H GLU 32 H GLU 32 -7.439 -1.992 -10.550 255 HA GLU 32 HA GLU 32 -6.432 -0.603 -8.355 256 HB2 GLU 32 2HB GLU 32 -6.412 0.131 -10.772 257 HB3 GLU 32 3HB GLU 32 -8.089 0.616 -10.565 258 HG2 GLU 32 2HG GLU 32 -7.558 2.389 -9.218 259 HG3 GLU 32 3HG GLU 32 -6.048 1.662 -8.671 260 H GLY 33 H GLY 33 -9.778 -0.825 -9.543 261 HA2 GLY 33 2HA GLY 33 -10.988 0.894 -7.723 262 HA3 GLY 33 3HA GLY 33 -11.781 -0.482 -8.476 263 H ASN 34 H ASN 34 -10.192 -2.535 -7.362 264 HA ASN 34 HA ASN 34 -11.522 -2.944 -4.919 265 HB2 ASN 34 2HB ASN 34 -9.210 -4.329 -6.262 266 HB3 ASN 34 3HB ASN 34 -9.787 -4.837 -4.677 267 HD21 ASN 34 1HD2 ASN 34 -10.360 -4.835 -8.054 268 HD22 ASN 34 2HD2 ASN 34 -11.785 -5.812 -8.039 269 H PHE 35 H PHE 35 -8.117 -2.164 -5.598 270 HA PHE 35 HA PHE 35 -7.232 -2.063 -2.952 271 HB2 PHE 35 2HB PHE 35 -6.200 -0.336 -5.206 272 HB3 PHE 35 3HB PHE 35 -5.319 -0.868 -3.778 273 HD1 PHE 35 HD1 PHE 35 -5.963 -3.707 -3.653 274 HD2 PHE 35 HD2 PHE 35 -5.094 -1.247 -7.016 275 HE1 PHE 35 HE1 PHE 35 -5.158 -5.680 -4.884 276 HE2 PHE 35 HE2 PHE 35 -4.289 -3.215 -8.253 277 HZ PHE 35 HZ PHE 35 -4.320 -5.436 -7.188 278 H ARG 36 H ARG 36 -8.805 0.367 -4.948 279 HA ARG 36 HA ARG 36 -8.388 2.594 -3.293 280 HB2 ARG 36 2HB ARG 36 -10.736 2.028 -5.112 281 HB3 ARG 36 3HB ARG 36 -10.284 3.603 -4.474 282 HG2 ARG 36 2HG ARG 36 -8.049 2.402 -5.815 283 HG3 ARG 36 3HG ARG 36 -9.462 2.427 -6.872 284 HD2 ARG 36 2HD ARG 36 -8.852 4.883 -5.321 285 HD3 ARG 36 3HD ARG 36 -7.794 4.488 -6.675 286 HE ARG 36 HE ARG 36 -10.439 4.287 -7.550 287 HH11 ARG 36 1HH1 ARG 36 -8.196 6.712 -6.451 288 HH12 ARG 36 2HH1 ARG 36 -8.919 7.986 -7.375 289 HH21 ARG 36 1HH2 ARG 36 -11.400 5.957 -8.771 290 HH22 ARG 36 2HH2 ARG 36 -10.742 7.556 -8.694 291 H TRP 37 H TRP 37 -11.146 0.350 -3.468 292 HA TRP 37 HA TRP 37 -12.693 1.495 -1.454 293 HB2 TRP 37 2HB TRP 37 -13.648 -0.177 -2.891 294 HB3 TRP 37 3HB TRP 37 -12.471 -1.377 -2.366 295 HD1 TRP 37 HD1 TRP 37 -15.780 0.185 -1.393 296 HE1 TRP 37 HE1 TRP 37 -16.738 -1.061 0.644 297 HE3 TRP 37 HE3 TRP 37 -11.715 -2.679 -0.209 298 HZ2 TRP 37 HZ2 TRP 37 -15.883 -3.002 2.508 299 HZ3 TRP 37 HZ3 TRP 37 -11.867 -4.204 1.716 300 HH2 TRP 37 HH2 TRP 37 -13.909 -4.360 3.045 301 H ALA 38 H ALA 38 -10.124 -0.929 -1.252 302 HA ALA 38 HA ALA 38 -10.407 -1.406 1.535 303 HB1 ALA 38 1HB ALA 38 -7.983 -2.280 1.219 304 HB2 ALA 38 2HB ALA 38 -9.320 -3.123 0.435 305 HB3 ALA 38 3HB ALA 38 -8.304 -2.023 -0.497 306 H ILE 39 H ILE 39 -7.825 0.306 -0.242 307 HA ILE 39 HA ILE 39 -6.501 1.386 1.923 308 HB ILE 39 HB ILE 39 -6.893 2.678 -0.779 309 HG12 ILE 39 2HG1 ILE 39 -4.498 1.094 0.120 310 HG13 ILE 39 3HG1 ILE 39 -5.895 0.297 -0.595 311 HG21 ILE 39 1HG2 ILE 39 -6.076 4.340 0.693 312 HG22 ILE 39 2HG2 ILE 39 -4.947 3.217 1.449 313 HG23 ILE 39 3HG2 ILE 39 -4.679 3.753 -0.209 314 HD11 ILE 39 3HD1 ILE 39 -4.565 0.597 -2.427 315 HD12 ILE 39 1HD1 ILE 39 -5.548 2.060 -2.491 316 HD13 ILE 39 2HD1 ILE 39 -3.910 2.125 -1.840 317 H ARG 40 H ARG 40 -9.018 3.002 -0.024 318 HA ARG 40 HA ARG 40 -9.226 5.343 1.423 319 HB2 ARG 40 2HB ARG 40 -10.376 4.920 -0.720 320 HB3 ARG 40 3HB ARG 40 -11.482 3.826 0.100 321 HG2 ARG 40 2HG ARG 40 -12.552 5.553 1.228 322 HG3 ARG 40 3HG ARG 40 -11.213 6.674 0.975 323 HD2 ARG 40 2HD ARG 40 -12.399 5.663 -1.499 324 HD3 ARG 40 3HD ARG 40 -13.518 6.589 -0.499 325 HE ARG 40 HE ARG 40 -11.310 7.605 -1.996 326 HH11 ARG 40 1HH1 ARG 40 -13.232 8.100 0.864 327 HH12 ARG 40 2HH1 ARG 40 -12.914 9.801 0.942 328 HH21 ARG 40 1HH2 ARG 40 -10.884 9.844 -1.904 329 HH22 ARG 40 2HH2 ARG 40 -11.579 10.793 -0.634 330 H MET 41 H MET 41 -10.975 2.292 1.945 331 HA MET 41 HA MET 41 -12.616 3.049 4.031 332 HB2 MET 41 2HB MET 41 -11.415 0.496 3.129 333 HB3 MET 41 3HB MET 41 -12.029 0.525 4.777 334 HG2 MET 41 2HG MET 41 -13.809 1.626 2.701 335 HG3 MET 41 3HG MET 41 -13.517 -0.111 2.647 336 HE1 MET 41 3HE MET 41 -16.081 0.373 2.662 337 HE2 MET 41 1HE MET 41 -16.980 -0.028 4.126 338 HE3 MET 41 2HE MET 41 -16.622 1.657 3.746 339 H ALA 42 H ALA 42 -9.233 2.020 4.144 340 HA ALA 42 HA ALA 42 -9.041 2.079 6.987 341 HB1 ALA 42 1HB ALA 42 -7.267 0.873 6.386 342 HB2 ALA 42 2HB ALA 42 -7.285 1.521 4.745 343 HB3 ALA 42 3HB ALA 42 -6.469 2.406 6.033 344 H ASN 43 H ASN 43 -8.212 4.364 4.411 345 HA ASN 43 HA ASN 43 -6.919 6.297 5.933 346 HB2 ASN 43 2HB ASN 43 -7.769 6.055 3.290 347 HB3 ASN 43 3HB ASN 43 -8.617 7.478 3.889 348 HD21 ASN 43 1HD2 ASN 43 -7.579 9.310 3.654 349 HD22 ASN 43 2HD2 ASN 43 -5.865 9.511 3.569 350 H VAL 44 H VAL 44 -10.314 5.567 5.625 351 HA VAL 44 HA VAL 44 -11.197 8.007 6.881 352 HB VAL 44 HB VAL 44 -12.752 5.464 6.383 353 HG11 VAL 44 1HG1 VAL 44 -13.753 6.936 8.066 354 HG12 VAL 44 2HG1 VAL 44 -13.698 8.278 6.922 355 HG13 VAL 44 3HG1 VAL 44 -14.722 6.880 6.593 356 HG21 VAL 44 3HG2 VAL 44 -11.752 7.425 4.555 357 HG22 VAL 44 1HG2 VAL 44 -12.710 5.981 4.224 358 HG23 VAL 44 2HG2 VAL 44 -13.513 7.506 4.597 359 H SER 45 H SER 45 -11.478 4.574 7.825 360 HA SER 45 HA SER 45 -12.283 4.965 10.439 361 HB2 SER 45 2HB SER 45 -12.428 2.746 9.880 362 HB3 SER 45 3HB SER 45 -10.911 2.763 8.981 363 HG SER 45 HG SER 45 -11.306 2.583 11.772 364 H THR 46 H THR 46 -9.027 4.954 9.095 365 HA THR 46 HA THR 46 -7.979 5.718 11.741 366 HB THR 46 HB THR 46 -5.842 4.871 11.120 367 HG1 THR 46 HG1 THR 46 -6.762 4.124 8.554 368 HG21 THR 46 3HG2 THR 46 -7.237 2.647 9.866 369 HG22 THR 46 1HG2 THR 46 -8.076 3.249 11.295 370 HG23 THR 46 2HG2 THR 46 -6.397 2.722 11.415 371 H GLY 47 H GLY 47 -9.232 7.690 10.292 372 HA2 GLY 47 2HA GLY 47 -7.240 9.680 10.155 373 HA3 GLY 47 3HA GLY 47 -7.632 9.156 8.523 374 H ARG 48 H ARG 48 -10.114 9.018 8.148 375 HA ARG 48 HA ARG 48 -12.084 10.129 7.909 376 HB2 ARG 48 2HB ARG 48 -12.102 9.728 10.428 377 HB3 ARG 48 3HB ARG 48 -11.558 11.392 10.595 378 HG2 ARG 48 2HG ARG 48 -13.572 12.256 10.027 379 HG3 ARG 48 3HG ARG 48 -13.954 10.931 8.925 380 HD2 ARG 48 2HD ARG 48 -14.661 9.536 10.659 381 HD3 ARG 48 3HD ARG 48 -13.841 10.498 11.889 382 HE ARG 48 HE ARG 48 -15.701 11.813 12.032 383 HH11 ARG 48 1HH1 ARG 48 -15.805 10.048 9.033 384 HH12 ARG 48 2HH1 ARG 48 -17.402 10.581 8.624 385 HH21 ARG 48 1HH2 ARG 48 -17.804 12.522 11.505 386 HH22 ARG 48 2HH2 ARG 48 -18.538 11.989 10.030 387 H GLU 49 H GLU 49 -10.022 11.262 6.595 388 HA GLU 49 HA GLU 49 -10.875 13.955 6.298 389 HB2 GLU 49 2HB GLU 49 -8.627 13.435 8.074 390 HB3 GLU 49 3HB GLU 49 -8.187 14.495 6.743 391 HG2 GLU 49 2HG GLU 49 -9.263 16.214 7.637 392 HG3 GLU 49 3HG GLU 49 -10.717 15.256 7.909 393 HA PRO 50 HA PRO 50 -9.164 13.410 2.297 394 HB2 PRO 50 2HB PRO 50 -8.384 15.927 1.644 395 HB3 PRO 50 3HB PRO 50 -10.081 15.440 1.731 396 HG2 PRO 50 2HG PRO 50 -8.423 16.900 3.752 397 HG3 PRO 50 3HG PRO 50 -10.090 17.213 3.236 398 HD2 PRO 50 2HD PRO 50 -9.496 15.905 5.532 399 HD3 PRO 50 3HD PRO 50 -10.951 15.549 4.579 400 H GLY 51 H GLY 51 -7.094 15.564 4.258 401 HA2 GLY 51 2HA GLY 51 -4.725 14.651 2.850 402 HA3 GLY 51 3HA GLY 51 -4.784 15.866 4.118 403 H ASP 52 H ASP 52 -5.259 12.368 3.653 404 HA ASP 52 HA ASP 52 -3.643 11.904 6.050 405 HB2 ASP 52 2HB ASP 52 -6.101 11.863 6.644 406 HB3 ASP 52 3HB ASP 52 -6.254 10.458 5.592 407 H ILE 53 H ILE 53 -2.763 11.637 3.462 408 HA ILE 53 HA ILE 53 -2.500 8.715 3.233 409 HB ILE 53 HB ILE 53 -2.685 10.610 0.888 410 HG12 ILE 53 2HG1 ILE 53 -4.677 8.541 1.842 411 HG13 ILE 53 3HG1 ILE 53 -4.851 10.279 2.060 412 HG21 ILE 53 1HG2 ILE 53 -2.703 8.579 -0.466 413 HG22 ILE 53 2HG2 ILE 53 -1.228 8.693 0.493 414 HG23 ILE 53 3HG2 ILE 53 -2.520 7.601 0.990 415 HD11 ILE 53 3HD1 ILE 53 -4.533 10.248 -0.572 416 HD12 ILE 53 1HD1 ILE 53 -5.189 8.624 -0.366 417 HD13 ILE 53 2HD1 ILE 53 -6.105 10.023 0.196 418 HA PRO 54 HA PRO 54 1.669 10.662 3.622 419 HB2 PRO 54 2HB PRO 54 2.665 8.713 5.228 420 HB3 PRO 54 3HB PRO 54 1.757 10.098 5.847 421 HG2 PRO 54 2HG PRO 54 0.822 7.305 5.311 422 HG3 PRO 54 3HG PRO 54 0.470 8.356 6.695 423 HD2 PRO 54 2HD PRO 54 -1.274 8.002 4.654 424 HD3 PRO 54 3HD PRO 54 -1.153 9.529 5.552 425 H GLU 55 H GLU 55 3.617 10.015 2.679 426 HA GLU 55 HA GLU 55 3.425 7.595 1.016 427 HB2 GLU 55 2HB GLU 55 5.124 8.709 -0.432 428 HB3 GLU 55 3HB GLU 55 3.596 9.573 -0.335 429 HG2 GLU 55 2HG GLU 55 5.244 10.574 1.722 430 HG3 GLU 55 3HG GLU 55 6.221 10.498 0.257 431 H THR 56 H THR 56 4.120 6.735 3.301 432 HA THR 56 HA THR 56 6.990 6.236 3.112 433 HB THR 56 HB THR 56 7.468 6.692 5.399 434 HG1 THR 56 HG1 THR 56 5.826 7.355 6.846 435 HG21 THR 56 3HG2 THR 56 7.501 8.664 3.965 436 HG22 THR 56 1HG2 THR 56 6.976 9.095 5.591 437 HG23 THR 56 2HG2 THR 56 5.792 8.949 4.292 438 H LEU 57 H LEU 57 7.461 4.151 3.431 439 HA LEU 57 HA LEU 57 5.534 2.177 3.654 440 HB2 LEU 57 2HB LEU 57 8.484 2.253 4.046 441 HB3 LEU 57 3HB LEU 57 7.607 0.803 4.530 442 HG LEU 57 HG LEU 57 8.584 0.606 2.286 443 HD11 LEU 57 1HD1 LEU 57 6.283 -0.367 3.058 444 HD12 LEU 57 2HD1 LEU 57 6.790 -0.497 1.374 445 HD13 LEU 57 3HD1 LEU 57 5.638 0.749 1.853 446 HD21 LEU 57 3HD2 LEU 57 6.648 2.755 1.448 447 HD22 LEU 57 1HD2 LEU 57 7.863 1.946 0.458 448 HD23 LEU 57 2HD2 LEU 57 8.363 3.046 1.744 449 H ASP 58 H ASP 58 7.275 3.890 6.159 450 HA ASP 58 HA ASP 58 6.639 2.180 8.316 451 HB2 ASP 58 2HB ASP 58 8.318 4.206 8.125 452 HB3 ASP 58 3HB ASP 58 6.941 5.128 8.723 453 H GLN 59 H GLN 59 5.007 4.998 6.938 454 HA GLN 59 HA GLN 59 2.967 5.150 8.899 455 HB2 GLN 59 2HB GLN 59 3.313 6.252 6.133 456 HB3 GLN 59 3HB GLN 59 1.761 6.399 6.948 457 HG2 GLN 59 2HG GLN 59 4.252 7.278 8.332 458 HG3 GLN 59 3HG GLN 59 3.507 8.310 7.113 459 HE21 GLN 59 1HE2 GLN 59 3.593 9.481 9.390 460 HE22 GLN 59 2HE2 GLN 59 2.094 9.437 10.248 461 H LEU 60 H LEU 60 2.970 3.819 5.594 462 HA LEU 60 HA LEU 60 0.360 2.843 5.592 463 HB2 LEU 60 2HB LEU 60 1.796 3.022 3.602 464 HB3 LEU 60 3HB LEU 60 2.769 1.680 4.201 465 HG LEU 60 HG LEU 60 0.295 0.554 4.144 466 HD11 LEU 60 1HD1 LEU 60 -0.951 2.191 3.105 467 HD12 LEU 60 2HD1 LEU 60 -0.440 1.204 1.736 468 HD13 LEU 60 3HD1 LEU 60 0.391 2.719 2.090 469 HD21 LEU 60 3HD2 LEU 60 1.051 -0.555 2.102 470 HD22 LEU 60 1HD2 LEU 60 2.360 -0.411 3.275 471 HD23 LEU 60 2HD2 LEU 60 2.295 0.677 1.889 472 H ARG 61 H ARG 61 3.380 1.199 6.492 473 HA ARG 61 HA ARG 61 2.296 -1.301 7.085 474 HB2 ARG 61 2HB ARG 61 4.711 -0.872 6.901 475 HB3 ARG 61 3HB ARG 61 4.657 0.067 8.387 476 HG2 ARG 61 2HG ARG 61 3.564 -2.293 9.191 477 HG3 ARG 61 3HG ARG 61 4.741 -2.827 7.988 478 HD2 ARG 61 2HD ARG 61 6.524 -2.112 9.214 479 HD3 ARG 61 3HD ARG 61 5.622 -0.790 9.955 480 HE ARG 61 HE ARG 61 5.989 -3.403 11.012 481 HH11 ARG 61 1HH1 ARG 61 3.706 -0.782 10.815 482 HH12 ARG 61 2HH1 ARG 61 2.911 -1.190 12.299 483 HH21 ARG 61 1HH2 ARG 61 4.950 -3.951 12.967 484 HH22 ARG 61 2HH2 ARG 61 3.620 -2.992 13.523 485 H LEU 62 H LEU 62 2.634 1.584 9.095 486 HA LEU 62 HA LEU 62 1.758 0.379 11.507 487 HB2 LEU 62 2HB LEU 62 2.518 2.999 10.583 488 HB3 LEU 62 3HB LEU 62 1.090 3.093 11.612 489 HG LEU 62 HG LEU 62 3.053 3.448 12.949 490 HD11 LEU 62 1HD1 LEU 62 2.452 0.657 13.712 491 HD12 LEU 62 2HD1 LEU 62 1.084 1.763 13.595 492 HD13 LEU 62 3HD1 LEU 62 2.425 2.132 14.678 493 HD21 LEU 62 3HD2 LEU 62 4.975 2.516 12.341 494 HD22 LEU 62 1HD2 LEU 62 4.148 1.385 11.270 495 HD23 LEU 62 2HD2 LEU 62 4.375 0.982 12.973 496 H VAL 63 H VAL 63 0.094 2.267 9.007 497 HA VAL 63 HA VAL 63 -2.409 2.474 10.185 498 HB VAL 63 HB VAL 63 -1.805 2.093 7.248 499 HG11 VAL 63 1HG1 VAL 63 -4.249 3.106 8.686 500 HG12 VAL 63 2HG1 VAL 63 -3.953 3.365 6.966 501 HG13 VAL 63 3HG1 VAL 63 -4.130 1.727 7.595 502 HG21 VAL 63 3HG2 VAL 63 -1.053 4.189 7.185 503 HG22 VAL 63 1HG2 VAL 63 -2.436 4.780 8.106 504 HG23 VAL 63 2HG2 VAL 63 -1.020 4.151 8.948 505 H ILE 64 H ILE 64 -1.007 -0.191 8.341 506 HA ILE 64 HA ILE 64 -3.360 -1.750 8.169 507 HB ILE 64 HB ILE 64 -0.481 -2.663 8.125 508 HG12 ILE 64 2HG1 ILE 64 -2.285 -2.239 5.750 509 HG13 ILE 64 3HG1 ILE 64 -1.296 -0.935 6.398 510 HG21 ILE 64 1HG2 ILE 64 -3.013 -4.091 7.953 511 HG22 ILE 64 2HG2 ILE 64 -1.949 -4.397 6.580 512 HG23 ILE 64 3HG2 ILE 64 -1.381 -4.704 8.221 513 HD11 ILE 64 3HD1 ILE 64 -0.206 -3.578 5.469 514 HD12 ILE 64 1HD1 ILE 64 -0.288 -2.125 4.473 515 HD13 ILE 64 2HD1 ILE 64 0.710 -2.143 5.928 516 H CYS 65 H CYS 65 -0.522 -2.102 10.305 517 HA CYS 65 HA CYS 65 -1.559 -4.142 11.900 518 HB2 CYS 65 2HB CYS 65 0.796 -3.583 11.961 519 HB3 CYS 65 3HB CYS 65 0.437 -1.975 12.578 520 HG CYS 65 HG CYS 65 0.453 -4.938 14.215 521 H ASP 66 H ASP 66 -1.989 -0.669 12.053 522 HA ASP 66 HA ASP 66 -3.198 -0.623 14.634 523 HB2 ASP 66 2HB ASP 66 -2.152 1.370 13.630 524 HB3 ASP 66 3HB ASP 66 -3.393 1.387 12.380 525 H LEU 67 H LEU 67 -4.642 -0.039 11.421 526 HA LEU 67 HA LEU 67 -7.298 -0.144 12.211 527 HB2 LEU 67 2HB LEU 67 -6.852 0.680 10.066 528 HB3 LEU 67 3HB LEU 67 -5.928 -0.752 9.614 529 HG LEU 67 HG LEU 67 -8.705 -1.372 10.209 530 HD11 LEU 67 1HD1 LEU 67 -9.094 -0.275 7.735 531 HD12 LEU 67 2HD1 LEU 67 -8.130 0.958 8.547 532 HD13 LEU 67 3HD1 LEU 67 -9.649 0.416 9.260 533 HD21 LEU 67 3HD2 LEU 67 -7.067 -1.720 7.702 534 HD22 LEU 67 1HD2 LEU 67 -8.537 -2.589 8.145 535 HD23 LEU 67 2HD2 LEU 67 -7.055 -2.836 9.069 536 H GLN 68 H GLN 68 -5.123 -2.759 11.276 537 HA GLN 68 HA GLN 68 -7.090 -4.802 11.255 538 HB2 GLN 68 2HB GLN 68 -5.031 -5.173 10.088 539 HB3 GLN 68 3HB GLN 68 -4.087 -4.888 11.545 540 HG2 GLN 68 2HG GLN 68 -5.065 -6.917 12.541 541 HG3 GLN 68 3HG GLN 68 -5.926 -7.214 11.032 542 HE21 GLN 68 1HE2 GLN 68 -4.979 -9.011 10.301 543 HE22 GLN 68 2HE2 GLN 68 -3.290 -9.182 9.983 544 H GLU 69 H GLU 69 -4.902 -3.559 13.731 545 HA GLU 69 HA GLU 69 -5.380 -5.517 15.685 546 HB2 GLU 69 2HB GLU 69 -3.519 -4.025 15.936 547 HB3 GLU 69 3HB GLU 69 -4.574 -2.618 15.924 548 HG2 GLU 69 2HG GLU 69 -4.935 -4.681 18.039 549 HG3 GLU 69 3HG GLU 69 -3.596 -3.542 18.161 550 H ARG 70 H ARG 70 -6.848 -2.292 15.294 551 HA ARG 70 HA ARG 70 -8.707 -2.581 17.393 552 HB2 ARG 70 2HB ARG 70 -7.920 -0.507 15.851 553 HB3 ARG 70 3HB ARG 70 -9.467 -0.873 15.099 554 HG2 ARG 70 2HG ARG 70 -10.609 -0.574 17.201 555 HG3 ARG 70 3HG ARG 70 -9.072 -0.335 18.034 556 HD2 ARG 70 2HD ARG 70 -9.140 1.833 17.565 557 HD3 ARG 70 3HD ARG 70 -9.193 1.469 15.840 558 HE ARG 70 HE ARG 70 -11.758 1.155 16.979 559 HH11 ARG 70 1HH1 ARG 70 -9.467 3.608 16.052 560 HH12 ARG 70 2HH1 ARG 70 -10.678 4.811 15.756 561 HH21 ARG 70 1HH2 ARG 70 -13.361 2.731 16.592 562 HH22 ARG 70 2HH2 ARG 70 -12.893 4.312 16.065 563 H ARG 71 H ARG 71 -9.114 -2.916 13.869 564 HA ARG 71 HA ARG 71 -11.798 -3.620 13.840 565 HB2 ARG 71 2HB ARG 71 -9.514 -4.344 12.017 566 HB3 ARG 71 3HB ARG 71 -11.156 -4.887 11.701 567 HG2 ARG 71 2HG ARG 71 -10.295 -2.013 11.960 568 HG3 ARG 71 3HG ARG 71 -10.578 -2.867 10.442 569 HD2 ARG 71 2HD ARG 71 -12.894 -3.349 11.803 570 HD3 ARG 71 3HD ARG 71 -12.484 -1.724 12.350 571 HE ARG 71 HE ARG 71 -12.199 -1.717 9.601 572 HH11 ARG 71 1HH1 ARG 71 -14.749 -2.265 11.908 573 HH12 ARG 71 2HH1 ARG 71 -16.001 -1.695 10.855 574 HH21 ARG 71 1HH2 ARG 71 -13.839 -0.964 8.206 575 HH22 ARG 71 2HH2 ARG 71 -15.483 -0.956 8.749 576 H GLU 72 H GLU 72 -8.943 -5.693 14.193 577 HA GLU 72 HA GLU 72 -10.228 -8.167 14.160 578 HB2 GLU 72 2HB GLU 72 -7.811 -7.984 14.035 579 HB3 GLU 72 3HB GLU 72 -7.747 -7.307 15.656 580 HG2 GLU 72 2HG GLU 72 -8.691 -9.450 16.509 581 HG3 GLU 72 3HG GLU 72 -8.524 -10.106 14.882 582 H LYS 73 H LYS 73 -9.445 -6.069 16.922 583 HA LYS 73 HA LYS 73 -10.434 -7.683 18.957 584 HB2 LYS 73 2HB LYS 73 -10.128 -4.714 18.654 585 HB3 LYS 73 3HB LYS 73 -10.896 -5.379 20.090 586 HG2 LYS 73 2HG LYS 73 -8.462 -6.787 19.583 587 HG3 LYS 73 3HG LYS 73 -8.152 -5.049 19.584 588 HD2 LYS 73 2HD LYS 73 -9.722 -5.197 21.741 589 HD3 LYS 73 3HD LYS 73 -9.046 -6.827 21.780 590 HE2 LYS 73 2HE LYS 73 -7.013 -6.094 22.386 591 HE3 LYS 73 3HE LYS 73 -7.073 -4.724 21.277 592 HZ1 LYS 73 3HZ LYS 73 -8.855 -3.975 23.111 593 HZ2 LYS 73 1HZ LYS 73 -7.216 -3.563 23.177 594 HZ3 LYS 73 2HZ LYS 73 -7.796 -4.870 24.081 595 H PHE 74 H PHE 74 -12.117 -5.395 16.861 596 HA PHE 74 HA PHE 74 -14.624 -5.631 18.211 597 HB2 PHE 74 2HB PHE 74 -13.828 -3.700 16.722 598 HB3 PHE 74 3HB PHE 74 -14.258 -4.729 15.360 599 HD1 PHE 74 HD1 PHE 74 -15.653 -3.200 18.443 600 HD2 PHE 74 HD2 PHE 74 -16.440 -4.779 14.569 601 HE1 PHE 74 HE1 PHE 74 -17.985 -2.435 18.609 602 HE2 PHE 74 HE2 PHE 74 -18.773 -4.015 14.729 603 HZ PHE 74 HZ PHE 74 -19.549 -2.841 16.750 604 H GLY 75 H GLY 75 -12.995 -7.402 15.716 605 HA2 GLY 75 2HA GLY 75 -14.129 -9.752 15.722 606 HA3 GLY 75 3HA GLY 75 -15.455 -8.841 15.016 607 H SER 76 H SER 76 -14.449 -10.914 13.608 608 HA SER 76 HA SER 76 -12.613 -9.755 11.634 609 HB2 SER 76 2HB SER 76 -12.346 -12.070 10.814 610 HB3 SER 76 3HB SER 76 -11.960 -11.938 12.530 611 HG SER 76 HG SER 76 -13.809 -13.468 11.335 612 H SER 77 H SER 77 -13.119 -9.654 9.455 613 HA SER 77 HA SER 77 -15.670 -10.581 8.480 614 HB2 SER 77 2HB SER 77 -16.796 -8.605 8.271 615 HB3 SER 77 3HB SER 77 -15.814 -8.171 9.669 616 HG SER 77 HG SER 77 -15.665 -6.573 8.076 617 H LYS 78 H LYS 78 -15.755 -10.711 6.256 618 HA LYS 78 HA LYS 78 -13.405 -11.016 4.839 619 HB2 LYS 78 2HB LYS 78 -16.266 -10.686 4.079 620 HB3 LYS 78 3HB LYS 78 -15.062 -10.544 2.804 621 HG2 LYS 78 2HG LYS 78 -15.129 -12.894 4.667 622 HG3 LYS 78 3HG LYS 78 -16.098 -12.833 3.193 623 HD2 LYS 78 2HD LYS 78 -13.837 -12.231 2.053 624 HD3 LYS 78 3HD LYS 78 -13.123 -12.934 3.506 625 HE2 LYS 78 2HE LYS 78 -15.250 -14.554 2.317 626 HE3 LYS 78 3HE LYS 78 -13.854 -14.323 1.265 627 HZ1 LYS 78 3HZ LYS 78 -13.826 -16.297 2.845 628 HZ2 LYS 78 1HZ LYS 78 -13.539 -15.173 4.077 629 HZ3 LYS 78 2HZ LYS 78 -12.441 -15.326 2.800 630 H GLU 79 H GLU 79 -15.382 -8.146 5.260 631 HA GLU 79 HA GLU 79 -14.202 -6.552 3.263 632 HB2 GLU 79 2HB GLU 79 -15.823 -6.047 5.706 633 HB3 GLU 79 3HB GLU 79 -14.947 -4.685 5.022 634 HG2 GLU 79 2HG GLU 79 -17.062 -4.584 4.049 635 HG3 GLU 79 3HG GLU 79 -16.034 -5.297 2.808 636 H ILE 80 H ILE 80 -13.459 -6.910 6.717 637 HA ILE 80 HA ILE 80 -11.303 -5.053 6.694 638 HB ILE 80 HB ILE 80 -11.885 -7.276 8.655 639 HG12 ILE 80 2HG1 ILE 80 -12.473 -4.343 9.007 640 HG13 ILE 80 3HG1 ILE 80 -13.640 -5.435 8.269 641 HG21 ILE 80 1HG2 ILE 80 -10.470 -6.015 10.199 642 HG22 ILE 80 2HG2 ILE 80 -9.570 -6.525 8.772 643 HG23 ILE 80 3HG2 ILE 80 -10.110 -4.853 8.922 644 HD11 ILE 80 3HD1 ILE 80 -12.477 -6.163 10.905 645 HD12 ILE 80 1HD1 ILE 80 -13.706 -4.900 10.831 646 HD13 ILE 80 2HD1 ILE 80 -14.068 -6.519 10.231 647 H ASP 81 H ASP 81 -11.371 -8.616 6.849 648 HA ASP 81 HA ASP 81 -8.651 -9.092 6.751 649 HB2 ASP 81 2HB ASP 81 -10.779 -10.696 6.888 650 HB3 ASP 81 3HB ASP 81 -10.416 -10.901 5.177 651 H MET 82 H MET 82 -10.892 -8.462 4.098 652 HA MET 82 HA MET 82 -9.040 -8.972 2.010 653 HB2 MET 82 2HB MET 82 -11.482 -8.966 1.673 654 HB3 MET 82 3HB MET 82 -11.517 -7.237 1.988 655 HG2 MET 82 2HG MET 82 -9.684 -7.353 0.004 656 HG3 MET 82 3HG MET 82 -10.731 -8.705 -0.424 657 HE1 MET 82 3HE MET 82 -13.364 -8.182 0.406 658 HE2 MET 82 1HE MET 82 -14.226 -6.938 -0.500 659 HE3 MET 82 2HE MET 82 -13.421 -8.253 -1.356 660 H ALA 83 H ALA 83 -10.011 -6.041 3.735 661 HA ALA 83 HA ALA 83 -8.696 -4.138 2.202 662 HB1 ALA 83 1HB ALA 83 -10.154 -3.343 3.856 663 HB2 ALA 83 2HB ALA 83 -9.338 -4.247 5.132 664 HB3 ALA 83 3HB ALA 83 -8.549 -2.851 4.398 665 H ILE 84 H ILE 84 -7.458 -6.098 4.886 666 HA ILE 84 HA ILE 84 -4.879 -4.920 4.929 667 HB ILE 84 HB ILE 84 -5.614 -7.698 5.850 668 HG12 ILE 84 2HG1 ILE 84 -5.700 -5.104 7.405 669 HG13 ILE 84 3HG1 ILE 84 -7.113 -5.967 6.808 670 HG21 ILE 84 1HG2 ILE 84 -3.539 -7.855 6.630 671 HG22 ILE 84 2HG2 ILE 84 -3.158 -6.384 5.735 672 HG23 ILE 84 3HG2 ILE 84 -3.658 -6.285 7.423 673 HD11 ILE 84 3HD1 ILE 84 -6.739 -6.387 9.171 674 HD12 ILE 84 1HD1 ILE 84 -6.560 -7.865 8.226 675 HD13 ILE 84 2HD1 ILE 84 -5.130 -7.015 8.813 676 H VAL 85 H VAL 85 -6.153 -7.874 3.427 677 HA VAL 85 HA VAL 85 -3.776 -8.880 2.388 678 HB VAL 85 HB VAL 85 -6.537 -9.051 1.172 679 HG11 VAL 85 1HG1 VAL 85 -5.631 -11.152 0.151 680 HG12 VAL 85 2HG1 VAL 85 -4.937 -9.661 -0.488 681 HG13 VAL 85 3HG1 VAL 85 -4.026 -10.635 0.666 682 HG21 VAL 85 3HG2 VAL 85 -5.549 -11.415 2.516 683 HG22 VAL 85 1HG2 VAL 85 -5.625 -10.031 3.607 684 HG23 VAL 85 2HG2 VAL 85 -7.069 -10.547 2.736 685 H THR 86 H THR 86 -6.087 -6.614 0.927 686 HA THR 86 HA THR 86 -4.792 -6.332 -1.546 687 HB THR 86 HB THR 86 -6.007 -4.142 -1.701 688 HG1 THR 86 HG1 THR 86 -6.418 -3.313 0.214 689 HG21 THR 86 3HG2 THR 86 -8.244 -5.683 -0.861 690 HG22 THR 86 1HG2 THR 86 -7.058 -6.780 -1.566 691 HG23 THR 86 2HG2 THR 86 -7.655 -5.408 -2.500 692 H LEU 87 H LEU 87 -4.536 -4.403 1.429 693 HA LEU 87 HA LEU 87 -2.747 -2.480 0.492 694 HB2 LEU 87 2HB LEU 87 -3.447 -3.574 3.167 695 HB3 LEU 87 3HB LEU 87 -2.011 -2.562 3.030 696 HG LEU 87 HG LEU 87 -4.816 -1.739 2.280 697 HD11 LEU 87 1HD1 LEU 87 -4.332 -2.049 4.734 698 HD12 LEU 87 2HD1 LEU 87 -4.845 -0.433 4.251 699 HD13 LEU 87 3HD1 LEU 87 -3.143 -0.756 4.578 700 HD21 LEU 87 3HD2 LEU 87 -2.149 -0.398 2.085 701 HD22 LEU 87 1HD2 LEU 87 -3.611 0.555 2.335 702 HD23 LEU 87 2HD2 LEU 87 -3.458 -0.465 0.904 703 H LYS 88 H LYS 88 -2.221 -5.762 1.555 704 HA LYS 88 HA LYS 88 0.608 -5.558 1.851 705 HB2 LYS 88 2HB LYS 88 -1.177 -7.962 1.428 706 HB3 LYS 88 3HB LYS 88 0.536 -8.051 1.817 707 HG2 LYS 88 2HG LYS 88 -1.148 -6.440 3.631 708 HG3 LYS 88 3HG LYS 88 -1.393 -8.188 3.656 709 HD2 LYS 88 2HD LYS 88 0.739 -8.609 4.424 710 HD3 LYS 88 3HD LYS 88 1.386 -7.104 3.766 711 HE2 LYS 88 2HE LYS 88 1.351 -6.737 6.069 712 HE3 LYS 88 3HE LYS 88 -0.112 -5.939 5.493 713 HZ1 LYS 88 3HZ LYS 88 -0.625 -7.205 7.440 714 HZ2 LYS 88 1HZ LYS 88 0.062 -8.606 6.786 715 HZ3 LYS 88 2HZ LYS 88 -1.351 -7.965 6.114 716 H VAL 89 H VAL 89 -1.313 -7.298 -0.605 717 HA VAL 89 HA VAL 89 0.724 -7.839 -2.384 718 HB VAL 89 HB VAL 89 -1.051 -7.843 -4.166 719 HG11 VAL 89 1HG1 VAL 89 -2.459 -9.621 -2.902 720 HG12 VAL 89 2HG1 VAL 89 -0.739 -9.910 -3.172 721 HG13 VAL 89 3HG1 VAL 89 -1.304 -9.352 -1.597 722 HG21 VAL 89 3HG2 VAL 89 -2.496 -6.102 -3.409 723 HG22 VAL 89 1HG2 VAL 89 -3.403 -7.613 -3.332 724 HG23 VAL 89 2HG2 VAL 89 -2.745 -6.904 -1.858 725 H PHE 90 H PHE 90 -1.259 -4.921 -2.127 726 HA PHE 90 HA PHE 90 -0.171 -3.651 -4.427 727 HB2 PHE 90 2HB PHE 90 -2.309 -2.913 -3.662 728 HB3 PHE 90 3HB PHE 90 -1.694 -2.600 -2.043 729 HD1 PHE 90 HD1 PHE 90 -0.404 -1.633 -5.401 730 HD2 PHE 90 HD2 PHE 90 -1.907 -0.346 -1.633 731 HE1 PHE 90 HE1 PHE 90 0.039 0.705 -6.027 732 HE2 PHE 90 HE2 PHE 90 -1.467 1.994 -2.253 733 HZ PHE 90 HZ PHE 90 -0.493 2.522 -4.452 734 H ALA 91 H ALA 91 0.710 -3.758 -1.043 735 HA ALA 91 HA ALA 91 2.493 -1.578 -1.008 736 HB1 ALA 91 1HB ALA 91 3.476 -2.740 0.988 737 HB2 ALA 91 2HB ALA 91 1.735 -2.465 1.065 738 HB3 ALA 91 3HB ALA 91 2.358 -4.069 0.678 739 H VAL 92 H VAL 92 3.156 -5.069 -1.337 740 HA VAL 92 HA VAL 92 5.919 -4.700 -1.902 741 HB VAL 92 HB VAL 92 4.243 -7.114 -2.589 742 HG11 VAL 92 1HG1 VAL 92 6.511 -6.999 -3.576 743 HG12 VAL 92 2HG1 VAL 92 7.181 -6.882 -1.948 744 HG13 VAL 92 3HG1 VAL 92 6.315 -8.337 -2.444 745 HG21 VAL 92 3HG2 VAL 92 5.233 -7.911 -0.325 746 HG22 VAL 92 1HG2 VAL 92 5.390 -6.187 0.013 747 HG23 VAL 92 2HG2 VAL 92 3.804 -6.878 -0.327 748 H ALA 93 H ALA 93 3.170 -5.635 -3.972 749 HA ALA 93 HA ALA 93 4.606 -5.613 -6.392 750 HB1 ALA 93 1HB ALA 93 2.513 -5.786 -7.485 751 HB2 ALA 93 2HB ALA 93 2.357 -6.672 -5.967 752 HB3 ALA 93 3HB ALA 93 1.661 -5.058 -6.122 753 H GLY 94 H GLY 94 3.559 -3.062 -4.405 754 HA2 GLY 94 2HA GLY 94 3.572 -1.136 -6.624 755 HA3 GLY 94 3HA GLY 94 2.994 -0.821 -4.995 756 H LEU 95 H LEU 95 4.701 -0.878 -3.265 757 HA LEU 95 HA LEU 95 6.697 0.996 -3.825 758 HB2 LEU 95 2HB LEU 95 6.269 -0.912 -1.551 759 HB3 LEU 95 3HB LEU 95 7.664 0.164 -1.598 760 HG LEU 95 HG LEU 95 5.988 1.145 -0.201 761 HD11 LEU 95 1HD1 LEU 95 5.735 3.279 -1.233 762 HD12 LEU 95 2HD1 LEU 95 5.894 2.582 -2.845 763 HD13 LEU 95 3HD1 LEU 95 7.281 2.610 -1.757 764 HD21 LEU 95 3HD2 LEU 95 4.038 1.258 -2.467 765 HD22 LEU 95 1HD2 LEU 95 3.751 1.409 -0.733 766 HD23 LEU 95 2HD2 LEU 95 4.121 -0.168 -1.432 767 H LEU 96 H LEU 96 6.869 -2.530 -3.534 768 HA LEU 96 HA LEU 96 9.700 -2.520 -4.194 769 HB2 LEU 96 2HB LEU 96 8.030 -4.213 -2.743 770 HB3 LEU 96 3HB LEU 96 8.442 -5.123 -4.195 771 HG LEU 96 HG LEU 96 9.954 -5.653 -2.364 772 HD11 LEU 96 1HD1 LEU 96 10.662 -5.311 -4.879 773 HD12 LEU 96 2HD1 LEU 96 11.851 -5.688 -3.632 774 HD13 LEU 96 3HD1 LEU 96 11.649 -4.025 -4.184 775 HD21 LEU 96 3HD2 LEU 96 11.176 -4.122 -1.166 776 HD22 LEU 96 1HD2 LEU 96 9.689 -3.214 -1.444 777 HD23 LEU 96 2HD2 LEU 96 11.110 -2.906 -2.442 778 H ASN 97 H ASN 97 6.857 -2.375 -5.890 779 HA ASN 97 HA ASN 97 6.227 -2.809 -8.038 780 HB2 ASN 97 2HB ASN 97 8.716 -1.573 -8.065 781 HB3 ASN 97 3HB ASN 97 8.907 -2.928 -9.173 782 HD21 ASN 97 1HD2 ASN 97 8.711 -2.188 -11.157 783 HD22 ASN 97 2HD2 ASN 97 7.477 -1.121 -11.725 784 H MET 98 H MET 98 6.810 -5.113 -6.343 785 HA MET 98 HA MET 98 7.629 -7.059 -8.398 786 HB2 MET 98 2HB MET 98 8.982 -6.879 -6.233 787 HB3 MET 98 3HB MET 98 7.583 -7.580 -5.431 788 HG2 MET 98 2HG MET 98 7.829 -9.417 -7.279 789 HG3 MET 98 3HG MET 98 9.483 -8.815 -7.356 790 HE1 MET 98 3HE MET 98 11.007 -8.628 -5.679 791 HE2 MET 98 1HE MET 98 10.489 -8.522 -3.997 792 HE3 MET 98 2HE MET 98 11.305 -9.973 -4.578 793 H THR 99 H THR 99 5.584 -7.274 -9.330 794 HA THR 99 HA THR 99 3.183 -7.676 -7.948 795 HB THR 99 HB THR 99 3.959 -8.679 -10.694 796 HG1 THR 99 HG1 THR 99 3.302 -6.739 -11.399 797 HG21 THR 99 3HG2 THR 99 1.411 -8.504 -11.008 798 HG22 THR 99 1HG2 THR 99 1.330 -8.552 -9.248 799 HG23 THR 99 2HG2 THR 99 2.042 -9.900 -10.135 800 H VAL 100 H VAL 100 3.264 -9.164 -6.316 801 HA VAL 100 HA VAL 100 4.509 -11.660 -6.381 802 HB VAL 100 HB VAL 100 2.847 -12.282 -4.566 803 HG11 VAL 100 1HG1 VAL 100 4.461 -11.491 -3.264 804 HG12 VAL 100 2HG1 VAL 100 5.010 -10.443 -4.573 805 HG13 VAL 100 3HG1 VAL 100 3.802 -9.864 -3.425 806 HG21 VAL 100 3HG2 VAL 100 1.301 -10.330 -5.652 807 HG22 VAL 100 1HG2 VAL 100 1.114 -10.960 -4.016 808 HG23 VAL 100 2HG2 VAL 100 2.026 -9.476 -4.291 809 H SER 101 H SER 101 2.970 -13.704 -5.901 810 HA SER 101 HA SER 101 1.487 -14.075 -8.394 811 HB2 SER 101 2HB SER 101 1.573 -16.517 -7.024 812 HB3 SER 101 3HB SER 101 2.595 -16.026 -8.375 813 HG SER 101 HG SER 101 3.842 -16.656 -6.576 814 H THR 102 H THR 102 1.099 -14.931 -4.952 815 HA THR 102 HA THR 102 -1.814 -14.649 -5.315 816 HB THR 102 HB THR 102 -2.234 -16.424 -3.802 817 HG1 THR 102 HG1 THR 102 0.497 -16.919 -3.336 818 HG21 THR 102 3HG2 THR 102 -1.457 -18.267 -4.987 819 HG22 THR 102 1HG2 THR 102 0.117 -17.534 -5.293 820 HG23 THR 102 2HG2 THR 102 -1.306 -16.965 -6.166 821 H ALA 103 H ALA 103 -2.998 -14.080 -3.330 822 HA ALA 103 HA ALA 103 -2.044 -11.764 -2.137 823 HB1 ALA 103 1HB ALA 103 -4.313 -13.587 -1.674 824 HB2 ALA 103 2HB ALA 103 -3.863 -12.553 -0.318 825 HB3 ALA 103 3HB ALA 103 -4.283 -11.835 -1.873 826 H ALA 104 H ALA 104 -1.932 -15.102 -0.975 827 HA ALA 104 HA ALA 104 -0.926 -14.548 1.598 828 HB1 ALA 104 1HB ALA 104 -0.013 -16.993 1.288 829 HB2 ALA 104 2HB ALA 104 -1.741 -16.683 1.454 830 HB3 ALA 104 3HB ALA 104 -1.045 -16.960 -0.142 831 H ALA 105 H ALA 105 0.719 -15.382 -1.439 832 HA ALA 105 HA ALA 105 3.329 -15.494 -0.501 833 HB1 ALA 105 1HB ALA 105 2.170 -15.790 -2.926 834 HB2 ALA 105 2HB ALA 105 3.005 -14.251 -3.146 835 HB3 ALA 105 3HB ALA 105 3.911 -15.686 -2.665 836 H ALA 106 H ALA 106 1.450 -12.693 -1.584 837 HA ALA 106 HA ALA 106 3.504 -10.787 -1.457 838 HB1 ALA 106 1HB ALA 106 1.893 -9.496 -2.265 839 HB2 ALA 106 2HB ALA 106 0.734 -10.796 -1.988 840 HB3 ALA 106 3HB ALA 106 1.017 -9.586 -0.736 841 H GLU 107 H GLU 107 0.999 -11.583 0.955 842 HA GLU 107 HA GLU 107 1.927 -9.843 2.950 843 HB2 GLU 107 2HB GLU 107 -0.302 -10.850 3.007 844 HB3 GLU 107 3HB GLU 107 0.409 -12.441 3.239 845 HG2 GLU 107 2HG GLU 107 1.247 -10.453 5.213 846 HG3 GLU 107 3HG GLU 107 -0.478 -10.812 5.225 847 H ASN 108 H ASN 108 2.706 -13.217 2.246 848 HA ASN 108 HA ASN 108 4.213 -13.812 4.507 849 HB2 ASN 108 2HB ASN 108 4.029 -14.864 1.746 850 HB3 ASN 108 3HB ASN 108 5.509 -15.253 2.619 851 HD21 ASN 108 1HD2 ASN 108 2.151 -14.910 3.692 852 HD22 ASN 108 2HD2 ASN 108 2.022 -16.498 4.361 853 H MET 109 H MET 109 5.248 -12.384 1.425 854 HA MET 109 HA MET 109 7.984 -12.188 2.077 855 HB2 MET 109 2HB MET 109 7.333 -12.028 -0.217 856 HB3 MET 109 3HB MET 109 6.265 -10.671 0.115 857 HG2 MET 109 2HG MET 109 8.281 -9.922 -0.987 858 HG3 MET 109 3HG MET 109 8.195 -9.279 0.651 859 HE1 MET 109 3HE MET 109 10.221 -8.630 1.194 860 HE2 MET 109 1HE MET 109 11.664 -9.600 1.488 861 HE3 MET 109 2HE MET 109 11.324 -8.996 -0.134 862 H TYR 110 H TYR 110 5.255 -10.017 2.572 863 HA TYR 110 HA TYR 110 6.665 -7.729 3.346 864 HB2 TYR 110 2HB TYR 110 4.116 -8.108 2.898 865 HB3 TYR 110 3HB TYR 110 4.049 -8.448 4.624 866 HD1 TYR 110 HD1 TYR 110 5.257 -5.861 2.222 867 HD2 TYR 110 HD2 TYR 110 3.767 -6.695 6.119 868 HE1 TYR 110 HE1 TYR 110 5.137 -3.448 2.686 869 HE2 TYR 110 HE2 TYR 110 3.641 -4.285 6.593 870 HH TYR 110 HH TYR 110 5.181 -1.979 4.813 871 H SER 111 H SER 111 5.620 -10.545 5.193 872 HA SER 111 HA SER 111 6.555 -9.451 7.696 873 HB2 SER 111 2HB SER 111 5.562 -11.270 8.708 874 HB3 SER 111 3HB SER 111 4.625 -11.205 7.215 875 HG SER 111 HG SER 111 6.286 -13.142 8.118 876 H GLN 112 H GLN 112 7.601 -11.944 5.409 877 HA GLN 112 HA GLN 112 9.770 -12.954 6.823 878 HB2 GLN 112 2HB GLN 112 8.777 -13.814 4.647 879 HB3 GLN 112 3HB GLN 112 9.730 -12.581 3.831 880 HG2 GLN 112 2HG GLN 112 11.713 -13.637 4.246 881 HG3 GLN 112 3HG GLN 112 11.110 -14.436 5.697 882 HE21 GLN 112 1HE2 GLN 112 10.627 -14.369 2.188 883 HE22 GLN 112 2HE2 GLN 112 10.355 -16.067 2.019 884 H MET 113 H MET 113 9.495 -10.056 4.857 885 HA MET 113 HA MET 113 12.296 -9.472 4.869 886 HB2 MET 113 2HB MET 113 10.428 -8.655 3.238 887 HB3 MET 113 3HB MET 113 10.179 -7.393 4.438 888 HG2 MET 113 2HG MET 113 12.925 -7.439 4.030 889 HG3 MET 113 3HG MET 113 12.228 -7.651 2.426 890 HE1 MET 113 3HE MET 113 12.984 -5.355 1.356 891 HE2 MET 113 1HE MET 113 11.334 -5.883 1.022 892 HE3 MET 113 2HE MET 113 11.661 -4.187 1.378 893 H GLY 114 H GLY 114 9.628 -8.848 6.997 894 HA2 GLY 114 2HA GLY 114 10.134 -8.357 9.317 895 HA3 GLY 114 3HA GLY 114 11.464 -7.354 8.758 896 H LEU 115 H LEU 115 8.491 -7.154 7.034 897 HA LEU 115 HA LEU 115 8.117 -4.438 8.046 898 HB2 LEU 115 2HB LEU 115 6.621 -5.712 5.777 899 HB3 LEU 115 3HB LEU 115 6.863 -3.997 6.103 900 HG LEU 115 HG LEU 115 8.999 -5.926 5.195 901 HD11 LEU 115 1HD1 LEU 115 8.901 -4.537 3.110 902 HD12 LEU 115 2HD1 LEU 115 7.403 -3.840 3.726 903 HD13 LEU 115 3HD1 LEU 115 7.497 -5.568 3.389 904 HD21 LEU 115 3HD2 LEU 115 10.516 -4.347 5.606 905 HD22 LEU 115 1HD2 LEU 115 9.282 -3.548 6.581 906 HD23 LEU 115 2HD2 LEU 115 9.509 -3.086 4.893 907 H ASP 116 H ASP 116 6.416 -7.506 7.724 908 HA ASP 116 HA ASP 116 3.987 -6.474 8.893 909 HB2 ASP 116 2HB ASP 116 4.515 -8.585 7.248 910 HB3 ASP 116 3HB ASP 116 4.359 -9.396 8.804 911 H THR 117 H THR 117 3.155 -8.400 10.611 912 HA THR 117 HA THR 117 5.144 -8.909 12.637 913 HB THR 117 HB THR 117 2.865 -7.337 13.708 914 HG1 THR 117 HG1 THR 117 3.475 -5.966 12.046 915 HG21 THR 117 3HG2 THR 117 4.785 -6.458 15.132 916 HG22 THR 117 1HG2 THR 117 5.788 -7.675 14.344 917 HG23 THR 117 2HG2 THR 117 4.394 -8.169 15.305 918 H ARG 118 H ARG 118 3.586 -10.666 11.190 919 HA ARG 118 HA ARG 118 1.954 -11.829 13.323 920 HB2 ARG 118 2HB ARG 118 1.043 -11.171 10.544 921 HB3 ARG 118 3HB ARG 118 0.361 -12.558 11.382 922 HG2 ARG 118 2HG ARG 118 0.376 -10.174 13.034 923 HG3 ARG 118 3HG ARG 118 -0.525 -9.955 11.532 924 HD2 ARG 118 2HD ARG 118 -2.116 -11.472 12.105 925 HD3 ARG 118 3HD ARG 118 -0.985 -12.473 13.016 926 HE ARG 118 HE ARG 118 -1.445 -9.987 14.315 927 HH11 ARG 118 1HH1 ARG 118 -2.853 -13.116 13.728 928 HH12 ARG 118 2HH1 ARG 118 -3.802 -13.106 15.177 929 HH21 ARG 118 1HH2 ARG 118 -2.689 -9.961 16.226 930 HH22 ARG 118 2HH2 ARG 118 -3.708 -11.310 16.597 931 HA PRO 119 HA PRO 119 4.898 -14.822 11.308 932 HB2 PRO 119 2HB PRO 119 5.948 -15.737 13.639 933 HB3 PRO 119 3HB PRO 119 6.578 -14.319 12.793 934 HG2 PRO 119 2HG PRO 119 4.723 -14.455 15.139 935 HG3 PRO 119 3HG PRO 119 6.104 -13.376 14.865 936 HD2 PRO 119 2HD PRO 119 3.542 -12.594 14.469 937 HD3 PRO 119 3HD PRO 119 4.893 -11.967 13.502 938 H SER 120 H SER 120 3.699 -16.501 10.652 939 HA SER 120 HA SER 120 2.526 -18.246 12.703 940 HB2 SER 120 2HB SER 120 0.688 -18.633 10.845 941 HB3 SER 120 3HB SER 120 0.553 -17.286 11.975 942 HG SER 120 HG SER 120 1.725 -16.064 10.276 943 H MET 121 H MET 121 3.428 -17.940 9.280 944 HA MET 121 HA MET 121 4.544 -20.644 9.400 945 HB2 MET 121 2HB MET 121 2.181 -19.905 7.947 946 HB3 MET 121 3HB MET 121 3.446 -20.356 6.811 947 HG2 MET 121 2HG MET 121 3.559 -22.520 7.584 948 HG3 MET 121 3HG MET 121 2.880 -22.105 9.156 949 HE1 MET 121 3HE MET 121 1.205 -24.785 7.197 950 HE2 MET 121 1HE MET 121 1.981 -24.325 8.713 951 HE3 MET 121 2HE MET 121 0.222 -24.325 8.588 952 H LYS 122 H LYS 122 6.474 -20.820 8.424 953 HA LYS 122 HA LYS 122 7.407 -18.516 6.846 954 HB2 LYS 122 2HB LYS 122 9.055 -20.526 8.391 955 HB3 LYS 122 3HB LYS 122 9.670 -19.115 7.540 956 HG2 LYS 122 2HG LYS 122 7.717 -18.938 9.818 957 HG3 LYS 122 3HG LYS 122 9.469 -18.889 10.031 958 HD2 LYS 122 2HD LYS 122 8.995 -17.044 8.024 959 HD3 LYS 122 3HD LYS 122 7.641 -16.814 9.134 960 HE2 LYS 122 2HE LYS 122 9.434 -15.361 9.796 961 HE3 LYS 122 3HE LYS 122 9.272 -16.641 10.998 962 HZ1 LYS 122 3HZ LYS 122 11.395 -16.230 9.003 963 HZ2 LYS 122 1HZ LYS 122 11.079 -17.791 9.575 964 HZ3 LYS 122 2HZ LYS 122 11.530 -16.569 10.655 965 H GLU 123 H GLU 123 5.897 -20.473 5.569 966 HA GLU 123 HA GLU 123 7.908 -21.573 3.745 967 HB2 GLU 123 2HB GLU 123 6.498 -23.167 5.537 968 HB3 GLU 123 3HB GLU 123 5.625 -23.352 4.022 969 HG2 GLU 123 2HG GLU 123 7.728 -23.971 2.910 970 HG3 GLU 123 3HG GLU 123 8.562 -23.846 4.459 971 H ALA 124 H ALA 124 7.042 -22.109 1.620 972 HA ALA 124 HA ALA 124 4.400 -21.295 0.889 973 HB1 ALA 124 1HB ALA 124 6.675 -19.417 0.508 974 HB2 ALA 124 2HB ALA 124 5.448 -19.520 -0.755 975 HB3 ALA 124 3HB ALA 124 4.985 -19.086 0.891 976 H GLY 125 H GLY 125 4.001 -21.537 -1.437 977 HA2 GLY 125 2HA GLY 125 6.076 -23.048 -2.866 978 HA3 GLY 125 3HA GLY 125 4.500 -23.789 -2.634 979 H GLY 126 H GLY 126 3.138 -23.585 -4.277 980 HA2 GLY 126 2HA GLY 126 1.930 -22.525 -5.957 981 HA3 GLY 126 3HA GLY 126 2.915 -21.089 -5.721 982 H LYS 127 H LYS 127 3.552 -24.461 -6.694 983 HA LYS 127 HA LYS 127 4.868 -23.409 -9.109 984 HB2 LYS 127 2HB LYS 127 5.934 -25.202 -7.014 985 HB3 LYS 127 3HB LYS 127 6.262 -25.691 -8.671 986 HG2 LYS 127 2HG LYS 127 7.623 -23.908 -9.079 987 HG3 LYS 127 3HG LYS 127 6.795 -22.869 -7.917 988 HD2 LYS 127 2HD LYS 127 7.760 -24.533 -6.159 989 HD3 LYS 127 3HD LYS 127 8.893 -24.949 -7.447 990 HE2 LYS 127 2HE LYS 127 8.417 -22.185 -6.334 991 HE3 LYS 127 3HE LYS 127 9.797 -23.219 -5.967 992 HZ1 LYS 127 3HZ LYS 127 10.170 -21.475 -7.710 993 HZ2 LYS 127 1HZ LYS 127 9.132 -22.349 -8.720 994 HZ3 LYS 127 2HZ LYS 127 10.569 -23.053 -8.173 995 H GLU 128 H GLU 128 3.560 -23.984 -10.726 996 HA GLU 128 HA GLU 128 1.822 -26.212 -10.677 997 HB2 GLU 128 2HB GLU 128 2.549 -24.099 -12.565 998 HB3 GLU 128 3HB GLU 128 2.154 -25.621 -13.352 999 HG2 GLU 128 2HG GLU 128 0.018 -25.092 -13.169 1000 HG3 GLU 128 3HG GLU 128 0.174 -25.254 -11.421 1001 H GLU 129 H GLU 129 1.896 -28.154 -11.872 1002 HA GLU 129 HA GLU 129 4.346 -29.511 -11.804 1003 HB2 GLU 129 2HB GLU 129 3.170 -31.306 -13.028 1004 HB3 GLU 129 3HB GLU 129 2.238 -30.701 -11.666 1005 HG2 GLU 129 2HG GLU 129 0.897 -29.340 -13.200 1006 HG3 GLU 129 3HG GLU 129 1.815 -29.987 -14.559 1007 H GLY 130 H GLY 130 5.988 -29.659 -13.195 1008 HA2 GLY 130 2HA GLY 130 6.994 -29.813 -15.322 1009 HA3 GLY 130 3HA GLY 130 5.548 -29.109 -16.031 1010 HA PRO 131 HA PRO 131 8.877 -25.874 -15.936 1011 HB2 PRO 131 2HB PRO 131 8.526 -25.094 -18.513 1012 HB3 PRO 131 3HB PRO 131 9.593 -26.425 -18.049 1013 HG2 PRO 131 2HG PRO 131 6.796 -26.521 -19.113 1014 HG3 PRO 131 3HG PRO 131 8.191 -27.529 -19.540 1015 HD2 PRO 131 2HD PRO 131 6.249 -28.369 -17.850 1016 HD3 PRO 131 3HD PRO 131 7.942 -28.878 -17.688 1017 HA PRO 132 HA PRO 132 6.199 -22.431 -15.385 1018 HB2 PRO 132 2HB PRO 132 7.660 -20.367 -16.374 1019 HB3 PRO 132 3HB PRO 132 8.053 -21.182 -14.855 1020 HG2 PRO 132 2HG PRO 132 9.249 -21.563 -17.573 1021 HG3 PRO 132 3HG PRO 132 10.058 -21.467 -15.998 1022 HD2 PRO 132 2HD PRO 132 9.575 -23.820 -17.247 1023 HD3 PRO 132 3HD PRO 132 9.582 -23.661 -15.478 1024 H GLN 133 H GLN 133 4.531 -21.449 -16.400 1025 HA GLN 133 HA GLN 133 4.151 -21.924 -19.200 1026 HB2 GLN 133 2HB GLN 133 2.451 -21.670 -17.103 1027 HB3 GLN 133 3HB GLN 133 2.316 -20.068 -17.816 1028 HG2 GLN 133 2HG GLN 133 1.683 -21.036 -19.943 1029 HG3 GLN 133 3HG GLN 133 1.892 -22.659 -19.289 1030 HE21 GLN 133 1HE2 GLN 133 -0.217 -23.264 -19.650 1031 HE22 GLN 133 2HE2 GLN 133 -1.544 -22.625 -18.747 1032 H ALA 134 H ALA 134 3.962 -20.414 -20.857 1033 HA ALA 134 HA ALA 134 4.665 -17.637 -20.283 1034 HB1 ALA 134 1HB ALA 134 6.764 -18.979 -20.762 1035 HB2 ALA 134 2HB ALA 134 6.159 -19.145 -22.411 1036 HB3 ALA 134 3HB ALA 134 6.501 -17.545 -21.754 1037 H TYR 135 H TYR 135 4.409 -16.240 -22.226 1038 HA TYR 135 HA TYR 135 3.078 -15.399 -23.868 1039 HB2 TYR 135 2HB TYR 135 3.468 -18.240 -24.763 1040 HB3 TYR 135 3HB TYR 135 2.441 -17.147 -25.683 1041 HD1 TYR 135 HD1 TYR 135 3.434 -15.072 -26.670 1042 HD2 TYR 135 HD2 TYR 135 5.832 -18.109 -24.900 1043 HE1 TYR 135 HE1 TYR 135 5.414 -14.171 -27.819 1044 HE2 TYR 135 HE2 TYR 135 7.818 -17.216 -26.043 1045 HH TYR 135 HH TYR 135 8.525 -14.938 -26.995 Start of MODEL 17 1 H21 MYR 1 1H2 MYR 1 3.309 12.409 -0.822 2 H22 MYR 1 2H2 MYR 1 2.568 13.467 0.363 3 H31 MYR 1 1H3 MYR 1 3.673 11.786 1.705 4 H32 MYR 1 2H3 MYR 1 4.771 13.164 1.792 5 H41 MYR 1 1H4 MYR 1 6.467 11.952 0.841 6 H42 MYR 1 2H4 MYR 1 5.486 11.605 -0.586 7 H51 MYR 1 1H5 MYR 1 5.034 10.020 2.013 8 H52 MYR 1 2H5 MYR 1 6.372 9.597 0.943 9 H61 MYR 1 1H6 MYR 1 4.826 9.183 -0.955 10 H62 MYR 1 2H6 MYR 1 3.454 9.833 -0.053 11 H71 MYR 1 1H7 MYR 1 3.921 7.940 1.721 12 H72 MYR 1 2H7 MYR 1 5.009 7.231 0.527 13 H81 MYR 1 1H8 MYR 1 3.268 6.583 -0.911 14 H82 MYR 1 2H8 MYR 1 2.258 7.975 -0.512 15 H91 MYR 1 1H9 MYR 1 1.266 6.927 1.336 16 H92 MYR 1 2H9 MYR 1 2.721 6.027 1.766 17 H101 MYR 1 1H10 MYR 1 2.139 4.836 -0.670 18 H102 MYR 1 2H10 MYR 1 0.509 5.279 -0.187 19 H111 MYR 1 1H11 MYR 1 0.451 3.684 1.523 20 H112 MYR 1 2H11 MYR 1 2.108 4.006 2.007 21 H121 MYR 1 1H12 MYR 1 2.216 1.769 1.200 22 H122 MYR 1 2H12 MYR 1 2.887 2.716 -0.128 23 H131 MYR 1 1H13 MYR 1 1.070 2.307 -1.553 24 H132 MYR 1 2H13 MYR 1 -0.114 2.316 -0.245 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 4.924 13.198 -2.214 29 HA2 GLY 2 2HA GLY 2 5.423 15.152 -3.523 30 HA3 GLY 2 3HA GLY 2 5.315 16.112 -2.055 31 H ASN 3 H ASN 3 7.006 15.719 -0.402 32 HA ASN 3 HA ASN 3 9.557 16.053 -1.449 33 HB2 ASN 3 2HB ASN 3 8.485 15.423 1.268 34 HB3 ASN 3 3HB ASN 3 10.221 15.300 0.999 35 HD21 ASN 3 1HD2 ASN 3 10.310 17.018 2.593 36 HD22 ASN 3 2HD2 ASN 3 10.106 18.654 2.077 37 H GLY 4 H GLY 4 8.212 13.156 0.143 38 HA2 GLY 4 2HA GLY 4 8.565 10.934 -0.547 39 HA3 GLY 4 3HA GLY 4 9.876 11.487 -1.579 40 H ALA 5 H ALA 5 10.700 9.408 -0.460 41 HA ALA 5 HA ALA 5 12.204 8.437 0.947 42 HB1 ALA 5 1HB ALA 5 13.735 10.194 2.153 43 HB2 ALA 5 2HB ALA 5 13.854 9.938 0.412 44 HB3 ALA 5 3HB ALA 5 12.955 11.319 1.040 45 H SER 6 H SER 6 10.441 7.683 2.271 46 HA SER 6 HA SER 6 10.350 9.019 4.897 47 HB2 SER 6 2HB SER 6 8.207 8.873 3.298 48 HB3 SER 6 3HB SER 6 8.071 7.293 4.068 49 HG SER 6 HG SER 6 7.285 8.298 5.722 50 H ARG 7 H ARG 7 10.347 7.710 6.731 51 HA ARG 7 HA ARG 7 11.890 5.389 6.628 52 HB2 ARG 7 2HB ARG 7 10.922 7.038 8.620 53 HB3 ARG 7 3HB ARG 7 10.104 5.515 8.940 54 HG2 ARG 7 2HG ARG 7 12.099 4.378 9.315 55 HG3 ARG 7 3HG ARG 7 13.062 5.610 8.496 56 HD2 ARG 7 2HD ARG 7 12.572 7.187 10.304 57 HD3 ARG 7 3HD ARG 7 11.613 5.953 11.120 58 HE ARG 7 HE ARG 7 13.552 4.988 11.868 59 HH11 ARG 7 1HH1 ARG 7 14.298 7.237 9.317 60 HH12 ARG 7 2HH1 ARG 7 16.012 7.134 9.551 61 HH21 ARG 7 1HH2 ARG 7 15.806 4.844 12.185 62 HH22 ARG 7 2HH2 ARG 7 16.868 5.772 11.182 63 H ASP 8 H ASP 8 8.376 5.768 6.963 64 HA ASP 8 HA ASP 8 7.714 3.072 7.248 65 HB2 ASP 8 2HB ASP 8 6.292 5.541 6.467 66 HB3 ASP 8 3HB ASP 8 5.557 4.039 5.911 67 H TRP 9 H TRP 9 8.419 4.971 4.386 68 HA TRP 9 HA TRP 9 7.500 3.067 2.490 69 HB2 TRP 9 2HB TRP 9 7.792 5.397 1.864 70 HB3 TRP 9 3HB TRP 9 9.514 5.308 2.222 71 HD1 TRP 9 HD1 TRP 9 11.079 4.053 0.448 72 HE1 TRP 9 HE1 TRP 9 10.724 3.452 -2.029 73 HE3 TRP 9 HE3 TRP 9 6.011 4.674 0.181 74 HZ2 TRP 9 HZ2 TRP 9 8.579 3.265 -3.855 75 HZ3 TRP 9 HZ3 TRP 9 4.885 4.264 -1.968 76 HH2 TRP 9 HH2 TRP 9 6.144 3.575 -3.943 77 H LYS 10 H LYS 10 10.813 3.945 3.490 78 HA LYS 10 HA LYS 10 12.157 1.953 2.098 79 HB2 LYS 10 2HB LYS 10 12.758 3.583 4.521 80 HB3 LYS 10 3HB LYS 10 13.798 2.208 4.174 81 HG2 LYS 10 2HG LYS 10 13.592 3.492 1.740 82 HG3 LYS 10 3HG LYS 10 13.674 4.812 2.909 83 HD2 LYS 10 2HD LYS 10 15.779 4.222 3.629 84 HD3 LYS 10 3HD LYS 10 15.577 2.530 3.168 85 HE2 LYS 10 2HE LYS 10 17.124 3.448 1.635 86 HE3 LYS 10 3HE LYS 10 15.596 3.315 0.766 87 HZ1 LYS 10 3HZ LYS 10 15.351 5.552 0.665 88 HZ2 LYS 10 1HZ LYS 10 17.041 5.507 0.734 89 HZ3 LYS 10 2HZ LYS 10 16.146 5.837 2.130 90 H MET 11 H MET 11 10.787 1.876 5.367 91 HA MET 11 HA MET 11 11.691 -0.715 6.027 92 HB2 MET 11 2HB MET 11 10.785 1.076 7.598 93 HB3 MET 11 3HB MET 11 9.179 0.569 7.091 94 HG2 MET 11 2HG MET 11 9.362 -1.494 8.115 95 HG3 MET 11 3HG MET 11 11.123 -1.438 8.140 96 HE1 MET 11 3HE MET 11 12.511 -0.159 9.503 97 HE2 MET 11 1HE MET 11 12.137 0.484 11.102 98 HE3 MET 11 2HE MET 11 12.131 -1.258 10.829 99 H ALA 12 H ALA 12 8.692 0.464 4.565 100 HA ALA 12 HA ALA 12 7.223 -1.890 4.551 101 HB1 ALA 12 1HB ALA 12 7.268 0.469 2.700 102 HB2 ALA 12 2HB ALA 12 6.181 -0.894 2.429 103 HB3 ALA 12 3HB ALA 12 6.071 0.039 3.922 104 H ILE 13 H ILE 13 9.588 -0.714 2.181 105 HA ILE 13 HA ILE 13 9.292 -3.007 0.480 106 HB ILE 13 HB ILE 13 11.449 -0.893 0.517 107 HG12 ILE 13 2HG1 ILE 13 8.963 -1.171 -1.186 108 HG13 ILE 13 3HG1 ILE 13 9.218 0.025 0.080 109 HG21 ILE 13 1HG2 ILE 13 12.217 -2.921 -0.572 110 HG22 ILE 13 2HG2 ILE 13 10.764 -2.959 -1.569 111 HG23 ILE 13 3HG2 ILE 13 11.936 -1.656 -1.769 112 HD11 ILE 13 3HD1 ILE 13 9.605 1.157 -1.923 113 HD12 ILE 13 1HD1 ILE 13 11.211 0.807 -1.287 114 HD13 ILE 13 2HD1 ILE 13 10.548 -0.172 -2.595 115 H LYS 14 H LYS 14 11.319 -2.113 3.162 116 HA LYS 14 HA LYS 14 13.457 -3.870 2.803 117 HB2 LYS 14 2HB LYS 14 13.379 -2.080 4.512 118 HB3 LYS 14 3HB LYS 14 12.194 -3.014 5.414 119 HG2 LYS 14 2HG LYS 14 14.533 -4.598 4.846 120 HG3 LYS 14 3HG LYS 14 14.962 -3.099 5.674 121 HD2 LYS 14 2HD LYS 14 13.109 -3.650 7.321 122 HD3 LYS 14 3HD LYS 14 13.066 -5.253 6.583 123 HE2 LYS 14 2HE LYS 14 15.451 -5.538 7.118 124 HE3 LYS 14 3HE LYS 14 15.454 -3.955 7.895 125 HZ1 LYS 14 3HZ LYS 14 14.297 -4.722 9.675 126 HZ2 LYS 14 1HZ LYS 14 15.083 -6.160 9.253 127 HZ3 LYS 14 2HZ LYS 14 13.475 -5.910 8.795 128 H ARG 15 H ARG 15 10.364 -4.372 4.477 129 HA ARG 15 HA ARG 15 10.971 -7.122 5.071 130 HB2 ARG 15 2HB ARG 15 9.062 -5.200 5.929 131 HB3 ARG 15 3HB ARG 15 8.175 -6.577 5.291 132 HG2 ARG 15 2HG ARG 15 8.419 -7.416 7.346 133 HG3 ARG 15 3HG ARG 15 10.055 -7.811 6.816 134 HD2 ARG 15 2HD ARG 15 10.996 -6.053 7.967 135 HD3 ARG 15 3HD ARG 15 9.508 -5.107 7.948 136 HE ARG 15 HE ARG 15 9.036 -7.367 9.497 137 HH11 ARG 15 1HH1 ARG 15 11.064 -4.538 9.566 138 HH12 ARG 15 2HH1 ARG 15 11.138 -4.473 11.296 139 HH21 ARG 15 1HH2 ARG 15 9.127 -7.292 11.775 140 HH22 ARG 15 2HH2 ARG 15 10.037 -6.041 12.551 141 H CYS 16 H CYS 16 8.850 -5.403 2.809 142 HA CYS 16 HA CYS 16 7.633 -7.650 1.662 143 HB2 CYS 16 2HB CYS 16 6.807 -5.359 1.333 144 HB3 CYS 16 3HB CYS 16 8.241 -4.973 0.388 145 HG CYS 16 HG CYS 16 7.156 -7.505 -1.153 146 H SER 17 H SER 17 10.798 -6.340 1.289 147 HA SER 17 HA SER 17 11.454 -7.298 -1.266 148 HB2 SER 17 2HB SER 17 12.957 -6.397 1.124 149 HB3 SER 17 3HB SER 17 13.844 -7.414 -0.011 150 HG SER 17 HG SER 17 13.862 -5.833 -1.402 151 H ASN 18 H ASN 18 10.897 -8.951 1.667 152 HA ASN 18 HA ASN 18 12.378 -11.322 0.814 153 HB2 ASN 18 2HB ASN 18 11.794 -10.209 3.324 154 HB3 ASN 18 3HB ASN 18 10.833 -11.683 3.232 155 HD21 ASN 18 1HD2 ASN 18 14.089 -10.393 2.906 156 HD22 ASN 18 2HD2 ASN 18 14.907 -11.856 3.323 157 H VAL 19 H VAL 19 9.929 -10.324 -0.544 158 HA VAL 19 HA VAL 19 8.082 -12.549 -0.023 159 HB VAL 19 HB VAL 19 7.637 -10.020 -1.615 160 HG11 VAL 19 1HG1 VAL 19 5.177 -11.085 -1.050 161 HG12 VAL 19 2HG1 VAL 19 6.022 -11.223 -2.593 162 HG13 VAL 19 3HG1 VAL 19 6.141 -12.519 -1.403 163 HG21 VAL 19 3HG2 VAL 19 5.934 -10.383 0.678 164 HG22 VAL 19 1HG2 VAL 19 7.633 -10.418 1.151 165 HG23 VAL 19 2HG2 VAL 19 6.991 -9.032 0.270 166 H ALA 20 H ALA 20 7.537 -14.008 -1.591 167 HA ALA 20 HA ALA 20 9.287 -14.070 -3.935 168 HB1 ALA 20 1HB ALA 20 7.438 -16.278 -3.094 169 HB2 ALA 20 2HB ALA 20 8.922 -16.375 -4.043 170 HB3 ALA 20 3HB ALA 20 9.001 -16.033 -2.315 171 H VAL 21 H VAL 21 8.462 -14.516 -6.038 172 HA VAL 21 HA VAL 21 5.937 -13.198 -6.547 173 HB VAL 21 HB VAL 21 7.800 -14.461 -8.559 174 HG11 VAL 21 1HG1 VAL 21 6.744 -12.767 -10.071 175 HG12 VAL 21 2HG1 VAL 21 5.652 -14.032 -9.506 176 HG13 VAL 21 3HG1 VAL 21 5.591 -12.425 -8.782 177 HG21 VAL 21 3HG2 VAL 21 8.084 -11.670 -8.598 178 HG22 VAL 21 1HG2 VAL 21 8.188 -12.148 -6.904 179 HG23 VAL 21 2HG2 VAL 21 9.277 -12.866 -8.091 180 H GLY 22 H GLY 22 7.349 -16.416 -7.064 181 HA2 GLY 22 2HA GLY 22 4.680 -17.416 -7.799 182 HA3 GLY 22 3HA GLY 22 6.201 -18.228 -8.138 183 H VAL 23 H VAL 23 4.593 -19.928 -7.168 184 HA VAL 23 HA VAL 23 4.754 -19.941 -4.241 185 HB VAL 23 HB VAL 23 3.176 -21.799 -4.308 186 HG11 VAL 23 1HG1 VAL 23 2.394 -19.423 -4.389 187 HG12 VAL 23 2HG1 VAL 23 2.207 -19.607 -6.134 188 HG13 VAL 23 3HG1 VAL 23 1.247 -20.597 -5.034 189 HG21 VAL 23 3HG2 VAL 23 3.420 -23.101 -6.141 190 HG22 VAL 23 1HG2 VAL 23 2.160 -22.049 -6.785 191 HG23 VAL 23 2HG2 VAL 23 3.852 -21.745 -7.181 192 H GLY 24 H GLY 24 5.952 -21.569 -7.082 193 HA2 GLY 24 2HA GLY 24 7.749 -23.126 -5.356 194 HA3 GLY 24 3HA GLY 24 6.813 -23.970 -6.581 195 H GLY 25 H GLY 25 8.492 -24.663 -7.844 196 HA2 GLY 25 2HA GLY 25 10.060 -24.529 -9.516 197 HA3 GLY 25 3HA GLY 25 9.505 -22.882 -9.781 198 H LYS 26 H LYS 26 11.321 -21.716 -9.937 199 HA LYS 26 HA LYS 26 13.539 -22.213 -8.118 200 HB2 LYS 26 2HB LYS 26 14.834 -20.796 -9.521 201 HB3 LYS 26 3HB LYS 26 13.857 -21.796 -10.589 202 HG2 LYS 26 2HG LYS 26 12.342 -19.490 -10.086 203 HG3 LYS 26 3HG LYS 26 13.993 -18.943 -10.391 204 HD2 LYS 26 2HD LYS 26 14.040 -20.175 -12.484 205 HD3 LYS 26 3HD LYS 26 12.423 -20.811 -12.169 206 HE2 LYS 26 2HE LYS 26 12.551 -17.907 -12.009 207 HE3 LYS 26 3HE LYS 26 13.031 -18.525 -13.589 208 HZ1 LYS 26 3HZ LYS 26 10.941 -19.817 -13.610 209 HZ2 LYS 26 1HZ LYS 26 10.687 -18.145 -13.584 210 HZ3 LYS 26 2HZ LYS 26 10.476 -19.053 -12.174 211 H SER 27 H SER 27 14.409 -20.649 -6.726 212 HA SER 27 HA SER 27 12.489 -19.009 -5.423 213 HB2 SER 27 2HB SER 27 15.483 -18.853 -5.057 214 HB3 SER 27 3HB SER 27 14.226 -18.458 -3.885 215 HG SER 27 HG SER 27 14.212 -20.469 -3.309 216 H LYS 28 H LYS 28 11.967 -16.942 -5.732 217 HA LYS 28 HA LYS 28 13.806 -15.034 -6.837 218 HB2 LYS 28 2HB LYS 28 12.225 -14.440 -8.741 219 HB3 LYS 28 3HB LYS 28 13.183 -15.900 -8.943 220 HG2 LYS 28 2HG LYS 28 11.371 -17.169 -9.120 221 HG3 LYS 28 3HG LYS 28 10.642 -16.458 -7.679 222 HD2 LYS 28 2HD LYS 28 9.208 -16.031 -9.560 223 HD3 LYS 28 3HD LYS 28 9.950 -14.510 -9.060 224 HE2 LYS 28 2HE LYS 28 11.426 -16.039 -11.100 225 HE3 LYS 28 3HE LYS 28 9.867 -15.396 -11.614 226 HZ1 LYS 28 3HZ LYS 28 10.919 -13.486 -11.945 227 HZ2 LYS 28 1HZ LYS 28 12.324 -14.026 -11.173 228 HZ3 LYS 28 2HZ LYS 28 11.073 -13.336 -10.267 229 H LYS 29 H LYS 29 13.469 -13.368 -5.531 230 HA LYS 29 HA LYS 29 10.744 -12.809 -4.595 231 HB2 LYS 29 2HB LYS 29 13.452 -11.977 -3.556 232 HB3 LYS 29 3HB LYS 29 11.947 -11.303 -2.946 233 HG2 LYS 29 2HG LYS 29 12.282 -12.957 -1.422 234 HG3 LYS 29 3HG LYS 29 11.336 -13.845 -2.620 235 HD2 LYS 29 2HD LYS 29 13.337 -14.792 -3.569 236 HD3 LYS 29 3HD LYS 29 14.351 -13.798 -2.520 237 HE2 LYS 29 2HE LYS 29 14.297 -15.399 -0.984 238 HE3 LYS 29 3HE LYS 29 12.550 -15.199 -0.856 239 HZ1 LYS 29 3HZ LYS 29 14.003 -17.358 -1.941 240 HZ2 LYS 29 1HZ LYS 29 13.026 -16.686 -3.149 241 HZ3 LYS 29 2HZ LYS 29 12.334 -17.219 -1.701 242 H PHE 30 H PHE 30 10.242 -10.437 -4.282 243 HA PHE 30 HA PHE 30 10.618 -9.098 -6.801 244 HB2 PHE 30 2HB PHE 30 9.135 -8.303 -4.290 245 HB3 PHE 30 3HB PHE 30 9.148 -7.346 -5.767 246 HD1 PHE 30 HD2 PHE 30 8.114 -8.256 -7.831 247 HD2 PHE 30 HD1 PHE 30 7.751 -10.204 -4.063 248 HE1 PHE 30 HE2 PHE 30 6.214 -9.559 -8.692 249 HE2 PHE 30 HE1 PHE 30 5.850 -11.511 -4.919 250 HZ PHE 30 HZ PHE 30 5.078 -11.188 -7.236 251 H GLY 31 H GLY 31 11.058 -6.646 -6.718 252 HA2 GLY 31 2HA GLY 31 13.242 -6.081 -4.817 253 HA3 GLY 31 3HA GLY 31 13.464 -5.816 -6.540 254 H GLU 32 H GLU 32 13.891 -3.737 -4.865 255 HA GLU 32 HA GLU 32 11.647 -2.129 -4.309 256 HB2 GLU 32 2HB GLU 32 13.289 -0.271 -4.150 257 HB3 GLU 32 3HB GLU 32 13.756 -1.691 -3.225 258 HG2 GLU 32 2HG GLU 32 15.005 -2.204 -5.556 259 HG3 GLU 32 3HG GLU 32 15.038 -0.441 -5.556 260 H GLY 33 H GLY 33 13.823 -2.264 -7.105 261 HA2 GLY 33 2HA GLY 33 12.773 -0.065 -8.501 262 HA3 GLY 33 3HA GLY 33 13.619 -1.422 -9.230 263 H ASN 34 H ASN 34 11.643 -3.363 -8.223 264 HA ASN 34 HA ASN 34 9.833 -3.214 -10.434 265 HB2 ASN 34 2HB ASN 34 10.352 -5.158 -8.224 266 HB3 ASN 34 3HB ASN 34 8.832 -5.273 -9.107 267 HD21 ASN 34 1HD2 ASN 34 10.512 -7.359 -9.202 268 HD22 ASN 34 2HD2 ASN 34 11.255 -7.479 -10.757 269 H PHE 35 H PHE 35 9.496 -2.959 -6.911 270 HA PHE 35 HA PHE 35 6.732 -2.701 -6.767 271 HB2 PHE 35 2HB PHE 35 8.809 -1.364 -5.020 272 HB3 PHE 35 3HB PHE 35 7.111 -1.579 -4.610 273 HD1 PHE 35 HD1 PHE 35 6.667 -4.348 -5.539 274 HD2 PHE 35 HD2 PHE 35 9.930 -2.621 -3.421 275 HE1 PHE 35 HE1 PHE 35 7.183 -6.543 -4.553 276 HE2 PHE 35 HE2 PHE 35 10.452 -4.813 -2.432 277 HZ PHE 35 HZ PHE 35 9.079 -6.777 -2.998 278 H ARG 36 H ARG 36 9.204 -0.192 -7.195 279 HA ARG 36 HA ARG 36 7.377 1.978 -7.248 280 HB2 ARG 36 2HB ARG 36 9.280 3.260 -8.189 281 HB3 ARG 36 3HB ARG 36 9.707 2.364 -6.737 282 HG2 ARG 36 2HG ARG 36 10.699 0.604 -8.162 283 HG3 ARG 36 3HG ARG 36 10.354 1.602 -9.575 284 HD2 ARG 36 2HD ARG 36 11.661 3.336 -7.882 285 HD3 ARG 36 3HD ARG 36 12.498 1.808 -7.614 286 HE ARG 36 HE ARG 36 13.432 2.018 -9.684 287 HH11 ARG 36 1HH1 ARG 36 10.616 4.059 -9.519 288 HH12 ARG 36 2HH1 ARG 36 10.888 4.781 -11.071 289 HH21 ARG 36 1HH2 ARG 36 13.801 2.961 -11.728 290 HH22 ARG 36 2HH2 ARG 36 12.699 4.155 -12.326 291 H TRP 37 H TRP 37 8.882 0.006 -9.770 292 HA TRP 37 HA TRP 37 8.003 1.441 -11.998 293 HB2 TRP 37 2HB TRP 37 9.655 -0.282 -12.267 294 HB3 TRP 37 3HB TRP 37 8.555 -1.509 -11.644 295 HD1 TRP 37 HD1 TRP 37 9.571 0.228 -14.820 296 HE1 TRP 37 HE1 TRP 37 8.218 -0.720 -16.793 297 HE3 TRP 37 HE3 TRP 37 6.122 -2.493 -12.205 298 HZ2 TRP 37 HZ2 TRP 37 5.983 -2.399 -17.188 299 HZ3 TRP 37 HZ3 TRP 37 4.410 -3.740 -13.456 300 HH2 TRP 37 HH2 TRP 37 4.343 -3.693 -15.896 301 H ALA 38 H ALA 38 6.322 -0.771 -9.901 302 HA ALA 38 HA ALA 38 4.089 -1.170 -11.665 303 HB1 ALA 38 1HB ALA 38 4.656 -1.877 -8.810 304 HB2 ALA 38 2HB ALA 38 3.042 -2.079 -9.493 305 HB3 ALA 38 3HB ALA 38 4.411 -2.942 -10.194 306 H ILE 39 H ILE 39 4.398 0.469 -8.506 307 HA ILE 39 HA ILE 39 1.902 1.714 -8.544 308 HB ILE 39 HB ILE 39 3.191 1.598 -6.503 309 HG12 ILE 39 2HG1 ILE 39 3.288 4.490 -6.648 310 HG13 ILE 39 3HG1 ILE 39 1.839 3.869 -7.429 311 HG21 ILE 39 1HG2 ILE 39 5.413 1.854 -7.597 312 HG22 ILE 39 2HG2 ILE 39 5.100 3.584 -7.720 313 HG23 ILE 39 3HG2 ILE 39 5.218 2.821 -6.135 314 HD11 ILE 39 3HD1 ILE 39 2.708 3.581 -4.582 315 HD12 ILE 39 1HD1 ILE 39 1.200 4.232 -5.226 316 HD13 ILE 39 2HD1 ILE 39 1.514 2.497 -5.296 317 H ARG 40 H ARG 40 5.028 2.808 -9.779 318 HA ARG 40 HA ARG 40 4.207 5.424 -10.468 319 HB2 ARG 40 2HB ARG 40 6.456 3.679 -11.468 320 HB3 ARG 40 3HB ARG 40 6.223 5.338 -12.003 321 HG2 ARG 40 2HG ARG 40 6.284 4.928 -9.087 322 HG3 ARG 40 3HG ARG 40 7.798 4.636 -9.947 323 HD2 ARG 40 2HD ARG 40 7.428 6.892 -11.054 324 HD3 ARG 40 3HD ARG 40 6.162 7.157 -9.856 325 HE ARG 40 HE ARG 40 8.368 6.449 -8.401 326 HH11 ARG 40 1HH1 ARG 40 7.618 8.929 -10.726 327 HH12 ARG 40 2HH1 ARG 40 8.722 10.080 -10.049 328 HH21 ARG 40 1HH2 ARG 40 9.825 7.955 -7.501 329 HH22 ARG 40 2HH2 ARG 40 9.978 9.525 -8.215 330 H MET 41 H MET 41 4.635 2.510 -12.479 331 HA MET 41 HA MET 41 3.796 3.532 -14.900 332 HB2 MET 41 2HB MET 41 4.754 1.314 -14.716 333 HB3 MET 41 3HB MET 41 3.379 0.761 -13.771 334 HG2 MET 41 2HG MET 41 2.319 0.175 -15.614 335 HG3 MET 41 3HG MET 41 2.407 1.829 -16.214 336 HE1 MET 41 3HE MET 41 4.533 2.083 -18.827 337 HE2 MET 41 1HE MET 41 3.241 0.970 -19.277 338 HE3 MET 41 2HE MET 41 2.927 2.263 -18.119 339 H ALA 42 H ALA 42 1.818 2.123 -12.313 340 HA ALA 42 HA ALA 42 -0.655 2.339 -13.659 341 HB1 ALA 42 1HB ALA 42 -0.849 0.910 -11.900 342 HB2 ALA 42 2HB ALA 42 0.203 1.870 -10.859 343 HB3 ALA 42 3HB ALA 42 -1.464 2.374 -11.132 344 H ASN 43 H ASN 43 0.985 4.476 -11.346 345 HA ASN 43 HA ASN 43 -0.990 6.388 -11.017 346 HB2 ASN 43 2HB ASN 43 1.966 6.354 -10.782 347 HB3 ASN 43 3HB ASN 43 1.213 7.941 -10.910 348 HD21 ASN 43 1HD2 ASN 43 1.597 8.594 -8.850 349 HD22 ASN 43 2HD2 ASN 43 0.874 7.863 -7.462 350 H VAL 44 H VAL 44 1.244 5.915 -13.673 351 HA VAL 44 HA VAL 44 0.706 8.415 -14.951 352 HB VAL 44 HB VAL 44 1.869 5.884 -16.123 353 HG11 VAL 44 1HG1 VAL 44 1.098 7.281 -17.894 354 HG12 VAL 44 2HG1 VAL 44 1.783 8.720 -17.136 355 HG13 VAL 44 3HG1 VAL 44 2.847 7.475 -17.792 356 HG21 VAL 44 3HG2 VAL 44 3.695 6.332 -14.940 357 HG22 VAL 44 1HG2 VAL 44 3.825 7.883 -15.770 358 HG23 VAL 44 2HG2 VAL 44 2.934 7.766 -14.252 359 H SER 45 H SER 45 -0.068 5.086 -15.983 360 HA SER 45 HA SER 45 -1.847 5.743 -18.000 361 HB2 SER 45 2HB SER 45 -1.632 3.320 -16.223 362 HB3 SER 45 3HB SER 45 -2.856 3.428 -17.488 363 HG SER 45 HG SER 45 -0.669 2.454 -17.972 364 H THR 46 H THR 46 -2.314 5.713 -14.560 365 HA THR 46 HA THR 46 -5.132 6.478 -14.967 366 HB THR 46 HB THR 46 -5.761 5.446 -12.917 367 HG1 THR 46 HG1 THR 46 -3.162 4.501 -12.396 368 HG21 THR 46 3HG2 THR 46 -5.607 3.880 -14.757 369 HG22 THR 46 1HG2 THR 46 -5.104 3.082 -13.268 370 HG23 THR 46 2HG2 THR 46 -3.894 3.619 -14.433 371 H GLY 47 H GLY 47 -3.223 8.423 -15.100 372 HA2 GLY 47 2HA GLY 47 -4.071 10.289 -13.206 373 HA3 GLY 47 3HA GLY 47 -2.551 9.621 -12.631 374 H ARG 48 H ARG 48 -0.949 9.403 -14.692 375 HA ARG 48 HA ARG 48 0.425 10.530 -16.112 376 HB2 ARG 48 2HB ARG 48 -1.822 10.706 -17.362 377 HB3 ARG 48 3HB ARG 48 -1.864 12.364 -16.777 378 HG2 ARG 48 2HG ARG 48 -0.820 12.805 -18.710 379 HG3 ARG 48 3HG ARG 48 0.618 12.282 -17.831 380 HD2 ARG 48 2HD ARG 48 -0.088 9.911 -18.666 381 HD3 ARG 48 3HD ARG 48 -0.999 10.819 -19.872 382 HE ARG 48 HE ARG 48 1.501 11.894 -19.976 383 HH11 ARG 48 1HH1 ARG 48 0.209 8.674 -20.257 384 HH12 ARG 48 2HH1 ARG 48 1.454 8.128 -21.331 385 HH21 ARG 48 1HH2 ARG 48 3.146 11.188 -21.389 386 HH22 ARG 48 2HH2 ARG 48 3.125 9.558 -21.973 387 H GLU 49 H GLU 49 0.675 11.250 -13.520 388 HA GLU 49 HA GLU 49 1.806 13.850 -13.710 389 HB2 GLU 49 2HB GLU 49 -0.913 13.603 -12.657 390 HB3 GLU 49 3HB GLU 49 0.192 14.397 -11.543 391 HG2 GLU 49 2HG GLU 49 0.204 16.266 -12.738 392 HG3 GLU 49 3HG GLU 49 0.483 15.394 -14.244 393 HA PRO 50 HA PRO 50 4.241 12.365 -10.378 394 HB2 PRO 50 2HB PRO 50 4.818 14.640 -9.013 395 HB3 PRO 50 3HB PRO 50 5.520 14.262 -10.591 396 HG2 PRO 50 2HG PRO 50 3.214 16.050 -9.923 397 HG3 PRO 50 3HG PRO 50 4.544 16.320 -11.064 398 HD2 PRO 50 2HD PRO 50 2.083 15.519 -11.860 399 HD3 PRO 50 3HD PRO 50 3.566 15.030 -12.705 400 H GLY 51 H GLY 51 1.893 14.798 -9.223 401 HA2 GLY 51 2HA GLY 51 1.765 13.581 -6.609 402 HA3 GLY 51 3HA GLY 51 0.814 14.947 -7.175 403 H ASP 52 H ASP 52 1.103 11.427 -7.337 404 HA ASP 52 HA ASP 52 -1.813 11.254 -7.429 405 HB2 ASP 52 2HB ASP 52 0.071 10.099 -9.464 406 HB3 ASP 52 3HB ASP 52 -1.474 9.322 -9.132 407 H ILE 53 H ILE 53 0.363 10.745 -5.458 408 HA ILE 53 HA ILE 53 -0.103 7.871 -5.003 409 HB ILE 53 HB ILE 53 2.115 9.547 -3.827 410 HG12 ILE 53 2HG1 ILE 53 2.252 7.571 -6.114 411 HG13 ILE 53 3HG1 ILE 53 2.303 9.321 -6.297 412 HG21 ILE 53 1HG2 ILE 53 3.083 7.380 -3.220 413 HG22 ILE 53 2HG2 ILE 53 1.499 7.616 -2.482 414 HG23 ILE 53 3HG2 ILE 53 1.670 6.565 -3.888 415 HD11 ILE 53 3HD1 ILE 53 4.426 7.497 -5.741 416 HD12 ILE 53 1HD1 ILE 53 4.498 9.225 -6.087 417 HD13 ILE 53 2HD1 ILE 53 4.288 8.666 -4.428 418 HA PRO 54 HA PRO 54 -2.523 10.058 -1.737 419 HB2 PRO 54 2HB PRO 54 -4.584 8.292 -1.779 420 HB3 PRO 54 3HB PRO 54 -4.476 9.669 -2.882 421 HG2 PRO 54 2HG PRO 54 -3.776 6.798 -3.362 422 HG3 PRO 54 3HG PRO 54 -4.640 7.931 -4.418 423 HD2 PRO 54 2HD PRO 54 -2.021 7.332 -4.756 424 HD3 PRO 54 3HD PRO 54 -2.695 8.927 -5.151 425 H GLU 55 H GLU 55 -1.919 9.658 0.289 426 HA GLU 55 HA GLU 55 -0.993 7.033 1.068 427 HB2 GLU 55 2HB GLU 55 -0.451 8.139 3.224 428 HB3 GLU 55 3HB GLU 55 0.269 8.940 1.835 429 HG2 GLU 55 2HG GLU 55 -2.363 9.941 2.720 430 HG3 GLU 55 3HG GLU 55 -0.995 10.244 3.789 431 H THR 56 H THR 56 -3.483 6.545 0.492 432 HA THR 56 HA THR 56 -4.734 6.093 3.090 433 HB THR 56 HB THR 56 -6.886 6.897 2.468 434 HG1 THR 56 HG1 THR 56 -5.958 7.782 -0.048 435 HG21 THR 56 3HG2 THR 56 -6.534 9.217 2.372 436 HG22 THR 56 1HG2 THR 56 -5.056 9.042 1.427 437 HG23 THR 56 2HG2 THR 56 -5.073 8.583 3.130 438 H LEU 57 H LEU 57 -5.313 4.032 3.246 439 HA LEU 57 HA LEU 57 -4.983 2.129 1.275 440 HB2 LEU 57 2HB LEU 57 -6.425 2.239 3.858 441 HB3 LEU 57 3HB LEU 57 -6.839 0.915 2.772 442 HG LEU 57 HG LEU 57 -3.958 1.349 3.295 443 HD11 LEU 57 1HD1 LEU 57 -3.912 0.562 5.456 444 HD12 LEU 57 2HD1 LEU 57 -5.528 -0.134 5.354 445 HD13 LEU 57 3HD1 LEU 57 -5.328 1.612 5.496 446 HD21 LEU 57 3HD2 LEU 57 -4.157 -1.190 3.478 447 HD22 LEU 57 1HD2 LEU 57 -4.471 -0.464 1.901 448 HD23 LEU 57 2HD2 LEU 57 -5.817 -0.979 2.918 449 H ASP 58 H ASP 58 -7.746 4.157 1.945 450 HA ASP 58 HA ASP 58 -9.670 2.741 0.446 451 HB2 ASP 58 2HB ASP 58 -9.544 5.720 0.963 452 HB3 ASP 58 3HB ASP 58 -10.973 4.799 0.500 453 H GLN 59 H GLN 59 -7.571 5.478 -0.422 454 HA GLN 59 HA GLN 59 -8.465 5.660 -3.101 455 HB2 GLN 59 2HB GLN 59 -5.979 6.631 -1.703 456 HB3 GLN 59 3HB GLN 59 -6.269 6.925 -3.413 457 HG2 GLN 59 2HG GLN 59 -8.143 7.770 -1.218 458 HG3 GLN 59 3HG GLN 59 -6.897 8.805 -1.914 459 HE21 GLN 59 1HE2 GLN 59 -6.989 8.834 -4.401 460 HE22 GLN 59 2HE2 GLN 59 -8.560 9.067 -5.081 461 H LEU 60 H LEU 60 -5.450 4.316 -1.748 462 HA LEU 60 HA LEU 60 -4.361 3.313 -4.079 463 HB2 LEU 60 2HB LEU 60 -3.376 3.392 -1.727 464 HB3 LEU 60 3HB LEU 60 -4.206 1.862 -1.453 465 HG LEU 60 HG LEU 60 -2.757 1.486 -3.809 466 HD11 LEU 60 1HD1 LEU 60 -0.429 2.002 -2.888 467 HD12 LEU 60 2HD1 LEU 60 -1.246 3.133 -1.809 468 HD13 LEU 60 3HD1 LEU 60 -1.361 3.342 -3.557 469 HD21 LEU 60 3HD2 LEU 60 -1.993 0.683 -1.006 470 HD22 LEU 60 1HD2 LEU 60 -1.537 -0.123 -2.507 471 HD23 LEU 60 2HD2 LEU 60 -3.221 -0.126 -1.981 472 H ARG 61 H ARG 61 -6.769 1.853 -1.949 473 HA ARG 61 HA ARG 61 -6.852 -0.682 -3.165 474 HB2 ARG 61 2HB ARG 61 -7.837 -0.245 -0.969 475 HB3 ARG 61 3HB ARG 61 -9.030 0.819 -1.702 476 HG2 ARG 61 2HG ARG 61 -9.369 -1.511 -3.105 477 HG3 ARG 61 3HG ARG 61 -8.993 -2.083 -1.478 478 HD2 ARG 61 2HD ARG 61 -11.344 -1.840 -1.568 479 HD3 ARG 61 3HD ARG 61 -10.741 -0.468 -0.639 480 HE ARG 61 HE ARG 61 -11.512 0.934 -2.274 481 HH11 ARG 61 1HH1 ARG 61 -11.417 -2.319 -3.511 482 HH12 ARG 61 2HH1 ARG 61 -12.239 -1.922 -4.983 483 HH21 ARG 61 1HH2 ARG 61 -12.596 1.469 -4.209 484 HH22 ARG 61 2HH2 ARG 61 -12.908 0.232 -5.380 485 H LEU 62 H LEU 62 -8.798 2.239 -3.717 486 HA LEU 62 HA LEU 62 -10.430 1.122 -5.736 487 HB2 LEU 62 2HB LEU 62 -11.187 3.076 -4.633 488 HB3 LEU 62 3HB LEU 62 -9.708 3.952 -5.023 489 HG LEU 62 HG LEU 62 -10.396 3.889 -7.425 490 HD11 LEU 62 1HD1 LEU 62 -11.913 2.250 -7.807 491 HD12 LEU 62 2HD1 LEU 62 -13.040 3.571 -7.501 492 HD13 LEU 62 3HD1 LEU 62 -12.665 2.418 -6.220 493 HD21 LEU 62 3HD2 LEU 62 -11.192 5.576 -5.376 494 HD22 LEU 62 1HD2 LEU 62 -12.677 5.250 -6.270 495 HD23 LEU 62 2HD2 LEU 62 -11.272 5.911 -7.107 496 H VAL 63 H VAL 63 -7.213 2.361 -5.742 497 HA VAL 63 HA VAL 63 -7.035 3.000 -8.510 498 HB VAL 63 HB VAL 63 -4.838 2.290 -6.561 499 HG11 VAL 63 1HG1 VAL 63 -3.759 3.945 -8.461 500 HG12 VAL 63 2HG1 VAL 63 -3.574 2.191 -8.404 501 HG13 VAL 63 3HG1 VAL 63 -4.828 2.915 -9.412 502 HG21 VAL 63 3HG2 VAL 63 -4.931 4.376 -5.769 503 HG22 VAL 63 1HG2 VAL 63 -5.091 5.067 -7.384 504 HG23 VAL 63 2HG2 VAL 63 -6.518 4.478 -6.531 505 H ILE 64 H ILE 64 -5.597 0.285 -6.691 506 HA ILE 64 HA ILE 64 -4.753 -1.214 -8.856 507 HB ILE 64 HB ILE 64 -4.076 -1.803 -6.618 508 HG12 ILE 64 2HG1 ILE 64 -5.751 -4.079 -7.688 509 HG13 ILE 64 3HG1 ILE 64 -4.226 -3.576 -8.410 510 HG21 ILE 64 1HG2 ILE 64 -6.911 -2.689 -6.112 511 HG22 ILE 64 2HG2 ILE 64 -5.565 -2.733 -4.975 512 HG23 ILE 64 3HG2 ILE 64 -6.211 -1.184 -5.518 513 HD11 ILE 64 3HD1 ILE 64 -4.368 -5.532 -6.649 514 HD12 ILE 64 1HD1 ILE 64 -2.984 -4.442 -6.721 515 HD13 ILE 64 2HD1 ILE 64 -4.244 -4.189 -5.512 516 H CYS 65 H CYS 65 -7.922 -1.145 -7.299 517 HA CYS 65 HA CYS 65 -9.031 -3.298 -8.775 518 HB2 CYS 65 2HB CYS 65 -9.973 -2.483 -6.637 519 HB3 CYS 65 3HB CYS 65 -10.450 -0.988 -7.432 520 HG CYS 65 HG CYS 65 -11.638 -3.637 -9.034 521 H ASP 66 H ASP 66 -9.429 0.230 -9.098 522 HA ASP 66 HA ASP 66 -11.013 0.226 -11.381 523 HB2 ASP 66 2HB ASP 66 -10.504 2.216 -9.952 524 HB3 ASP 66 3HB ASP 66 -8.907 2.284 -10.693 525 H LEU 67 H LEU 67 -7.477 0.261 -11.102 526 HA LEU 67 HA LEU 67 -6.979 0.397 -13.889 527 HB2 LEU 67 2HB LEU 67 -5.259 1.059 -12.390 528 HB3 LEU 67 3HB LEU 67 -5.301 -0.494 -11.557 529 HG LEU 67 HG LEU 67 -4.646 -0.799 -14.365 530 HD11 LEU 67 1HD1 LEU 67 -3.180 1.232 -12.766 531 HD12 LEU 67 2HD1 LEU 67 -3.507 1.173 -14.497 532 HD13 LEU 67 3HD1 LEU 67 -2.250 0.149 -13.802 533 HD21 LEU 67 3HD2 LEU 67 -4.339 -2.345 -12.307 534 HD22 LEU 67 1HD2 LEU 67 -2.865 -1.414 -12.042 535 HD23 LEU 67 2HD2 LEU 67 -3.087 -2.303 -13.549 536 H GLN 68 H GLN 68 -6.658 -2.340 -11.620 537 HA GLN 68 HA GLN 68 -6.128 -4.318 -13.485 538 HB2 GLN 68 2HB GLN 68 -5.866 -4.794 -11.158 539 HB3 GLN 68 3HB GLN 68 -7.561 -4.456 -10.834 540 HG2 GLN 68 2HG GLN 68 -8.223 -6.421 -12.082 541 HG3 GLN 68 3HG GLN 68 -6.541 -6.743 -12.503 542 HE21 GLN 68 1HE2 GLN 68 -7.416 -8.827 -11.467 543 HE22 GLN 68 2HE2 GLN 68 -7.103 -9.005 -9.778 544 H GLU 69 H GLU 69 -9.132 -2.765 -12.693 545 HA GLU 69 HA GLU 69 -10.868 -4.716 -13.813 546 HB2 GLU 69 2HB GLU 69 -11.111 -1.917 -12.865 547 HB3 GLU 69 3HB GLU 69 -12.327 -2.464 -14.010 548 HG2 GLU 69 2HG GLU 69 -11.701 -4.149 -11.637 549 HG3 GLU 69 3HG GLU 69 -12.705 -2.714 -11.443 550 H ARG 70 H ARG 70 -9.960 -1.490 -15.045 551 HA ARG 70 HA ARG 70 -11.017 -1.862 -17.613 552 HB2 ARG 70 2HB ARG 70 -9.389 0.113 -16.245 553 HB3 ARG 70 3HB ARG 70 -8.882 -0.093 -17.916 554 HG2 ARG 70 2HG ARG 70 -10.962 0.563 -18.752 555 HG3 ARG 70 3HG ARG 70 -11.759 0.330 -17.195 556 HD2 ARG 70 2HD ARG 70 -9.906 2.172 -16.522 557 HD3 ARG 70 3HD ARG 70 -10.191 2.612 -18.205 558 HE ARG 70 HE ARG 70 -12.645 2.258 -16.836 559 HH11 ARG 70 1HH1 ARG 70 -9.974 4.467 -17.164 560 HH12 ARG 70 2HH1 ARG 70 -10.908 5.864 -16.746 561 HH21 ARG 70 1HH2 ARG 70 -13.886 4.091 -16.285 562 HH22 ARG 70 2HH2 ARG 70 -13.134 5.649 -16.245 563 H ARG 71 H ARG 71 -7.697 -2.265 -16.410 564 HA ARG 71 HA ARG 71 -6.458 -2.932 -18.803 565 HB2 ARG 71 2HB ARG 71 -5.905 -3.431 -15.932 566 HB3 ARG 71 3HB ARG 71 -5.051 -4.448 -17.084 567 HG2 ARG 71 2HG ARG 71 -3.759 -2.468 -16.433 568 HG3 ARG 71 3HG ARG 71 -4.110 -2.505 -18.163 569 HD2 ARG 71 2HD ARG 71 -6.110 -1.111 -16.529 570 HD3 ARG 71 3HD ARG 71 -4.514 -0.361 -16.537 571 HE ARG 71 HE ARG 71 -5.145 -0.934 -19.173 572 HH11 ARG 71 1HH1 ARG 71 -6.391 1.044 -16.594 573 HH12 ARG 71 2HH1 ARG 71 -7.042 2.248 -17.656 574 HH21 ARG 71 1HH2 ARG 71 -5.998 0.645 -20.582 575 HH22 ARG 71 2HH2 ARG 71 -6.819 2.020 -19.925 576 H GLU 72 H GLU 72 -8.112 -5.034 -16.472 577 HA GLU 72 HA GLU 72 -7.561 -7.487 -17.681 578 HB2 GLU 72 2HB GLU 72 -9.649 -6.469 -15.826 579 HB3 GLU 72 3HB GLU 72 -9.965 -8.002 -16.628 580 HG2 GLU 72 2HG GLU 72 -7.371 -7.540 -15.222 581 HG3 GLU 72 3HG GLU 72 -8.816 -7.987 -14.317 582 H LYS 73 H LYS 73 -10.346 -5.323 -18.138 583 HA LYS 73 HA LYS 73 -11.748 -6.854 -19.988 584 HB2 LYS 73 2HB LYS 73 -11.866 -4.196 -18.956 585 HB3 LYS 73 3HB LYS 73 -12.024 -4.112 -20.705 586 HG2 LYS 73 2HG LYS 73 -13.897 -5.631 -20.652 587 HG3 LYS 73 3HG LYS 73 -13.700 -5.857 -18.912 588 HD2 LYS 73 2HD LYS 73 -13.963 -3.060 -19.767 589 HD3 LYS 73 3HD LYS 73 -15.388 -4.059 -20.062 590 HE2 LYS 73 2HE LYS 73 -15.649 -3.113 -17.903 591 HE3 LYS 73 3HE LYS 73 -15.223 -4.807 -17.666 592 HZ1 LYS 73 3HZ LYS 73 -14.008 -3.309 -16.177 593 HZ2 LYS 73 1HZ LYS 73 -13.310 -2.541 -17.513 594 HZ3 LYS 73 2HZ LYS 73 -12.965 -4.166 -17.196 595 H PHE 74 H PHE 74 -9.036 -4.662 -20.445 596 HA PHE 74 HA PHE 74 -9.149 -4.769 -23.312 597 HB2 PHE 74 2HB PHE 74 -7.483 -3.453 -21.273 598 HB3 PHE 74 3HB PHE 74 -6.623 -3.895 -22.744 599 HD1 PHE 74 HD1 PHE 74 -9.669 -2.128 -21.555 600 HD2 PHE 74 HD2 PHE 74 -6.727 -2.523 -24.606 601 HE1 PHE 74 HE1 PHE 74 -10.563 -0.127 -22.672 602 HE2 PHE 74 HE2 PHE 74 -7.617 -0.522 -25.728 603 HZ PHE 74 HZ PHE 74 -9.537 0.679 -24.761 604 H GLY 75 H GLY 75 -7.660 -6.623 -20.790 605 HA2 GLY 75 2HA GLY 75 -7.167 -8.936 -21.947 606 HA3 GLY 75 3HA GLY 75 -5.884 -7.982 -22.676 607 H SER 76 H SER 76 -4.617 -9.742 -21.574 608 HA SER 76 HA SER 76 -3.979 -8.896 -18.825 609 HB2 SER 76 2HB SER 76 -3.165 -11.460 -18.770 610 HB3 SER 76 3HB SER 76 -4.792 -10.966 -18.302 611 HG SER 76 HG SER 76 -5.582 -11.741 -20.150 612 H SER 77 H SER 77 -1.770 -9.172 -18.176 613 HA SER 77 HA SER 77 0.259 -9.964 -20.000 614 HB2 SER 77 2HB SER 77 1.081 -7.971 -20.813 615 HB3 SER 77 3HB SER 77 -0.638 -7.580 -20.751 616 HG SER 77 HG SER 77 0.600 -5.944 -19.779 617 H LYS 78 H LYS 78 2.291 -10.058 -19.039 618 HA LYS 78 HA LYS 78 2.422 -10.444 -16.308 619 HB2 LYS 78 2HB LYS 78 4.415 -10.077 -18.472 620 HB3 LYS 78 3HB LYS 78 5.000 -9.858 -16.828 621 HG2 LYS 78 2HG LYS 78 4.649 -12.055 -16.263 622 HG3 LYS 78 3HG LYS 78 3.399 -12.283 -17.488 623 HD2 LYS 78 2HD LYS 78 5.340 -11.887 -19.169 624 HD3 LYS 78 3HD LYS 78 6.378 -12.276 -17.795 625 HE2 LYS 78 2HE LYS 78 6.097 -14.351 -18.749 626 HE3 LYS 78 3HE LYS 78 4.797 -14.341 -17.558 627 HZ1 LYS 78 3HZ LYS 78 4.020 -15.144 -19.694 628 HZ2 LYS 78 1HZ LYS 78 4.506 -13.709 -20.446 629 HZ3 LYS 78 2HZ LYS 78 3.257 -13.685 -19.306 630 H GLU 79 H GLU 79 2.944 -7.508 -18.159 631 HA GLU 79 HA GLU 79 4.119 -5.949 -16.139 632 HB2 GLU 79 2HB GLU 79 2.476 -5.227 -18.560 633 HB3 GLU 79 3HB GLU 79 3.146 -4.008 -17.484 634 HG2 GLU 79 2HG GLU 79 5.403 -5.050 -17.911 635 HG3 GLU 79 3HG GLU 79 4.629 -5.984 -19.190 636 H ILE 80 H ILE 80 0.715 -6.190 -17.161 637 HA ILE 80 HA ILE 80 -0.285 -4.479 -15.143 638 HB ILE 80 HB ILE 80 -1.759 -6.660 -16.625 639 HG12 ILE 80 2HG1 ILE 80 -1.541 -3.717 -17.290 640 HG13 ILE 80 3HG1 ILE 80 -0.622 -4.985 -18.093 641 HG21 ILE 80 1HG2 ILE 80 -3.587 -6.047 -15.525 642 HG22 ILE 80 2HG2 ILE 80 -2.571 -5.048 -14.487 643 HG23 ILE 80 3HG2 ILE 80 -3.318 -4.351 -15.924 644 HD11 ILE 80 3HD1 ILE 80 -3.533 -5.376 -18.035 645 HD12 ILE 80 1HD1 ILE 80 -2.958 -4.012 -18.994 646 HD13 ILE 80 2HD1 ILE 80 -2.372 -5.640 -19.335 647 H ASP 81 H ASP 81 -0.274 -8.031 -15.417 648 HA ASP 81 HA ASP 81 -1.505 -8.662 -13.028 649 HB2 ASP 81 2HB ASP 81 -0.657 -10.199 -14.939 650 HB3 ASP 81 3HB ASP 81 0.845 -10.253 -14.019 651 H MET 82 H MET 82 1.847 -7.761 -13.624 652 HA MET 82 HA MET 82 2.808 -8.363 -11.026 653 HB2 MET 82 2HB MET 82 3.806 -6.865 -13.387 654 HB3 MET 82 3HB MET 82 4.545 -6.486 -11.836 655 HG2 MET 82 2HG MET 82 4.379 -9.319 -12.124 656 HG3 MET 82 3HG MET 82 5.118 -8.628 -13.567 657 HE1 MET 82 3HE MET 82 8.479 -7.366 -12.504 658 HE2 MET 82 1HE MET 82 7.534 -8.174 -13.755 659 HE3 MET 82 2HE MET 82 7.056 -6.575 -13.184 660 H ALA 83 H ALA 83 1.680 -5.356 -12.541 661 HA ALA 83 HA ALA 83 2.161 -3.609 -10.432 662 HB1 ALA 83 1HB ALA 83 -0.329 -3.142 -11.932 663 HB2 ALA 83 2HB ALA 83 1.057 -2.083 -11.668 664 HB3 ALA 83 3HB ALA 83 1.127 -3.336 -12.908 665 H ILE 84 H ILE 84 -0.475 -5.868 -10.944 666 HA ILE 84 HA ILE 84 -2.144 -4.877 -8.862 667 HB ILE 84 HB ILE 84 -2.099 -7.629 -10.108 668 HG12 ILE 84 2HG1 ILE 84 -3.922 -5.309 -10.757 669 HG13 ILE 84 3HG1 ILE 84 -2.456 -5.664 -11.666 670 HG21 ILE 84 1HG2 ILE 84 -3.252 -7.573 -7.953 671 HG22 ILE 84 2HG2 ILE 84 -4.254 -6.239 -8.522 672 HG23 ILE 84 3HG2 ILE 84 -4.385 -7.825 -9.281 673 HD11 ILE 84 3HD1 ILE 84 -3.327 -7.753 -12.394 674 HD12 ILE 84 1HD1 ILE 84 -4.711 -7.617 -11.309 675 HD13 ILE 84 2HD1 ILE 84 -4.557 -6.523 -12.684 676 H VAL 85 H VAL 85 -0.161 -7.840 -9.059 677 HA VAL 85 HA VAL 85 -0.445 -8.613 -6.395 678 HB VAL 85 HB VAL 85 1.669 -9.897 -6.724 679 HG11 VAL 85 1HG1 VAL 85 0.570 -11.497 -7.874 680 HG12 VAL 85 2HG1 VAL 85 -0.785 -10.376 -7.730 681 HG13 VAL 85 3HG1 VAL 85 0.175 -10.416 -9.210 682 HG21 VAL 85 3HG2 VAL 85 2.647 -9.887 -9.015 683 HG22 VAL 85 1HG2 VAL 85 1.667 -8.466 -9.377 684 HG23 VAL 85 2HG2 VAL 85 2.904 -8.388 -8.122 685 H THR 86 H THR 86 1.865 -6.428 -7.913 686 HA THR 86 HA THR 86 3.620 -6.117 -5.747 687 HB THR 86 HB THR 86 4.149 -3.873 -6.805 688 HG1 THR 86 HG1 THR 86 2.460 -3.224 -7.961 689 HG21 THR 86 3HG2 THR 86 4.328 -6.519 -8.154 690 HG22 THR 86 1HG2 THR 86 5.610 -5.476 -7.541 691 HG23 THR 86 2HG2 THR 86 4.812 -5.089 -9.065 692 H LEU 87 H LEU 87 0.856 -4.095 -6.738 693 HA LEU 87 HA LEU 87 0.973 -2.262 -4.643 694 HB2 LEU 87 2HB LEU 87 -1.303 -3.267 -6.323 695 HB3 LEU 87 3HB LEU 87 -1.534 -2.034 -5.086 696 HG LEU 87 HG LEU 87 0.233 -1.800 -7.521 697 HD11 LEU 87 1HD1 LEU 87 -1.377 -0.397 -8.448 698 HD12 LEU 87 2HD1 LEU 87 -2.213 -0.181 -6.911 699 HD13 LEU 87 3HD1 LEU 87 -2.321 -1.720 -7.764 700 HD21 LEU 87 3HD2 LEU 87 1.292 -0.193 -6.413 701 HD22 LEU 87 1HD2 LEU 87 0.216 -0.371 -5.026 702 HD23 LEU 87 2HD2 LEU 87 -0.227 0.703 -6.354 703 H LYS 88 H LYS 88 -0.466 -5.460 -4.805 704 HA LYS 88 HA LYS 88 -1.864 -5.275 -2.325 705 HB2 LYS 88 2HB LYS 88 -1.341 -7.335 -4.355 706 HB3 LYS 88 3HB LYS 88 -1.489 -7.959 -2.718 707 HG2 LYS 88 2HG LYS 88 -3.693 -7.668 -2.699 708 HG3 LYS 88 3HG LYS 88 -3.568 -6.038 -3.365 709 HD2 LYS 88 2HD LYS 88 -3.283 -6.999 -5.612 710 HD3 LYS 88 3HD LYS 88 -3.459 -8.617 -4.930 711 HE2 LYS 88 2HE LYS 88 -5.712 -7.989 -4.128 712 HE3 LYS 88 3HE LYS 88 -5.528 -6.421 -4.912 713 HZ1 LYS 88 3HZ LYS 88 -4.953 -8.415 -6.789 714 HZ2 LYS 88 1HZ LYS 88 -6.241 -7.317 -6.788 715 HZ3 LYS 88 2HZ LYS 88 -6.413 -8.822 -6.037 716 H VAL 89 H VAL 89 0.960 -7.272 -3.210 717 HA VAL 89 HA VAL 89 1.696 -8.046 -0.665 718 HB VAL 89 HB VAL 89 3.633 -7.431 -2.898 719 HG11 VAL 89 1HG1 VAL 89 4.460 -7.939 -0.527 720 HG12 VAL 89 2HG1 VAL 89 3.881 -9.580 -0.819 721 HG13 VAL 89 3HG1 VAL 89 5.132 -8.889 -1.852 722 HG21 VAL 89 3HG2 VAL 89 3.003 -10.188 -2.776 723 HG22 VAL 89 1HG2 VAL 89 1.483 -9.296 -2.834 724 HG23 VAL 89 2HG2 VAL 89 2.697 -9.054 -4.091 725 H PHE 90 H PHE 90 2.554 -5.097 -2.414 726 HA PHE 90 HA PHE 90 4.385 -4.124 -0.479 727 HB2 PHE 90 2HB PHE 90 4.518 -3.243 -2.697 728 HB3 PHE 90 3HB PHE 90 2.827 -2.753 -2.672 729 HD1 PHE 90 HD2 PHE 90 5.535 -2.244 -0.170 730 HD2 PHE 90 HD1 PHE 90 2.803 -0.458 -2.901 731 HE1 PHE 90 HE2 PHE 90 6.198 -0.014 0.631 732 HE2 PHE 90 HE1 PHE 90 3.462 1.775 -2.106 733 HZ PHE 90 HZ PHE 90 5.161 2.000 -0.337 734 H ALA 91 H ALA 91 0.919 -3.773 -0.940 735 HA ALA 91 HA ALA 91 0.499 -1.711 0.943 736 HB1 ALA 91 1HB ALA 91 -1.218 -3.698 -0.444 737 HB2 ALA 91 2HB ALA 91 -1.875 -2.884 0.977 738 HB3 ALA 91 3HB ALA 91 -1.324 -1.937 -0.405 739 H VAL 92 H VAL 92 0.258 -5.249 1.218 740 HA VAL 92 HA VAL 92 -0.383 -5.173 4.009 741 HB VAL 92 HB VAL 92 0.645 -7.535 2.435 742 HG11 VAL 92 1HG1 VAL 92 -0.901 -7.272 5.006 743 HG12 VAL 92 2HG1 VAL 92 -0.719 -8.792 4.127 744 HG13 VAL 92 3HG1 VAL 92 0.701 -7.970 4.775 745 HG21 VAL 92 3HG2 VAL 92 -2.102 -6.346 2.632 746 HG22 VAL 92 1HG2 VAL 92 -1.212 -6.853 1.196 747 HG23 VAL 92 2HG2 VAL 92 -1.867 -8.062 2.300 748 H ALA 93 H ALA 93 2.480 -6.367 2.241 749 HA ALA 93 HA ALA 93 4.090 -6.744 4.506 750 HB1 ALA 93 1HB ALA 93 4.552 -7.729 2.295 751 HB2 ALA 93 2HB ALA 93 4.999 -6.131 1.697 752 HB3 ALA 93 3HB ALA 93 5.951 -6.894 2.970 753 H GLY 94 H GLY 94 3.108 -3.879 2.927 754 HA2 GLY 94 2HA GLY 94 5.337 -2.340 4.067 755 HA3 GLY 94 3HA GLY 94 4.202 -1.759 2.857 756 H LEU 95 H LEU 95 1.898 -1.563 3.620 757 HA LEU 95 HA LEU 95 1.749 0.194 5.781 758 HB2 LEU 95 2HB LEU 95 -0.567 -1.439 4.783 759 HB3 LEU 95 3HB LEU 95 -0.595 0.177 5.486 760 HG LEU 95 HG LEU 95 0.447 -0.583 2.759 761 HD11 LEU 95 1HD1 LEU 95 -1.641 1.429 2.968 762 HD12 LEU 95 2HD1 LEU 95 -2.141 -0.147 3.581 763 HD13 LEU 95 3HD1 LEU 95 -1.536 0.006 1.932 764 HD21 LEU 95 3HD2 LEU 95 1.796 1.189 3.106 765 HD22 LEU 95 1HD2 LEU 95 0.810 1.819 4.426 766 HD23 LEU 95 2HD2 LEU 95 0.333 2.109 2.753 767 H LEU 96 H LEU 96 0.965 -3.257 5.589 768 HA LEU 96 HA LEU 96 0.332 -3.342 8.425 769 HB2 LEU 96 2HB LEU 96 -0.194 -4.980 6.105 770 HB3 LEU 96 3HB LEU 96 0.429 -5.949 7.438 771 HG LEU 96 HG LEU 96 -1.927 -4.096 7.722 772 HD11 LEU 96 1HD1 LEU 96 -2.553 -5.678 6.048 773 HD12 LEU 96 2HD1 LEU 96 -3.299 -6.173 7.567 774 HD13 LEU 96 3HD1 LEU 96 -1.866 -7.013 6.974 775 HD21 LEU 96 3HD2 LEU 96 -0.367 -5.629 9.538 776 HD22 LEU 96 1HD2 LEU 96 -1.976 -6.346 9.442 777 HD23 LEU 96 2HD2 LEU 96 -1.793 -4.644 9.866 778 H ASN 97 H ASN 97 3.091 -3.456 6.586 779 HA ASN 97 HA ASN 97 5.224 -4.188 6.914 780 HB2 ASN 97 2HB ASN 97 4.436 -4.111 9.834 781 HB3 ASN 97 3HB ASN 97 6.068 -4.001 9.180 782 HD21 ASN 97 1HD2 ASN 97 6.865 -2.060 8.743 783 HD22 ASN 97 2HD2 ASN 97 5.961 -0.587 8.725 784 H MET 98 H MET 98 3.155 -6.223 6.570 785 HA MET 98 HA MET 98 4.400 -8.451 8.042 786 HB2 MET 98 2HB MET 98 1.591 -7.934 7.180 787 HB3 MET 98 3HB MET 98 2.152 -9.599 7.238 788 HG2 MET 98 2HG MET 98 2.544 -7.800 9.588 789 HG3 MET 98 3HG MET 98 0.983 -8.563 9.298 790 HE1 MET 98 3HE MET 98 1.536 -11.304 11.666 791 HE2 MET 98 1HE MET 98 1.856 -9.620 12.081 792 HE3 MET 98 2HE MET 98 0.533 -10.021 10.987 793 H THR 99 H THR 99 6.065 -8.716 6.511 794 HA THR 99 HA THR 99 5.702 -8.958 3.742 795 HB THR 99 HB THR 99 7.920 -8.629 4.543 796 HG1 THR 99 HG1 THR 99 8.981 -10.467 3.569 797 HG21 THR 99 3HG2 THR 99 8.703 -11.049 5.718 798 HG22 THR 99 1HG2 THR 99 7.171 -10.626 6.481 799 HG23 THR 99 2HG2 THR 99 8.517 -9.486 6.513 800 H VAL 100 H VAL 100 4.346 -10.359 2.822 801 HA VAL 100 HA VAL 100 3.584 -12.836 3.974 802 HB VAL 100 HB VAL 100 2.556 -13.288 1.724 803 HG11 VAL 100 1HG1 VAL 100 1.542 -10.622 2.263 804 HG12 VAL 100 2HG1 VAL 100 0.755 -12.191 2.450 805 HG13 VAL 100 3HG1 VAL 100 1.784 -11.560 3.737 806 HG21 VAL 100 3HG2 VAL 100 3.092 -10.483 0.928 807 HG22 VAL 100 1HG2 VAL 100 4.391 -11.654 0.698 808 HG23 VAL 100 2HG2 VAL 100 2.823 -11.912 -0.069 809 H SER 101 H SER 101 3.644 -14.811 2.268 810 HA SER 101 HA SER 101 6.486 -15.418 2.006 811 HB2 SER 101 2HB SER 101 4.929 -17.655 1.250 812 HB3 SER 101 3HB SER 101 5.821 -17.421 2.754 813 HG SER 101 HG SER 101 4.017 -16.782 3.749 814 H THR 102 H THR 102 3.536 -15.366 0.049 815 HA THR 102 HA THR 102 5.218 -15.177 -2.350 816 HB THR 102 HB THR 102 3.919 -16.721 -3.592 817 HG1 THR 102 HG1 THR 102 2.190 -16.968 -1.338 818 HG21 THR 102 3HG2 THR 102 5.518 -17.583 -1.698 819 HG22 THR 102 1HG2 THR 102 4.512 -18.716 -2.600 820 HG23 THR 102 2HG2 THR 102 4.019 -18.185 -0.992 821 H ALA 103 H ALA 103 3.993 -14.356 -4.252 822 HA ALA 103 HA ALA 103 2.727 -11.941 -3.694 823 HB1 ALA 103 1HB ALA 103 3.836 -12.775 -5.869 824 HB2 ALA 103 2HB ALA 103 2.237 -13.408 -6.259 825 HB3 ALA 103 3HB ALA 103 2.459 -11.679 -5.986 826 H ALA 104 H ALA 104 1.349 -15.111 -4.445 827 HA ALA 104 HA ALA 104 -1.342 -14.288 -4.622 828 HB1 ALA 104 1HB ALA 104 -0.124 -16.566 -5.210 829 HB2 ALA 104 2HB ALA 104 -0.714 -17.006 -3.606 830 HB3 ALA 104 3HB ALA 104 -1.851 -16.496 -4.855 831 H ALA 105 H ALA 105 0.565 -15.557 -1.909 832 HA ALA 105 HA ALA 105 -1.444 -15.721 0.001 833 HB1 ALA 105 1HB ALA 105 0.381 -15.441 1.670 834 HB2 ALA 105 2HB ALA 105 0.724 -16.649 0.431 835 HB3 ALA 105 3HB ALA 105 1.476 -15.057 0.342 836 H ALA 106 H ALA 106 0.569 -12.950 -0.910 837 HA ALA 106 HA ALA 106 -0.342 -11.169 1.060 838 HB1 ALA 106 1HB ALA 106 0.242 -9.676 -1.259 839 HB2 ALA 106 2HB ALA 106 1.278 -9.968 0.138 840 HB3 ALA 106 3HB ALA 106 1.337 -11.059 -1.246 841 H GLU 107 H GLU 107 -1.378 -11.517 -2.336 842 HA GLU 107 HA GLU 107 -3.421 -9.619 -2.276 843 HB2 GLU 107 2HB GLU 107 -2.666 -10.478 -4.380 844 HB3 GLU 107 3HB GLU 107 -3.096 -12.122 -3.930 845 HG2 GLU 107 2HG GLU 107 -5.387 -11.708 -4.150 846 HG3 GLU 107 3HG GLU 107 -5.159 -9.960 -4.136 847 H ASN 108 H ASN 108 -3.571 -13.121 -1.682 848 HA ASN 108 HA ASN 108 -6.316 -13.326 -1.250 849 HB2 ASN 108 2HB ASN 108 -4.577 -15.198 -1.463 850 HB3 ASN 108 3HB ASN 108 -4.277 -14.958 0.256 851 HD21 ASN 108 1HD2 ASN 108 -5.071 -17.375 -0.471 852 HD22 ASN 108 2HD2 ASN 108 -6.716 -17.663 -0.030 853 H MET 109 H MET 109 -3.700 -12.701 1.070 854 HA MET 109 HA MET 109 -5.339 -12.576 3.360 855 HB2 MET 109 2HB MET 109 -2.765 -12.761 3.176 856 HB3 MET 109 3HB MET 109 -2.793 -11.006 3.065 857 HG2 MET 109 2HG MET 109 -4.247 -11.195 5.230 858 HG3 MET 109 3HG MET 109 -3.473 -12.773 5.359 859 HE1 MET 109 3HE MET 109 -2.987 -8.875 5.765 860 HE2 MET 109 1HE MET 109 -3.487 -9.926 7.090 861 HE3 MET 109 2HE MET 109 -1.912 -9.134 7.139 862 H TYR 110 H TYR 110 -4.510 -10.231 0.909 863 HA TYR 110 HA TYR 110 -5.324 -7.911 2.310 864 HB2 TYR 110 2HB TYR 110 -3.908 -8.032 0.193 865 HB3 TYR 110 3HB TYR 110 -5.416 -8.262 -0.685 866 HD1 TYR 110 HD2 TYR 110 -4.200 -5.967 2.013 867 HD2 TYR 110 HD1 TYR 110 -6.173 -6.363 -1.735 868 HE1 TYR 110 HE2 TYR 110 -4.515 -3.530 1.929 869 HE2 TYR 110 HE1 TYR 110 -6.493 -3.926 -1.831 870 HH TYR 110 HH TYR 110 -5.858 -1.948 -0.915 871 H SER 111 H SER 111 -7.015 -10.161 0.180 872 HA SER 111 HA SER 111 -9.466 -8.650 0.238 873 HB2 SER 111 2HB SER 111 -8.535 -10.342 -1.579 874 HB3 SER 111 3HB SER 111 -9.404 -11.519 -0.594 875 HG SER 111 HG SER 111 -11.294 -10.399 -0.952 876 H GLN 112 H GLN 112 -8.311 -11.692 1.659 877 HA GLN 112 HA GLN 112 -10.655 -12.411 2.993 878 HB2 GLN 112 2HB GLN 112 -8.470 -13.741 2.660 879 HB3 GLN 112 3HB GLN 112 -7.918 -12.934 4.122 880 HG2 GLN 112 2HG GLN 112 -9.878 -13.847 5.318 881 HG3 GLN 112 3HG GLN 112 -10.317 -14.730 3.857 882 HE21 GLN 112 1HE2 GLN 112 -9.108 -16.500 3.231 883 HE22 GLN 112 2HE2 GLN 112 -7.961 -17.260 4.277 884 H MET 113 H MET 113 -8.103 -10.172 3.875 885 HA MET 113 HA MET 113 -8.864 -9.830 6.583 886 HB2 MET 113 2HB MET 113 -7.124 -8.372 4.654 887 HB3 MET 113 3HB MET 113 -7.632 -7.520 6.106 888 HG2 MET 113 2HG MET 113 -6.272 -10.201 6.122 889 HG3 MET 113 3HG MET 113 -5.429 -8.662 6.279 890 HE1 MET 113 3HE MET 113 -7.578 -11.383 8.029 891 HE2 MET 113 1HE MET 113 -5.825 -11.412 8.225 892 HE3 MET 113 2HE MET 113 -6.864 -11.117 9.620 893 H GLY 114 H GLY 114 -10.045 -8.538 3.589 894 HA2 GLY 114 2HA GLY 114 -12.293 -7.654 3.530 895 HA3 GLY 114 3HA GLY 114 -12.009 -6.957 5.118 896 H LEU 115 H LEU 115 -9.465 -6.710 2.817 897 HA LEU 115 HA LEU 115 -10.007 -3.836 2.577 898 HB2 LEU 115 2HB LEU 115 -7.440 -5.280 1.963 899 HB3 LEU 115 3HB LEU 115 -7.678 -3.543 2.134 900 HG LEU 115 HG LEU 115 -8.077 -5.455 4.421 901 HD11 LEU 115 1HD1 LEU 115 -5.823 -4.903 5.153 902 HD12 LEU 115 2HD1 LEU 115 -5.560 -3.970 3.681 903 HD13 LEU 115 3HD1 LEU 115 -5.794 -5.715 3.588 904 HD21 LEU 115 3HD2 LEU 115 -8.208 -2.561 4.015 905 HD22 LEU 115 1HD2 LEU 115 -7.236 -3.052 5.403 906 HD23 LEU 115 2HD2 LEU 115 -8.919 -3.566 5.279 907 H ASP 116 H ASP 116 -9.612 -6.765 0.751 908 HA ASP 116 HA ASP 116 -9.857 -5.244 -1.757 909 HB2 ASP 116 2HB ASP 116 -8.029 -7.188 -1.113 910 HB3 ASP 116 3HB ASP 116 -9.258 -8.110 -1.976 911 H THR 117 H THR 117 -10.975 -6.740 -3.506 912 HA THR 117 HA THR 117 -13.367 -7.975 -2.327 913 HB THR 117 HB THR 117 -14.670 -6.930 -4.269 914 HG1 THR 117 HG1 THR 117 -12.501 -6.133 -5.153 915 HG21 THR 117 3HG2 THR 117 -15.496 -5.595 -2.686 916 HG22 THR 117 1HG2 THR 117 -14.041 -4.600 -2.695 917 HG23 THR 117 2HG2 THR 117 -14.122 -6.033 -1.671 918 H ARG 118 H ARG 118 -11.038 -9.235 -3.409 919 HA ARG 118 HA ARG 118 -12.325 -10.799 -5.506 920 HB2 ARG 118 2HB ARG 118 -9.889 -9.143 -5.860 921 HB3 ARG 118 3HB ARG 118 -9.851 -10.758 -6.555 922 HG2 ARG 118 2HG ARG 118 -12.329 -9.447 -7.192 923 HG3 ARG 118 3HG ARG 118 -10.951 -8.453 -7.671 924 HD2 ARG 118 2HD ARG 118 -11.114 -9.736 -9.539 925 HD3 ARG 118 3HD ARG 118 -10.079 -10.792 -8.579 926 HE ARG 118 HE ARG 118 -11.760 -12.325 -8.582 927 HH11 ARG 118 1HH1 ARG 118 -13.136 -9.183 -9.181 928 HH12 ARG 118 2HH1 ARG 118 -14.739 -9.789 -9.435 929 HH21 ARG 118 1HH2 ARG 118 -13.867 -13.135 -8.914 930 HH22 ARG 118 2HH2 ARG 118 -15.154 -12.037 -9.282 931 HA PRO 119 HA PRO 119 -10.105 -13.287 -2.261 932 HB2 PRO 119 2HB PRO 119 -12.193 -14.950 -1.765 933 HB3 PRO 119 3HB PRO 119 -11.981 -13.401 -0.939 934 HG2 PRO 119 2HG PRO 119 -13.739 -14.082 -3.265 935 HG3 PRO 119 3HG PRO 119 -14.103 -13.093 -1.839 936 HD2 PRO 119 2HD PRO 119 -13.462 -12.011 -4.237 937 HD3 PRO 119 3HD PRO 119 -13.035 -11.239 -2.696 938 H SER 120 H SER 120 -8.812 -14.824 -3.032 939 HA SER 120 HA SER 120 -9.659 -16.379 -5.359 940 HB2 SER 120 2HB SER 120 -7.404 -16.723 -5.841 941 HB3 SER 120 3HB SER 120 -7.386 -15.116 -5.116 942 HG SER 120 HG SER 120 -6.077 -15.910 -3.694 943 H MET 121 H MET 121 -8.560 -18.692 -5.325 944 HA MET 121 HA MET 121 -9.463 -19.973 -2.835 945 HB2 MET 121 2HB MET 121 -10.175 -20.462 -5.499 946 HB3 MET 121 3HB MET 121 -9.117 -21.795 -5.056 947 HG2 MET 121 2HG MET 121 -10.609 -21.947 -2.945 948 HG3 MET 121 3HG MET 121 -11.755 -21.013 -3.903 949 HE1 MET 121 3HE MET 121 -10.369 -25.291 -4.393 950 HE2 MET 121 1HE MET 121 -9.385 -24.197 -5.365 951 HE3 MET 121 2HE MET 121 -9.516 -23.952 -3.624 952 H LYS 122 H LYS 122 -8.374 -22.427 -3.014 953 HA LYS 122 HA LYS 122 -6.496 -23.635 -2.582 954 HB2 LYS 122 2HB LYS 122 -5.992 -22.321 -4.960 955 HB3 LYS 122 3HB LYS 122 -4.589 -21.915 -3.980 956 HG2 LYS 122 2HG LYS 122 -3.900 -23.841 -5.025 957 HG3 LYS 122 3HG LYS 122 -4.517 -24.465 -3.493 958 HD2 LYS 122 2HD LYS 122 -6.561 -25.156 -4.515 959 HD3 LYS 122 3HD LYS 122 -6.161 -24.317 -6.015 960 HE2 LYS 122 2HE LYS 122 -4.283 -26.397 -5.018 961 HE3 LYS 122 3HE LYS 122 -5.805 -26.925 -5.734 962 HZ1 LYS 122 3HZ LYS 122 -3.671 -26.533 -7.187 963 HZ2 LYS 122 1HZ LYS 122 -4.226 -24.935 -7.184 964 HZ3 LYS 122 2HZ LYS 122 -5.213 -26.172 -7.781 965 H GLU 123 H GLU 123 -4.182 -23.424 -1.675 966 HA GLU 123 HA GLU 123 -3.411 -21.012 -0.402 967 HB2 GLU 123 2HB GLU 123 -3.816 -21.711 1.940 968 HB3 GLU 123 3HB GLU 123 -5.302 -21.427 1.044 969 HG2 GLU 123 2HG GLU 123 -4.921 -24.087 0.632 970 HG3 GLU 123 3HG GLU 123 -4.270 -23.880 2.257 971 H ALA 124 H ALA 124 -1.779 -21.622 1.490 972 HA ALA 124 HA ALA 124 0.257 -22.510 1.986 973 HB1 ALA 124 1HB ALA 124 -1.300 -24.918 1.142 974 HB2 ALA 124 2HB ALA 124 0.413 -25.062 1.537 975 HB3 ALA 124 3HB ALA 124 -0.722 -24.461 2.745 976 H GLY 125 H GLY 125 1.554 -21.392 0.560 977 HA2 GLY 125 2HA GLY 125 2.052 -22.668 -2.052 978 HA3 GLY 125 3HA GLY 125 2.341 -20.972 -1.693 979 H GLY 126 H GLY 126 3.244 -23.469 0.565 980 HA2 GLY 126 2HA GLY 126 5.292 -24.137 1.356 981 HA3 GLY 126 3HA GLY 126 5.847 -24.003 -0.306 982 H LYS 127 H LYS 127 7.808 -23.432 1.142 983 HA LYS 127 HA LYS 127 8.162 -20.581 0.938 984 HB2 LYS 127 2HB LYS 127 7.177 -21.339 3.319 985 HB3 LYS 127 3HB LYS 127 8.888 -21.609 3.627 986 HG2 LYS 127 2HG LYS 127 8.557 -19.067 2.372 987 HG3 LYS 127 3HG LYS 127 7.457 -19.189 3.746 988 HD2 LYS 127 2HD LYS 127 10.261 -20.105 4.115 989 HD3 LYS 127 3HD LYS 127 9.961 -18.367 4.025 990 HE2 LYS 127 2HE LYS 127 8.797 -18.329 5.986 991 HE3 LYS 127 3HE LYS 127 8.204 -19.978 5.793 992 HZ1 LYS 127 3HZ LYS 127 10.982 -19.229 6.532 993 HZ2 LYS 127 1HZ LYS 127 10.388 -20.806 6.377 994 HZ3 LYS 127 2HZ LYS 127 9.802 -19.799 7.602 995 H GLU 128 H GLU 128 10.036 -20.452 -0.094 996 HA GLU 128 HA GLU 128 12.265 -22.134 0.833 997 HB2 GLU 128 2HB GLU 128 11.010 -22.171 -1.741 998 HB3 GLU 128 3HB GLU 128 12.652 -21.571 -1.918 999 HG2 GLU 128 2HG GLU 128 13.570 -23.538 -0.976 1000 HG3 GLU 128 3HG GLU 128 11.987 -24.100 -0.442 1001 H GLU 129 H GLU 129 14.147 -21.098 1.162 1002 HA GLU 129 HA GLU 129 14.271 -18.258 0.394 1003 HB2 GLU 129 2HB GLU 129 15.065 -19.727 2.840 1004 HB3 GLU 129 3HB GLU 129 16.150 -18.446 2.318 1005 HG2 GLU 129 2HG GLU 129 14.355 -17.822 3.988 1006 HG3 GLU 129 3HG GLU 129 14.508 -16.798 2.562 1007 H GLY 130 H GLY 130 16.032 -17.476 -0.673 1008 HA2 GLY 130 2HA GLY 130 18.511 -18.858 -0.874 1009 HA3 GLY 130 3HA GLY 130 17.532 -19.134 -2.307 1010 HA PRO 131 HA PRO 131 18.433 -14.375 -2.137 1011 HB2 PRO 131 2HB PRO 131 20.317 -13.580 -0.352 1012 HB3 PRO 131 3HB PRO 131 18.594 -13.648 0.037 1013 HG2 PRO 131 2HG PRO 131 20.759 -15.616 0.673 1014 HG3 PRO 131 3HG PRO 131 19.441 -15.030 1.705 1015 HD2 PRO 131 2HD PRO 131 19.350 -17.424 0.444 1016 HD3 PRO 131 3HD PRO 131 17.896 -16.453 0.756 1017 HA PRO 132 HA PRO 132 22.046 -14.551 -4.637 1018 HB2 PRO 132 2HB PRO 132 22.898 -11.973 -4.644 1019 HB3 PRO 132 3HB PRO 132 21.445 -12.507 -5.498 1020 HG2 PRO 132 2HG PRO 132 21.690 -11.165 -2.833 1021 HG3 PRO 132 3HG PRO 132 20.533 -10.855 -4.140 1022 HD2 PRO 132 2HD PRO 132 19.901 -12.318 -1.952 1023 HD3 PRO 132 3HD PRO 132 19.196 -12.637 -3.549 1024 H GLN 133 H GLN 133 24.427 -13.701 -4.707 1025 HA GLN 133 HA GLN 133 25.589 -14.252 -2.068 1026 HB2 GLN 133 2HB GLN 133 26.372 -14.883 -4.846 1027 HB3 GLN 133 3HB GLN 133 27.690 -14.441 -3.769 1028 HG2 GLN 133 2HG GLN 133 27.662 -16.680 -3.423 1029 HG3 GLN 133 3HG GLN 133 26.512 -16.186 -2.182 1030 HE21 GLN 133 1HE2 GLN 133 26.980 -18.566 -4.156 1031 HE22 GLN 133 2HE2 GLN 133 25.376 -18.922 -4.690 1032 H ALA 134 H ALA 134 27.268 -12.987 -1.242 1033 HA ALA 134 HA ALA 134 27.097 -10.209 -1.846 1034 HB1 ALA 134 1HB ALA 134 29.226 -10.286 -0.242 1035 HB2 ALA 134 2HB ALA 134 27.575 -10.443 0.359 1036 HB3 ALA 134 3HB ALA 134 28.562 -11.883 0.107 1037 H TYR 135 H TYR 135 29.414 -12.753 -2.581 1038 HA TYR 135 HA TYR 135 30.553 -11.127 -4.684 1039 HB2 TYR 135 2HB TYR 135 31.799 -10.714 -2.415 1040 HB3 TYR 135 3HB TYR 135 32.525 -12.283 -2.746 1041 HD1 TYR 135 HD1 TYR 135 34.040 -12.580 -4.637 1042 HD2 TYR 135 HD2 TYR 135 32.344 -8.778 -3.759 1043 HE1 TYR 135 HE1 TYR 135 35.695 -11.508 -6.107 1044 HE2 TYR 135 HE2 TYR 135 33.994 -7.696 -5.227 1045 HH TYR 135 HH TYR 135 36.502 -9.589 -6.881 Start of MODEL 18 1 H21 MYR 1 1H2 MYR 1 1.524 11.478 0.964 2 H22 MYR 1 2H2 MYR 1 2.237 11.931 2.499 3 H31 MYR 1 1H3 MYR 1 3.742 10.223 1.783 4 H32 MYR 1 2H3 MYR 1 4.586 11.664 1.213 5 H41 MYR 1 1H4 MYR 1 4.619 10.180 -0.676 6 H42 MYR 1 2H4 MYR 1 3.356 11.347 -1.072 7 H51 MYR 1 1H5 MYR 1 2.115 9.435 -1.522 8 H52 MYR 1 2H5 MYR 1 1.780 9.499 0.210 9 H61 MYR 1 1H6 MYR 1 2.961 7.565 0.629 10 H62 MYR 1 2H6 MYR 1 4.357 8.107 -0.304 11 H71 MYR 1 1H7 MYR 1 3.356 6.037 -1.301 12 H72 MYR 1 2H7 MYR 1 3.293 7.383 -2.440 13 H81 MYR 1 1H8 MYR 1 1.002 7.298 -2.554 14 H82 MYR 1 2H8 MYR 1 0.841 7.397 -0.798 15 H91 MYR 1 1H9 MYR 1 1.839 4.718 -1.585 16 H92 MYR 1 2H9 MYR 1 0.366 5.100 -2.475 17 H101 MYR 1 1H10 MYR 1 -0.521 5.912 -0.052 18 H102 MYR 1 2H10 MYR 1 0.750 4.869 0.564 19 H111 MYR 1 1H11 MYR 1 -1.045 3.643 -1.562 20 H112 MYR 1 2H11 MYR 1 -1.837 4.081 -0.056 21 H121 MYR 1 1H12 MYR 1 -1.160 1.767 0.191 22 H122 MYR 1 2H12 MYR 1 -0.112 2.713 1.248 23 H131 MYR 1 1H13 MYR 1 1.814 2.317 -0.035 24 H132 MYR 1 2H13 MYR 1 0.939 2.307 -1.568 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 0.628 13.796 1.464 29 HA2 GLY 2 2HA GLY 2 0.888 16.140 1.245 30 HA3 GLY 2 3HA GLY 2 2.474 15.873 0.536 31 H ASN 3 H ASN 3 1.066 17.651 -0.759 32 HA ASN 3 HA ASN 3 0.249 18.229 -2.800 33 HB2 ASN 3 2HB ASN 3 1.892 16.004 -3.246 34 HB3 ASN 3 3HB ASN 3 0.418 15.672 -4.150 35 HD21 ASN 3 1HD2 ASN 3 2.539 18.442 -3.485 36 HD22 ASN 3 2HD2 ASN 3 2.603 18.999 -5.119 37 H GLY 4 H GLY 4 -1.518 17.752 -4.399 38 HA2 GLY 4 2HA GLY 4 -3.707 16.358 -2.998 39 HA3 GLY 4 3HA GLY 4 -3.921 17.702 -4.109 40 H ALA 5 H ALA 5 -1.855 16.416 -5.917 41 HA ALA 5 HA ALA 5 -3.705 15.010 -7.561 42 HB1 ALA 5 1HB ALA 5 -0.722 15.372 -7.785 43 HB2 ALA 5 2HB ALA 5 -1.731 14.619 -9.021 44 HB3 ALA 5 3HB ALA 5 -1.976 16.312 -8.593 45 H SER 6 H SER 6 -3.748 12.834 -8.137 46 HA SER 6 HA SER 6 -2.380 11.031 -6.249 47 HB2 SER 6 2HB SER 6 -4.848 10.196 -7.723 48 HB3 SER 6 3HB SER 6 -4.257 9.676 -6.145 49 HG SER 6 HG SER 6 -5.961 11.013 -5.752 50 H ARG 7 H ARG 7 -0.977 11.810 -8.457 51 HA ARG 7 HA ARG 7 -1.316 10.128 -10.711 52 HB2 ARG 7 2HB ARG 7 0.307 12.292 -10.038 53 HB3 ARG 7 3HB ARG 7 1.432 10.961 -10.276 54 HG2 ARG 7 2HG ARG 7 1.114 10.926 -12.491 55 HG3 ARG 7 3HG ARG 7 -0.626 11.184 -12.346 56 HD2 ARG 7 2HD ARG 7 -0.033 13.165 -13.307 57 HD3 ARG 7 3HD ARG 7 0.157 13.598 -11.609 58 HE ARG 7 HE ARG 7 2.558 12.558 -12.778 59 HH11 ARG 7 1HH1 ARG 7 0.607 15.410 -12.357 60 HH12 ARG 7 2HH1 ARG 7 1.933 16.506 -12.565 61 HH21 ARG 7 1HH2 ARG 7 4.311 13.990 -13.054 62 HH22 ARG 7 2HH2 ARG 7 4.039 15.697 -12.962 63 H ASP 8 H ASP 8 1.076 10.021 -8.066 64 HA ASP 8 HA ASP 8 2.306 7.632 -8.773 65 HB2 ASP 8 2HB ASP 8 1.866 8.824 -6.028 66 HB3 ASP 8 3HB ASP 8 2.954 7.480 -6.363 67 H TRP 9 H TRP 9 -0.770 8.200 -7.287 68 HA TRP 9 HA TRP 9 -1.095 5.529 -6.277 69 HB2 TRP 9 2HB TRP 9 -2.280 7.292 -5.155 70 HB3 TRP 9 3HB TRP 9 -3.033 7.815 -6.659 71 HD1 TRP 9 HD1 TRP 9 -5.148 6.460 -7.514 72 HE1 TRP 9 HE1 TRP 9 -6.691 4.741 -6.378 73 HE3 TRP 9 HE3 TRP 9 -2.266 5.351 -3.440 74 HZ2 TRP 9 HZ2 TRP 9 -6.687 3.129 -4.061 75 HZ3 TRP 9 HZ3 TRP 9 -3.108 3.710 -1.811 76 HH2 TRP 9 HH2 TRP 9 -5.273 2.624 -2.116 77 H LYS 10 H LYS 10 -3.010 7.302 -8.708 78 HA LYS 10 HA LYS 10 -4.258 5.121 -9.849 79 HB2 LYS 10 2HB LYS 10 -4.085 7.869 -10.378 80 HB3 LYS 10 3HB LYS 10 -3.601 7.081 -11.874 81 HG2 LYS 10 2HG LYS 10 -5.659 6.143 -12.211 82 HG3 LYS 10 3HG LYS 10 -6.053 6.121 -10.491 83 HD2 LYS 10 2HD LYS 10 -5.681 8.792 -11.679 84 HD3 LYS 10 3HD LYS 10 -7.082 7.889 -12.259 85 HE2 LYS 10 2HE LYS 10 -6.547 8.046 -9.327 86 HE3 LYS 10 3HE LYS 10 -7.264 9.431 -10.148 87 HZ1 LYS 10 3HZ LYS 10 -9.217 8.421 -10.126 88 HZ2 LYS 10 1HZ LYS 10 -8.547 7.136 -9.252 89 HZ3 LYS 10 2HZ LYS 10 -8.591 7.078 -10.942 90 H MET 11 H MET 11 -1.029 6.351 -10.393 91 HA MET 11 HA MET 11 -0.507 4.821 -12.741 92 HB2 MET 11 2HB MET 11 1.253 6.275 -10.780 93 HB3 MET 11 3HB MET 11 1.925 5.344 -12.111 94 HG2 MET 11 2HG MET 11 -0.169 7.325 -12.772 95 HG3 MET 11 3HG MET 11 1.407 7.943 -12.282 96 HE1 MET 11 3HE MET 11 0.673 8.751 -15.411 97 HE2 MET 11 1HE MET 11 0.301 7.299 -16.341 98 HE3 MET 11 2HE MET 11 -0.625 7.676 -14.889 99 H ALA 12 H ALA 12 0.537 4.454 -9.351 100 HA ALA 12 HA ALA 12 1.927 2.083 -9.574 101 HB1 ALA 12 1HB ALA 12 1.365 1.717 -7.184 102 HB2 ALA 12 2HB ALA 12 1.953 3.343 -7.531 103 HB3 ALA 12 3HB ALA 12 0.229 3.062 -7.285 104 H ILE 13 H ILE 13 -1.541 2.601 -9.421 105 HA ILE 13 HA ILE 13 -2.234 -0.139 -9.041 106 HB ILE 13 HB ILE 13 -3.897 2.143 -10.115 107 HG12 ILE 13 2HG1 ILE 13 -3.046 2.457 -7.803 108 HG13 ILE 13 3HG1 ILE 13 -4.798 2.297 -7.865 109 HG21 ILE 13 1HG2 ILE 13 -5.302 0.510 -10.718 110 HG22 ILE 13 2HG2 ILE 13 -4.443 -0.705 -9.772 111 HG23 ILE 13 3HG2 ILE 13 -5.625 0.346 -8.992 112 HD11 ILE 13 3HD1 ILE 13 -3.080 0.913 -6.220 113 HD12 ILE 13 1HD1 ILE 13 -4.766 0.513 -6.548 114 HD13 ILE 13 2HD1 ILE 13 -3.480 -0.252 -7.482 115 H LYS 14 H LYS 14 -2.255 2.008 -11.880 116 HA LYS 14 HA LYS 14 -3.190 0.241 -13.782 117 HB2 LYS 14 2HB LYS 14 -2.840 2.586 -14.283 118 HB3 LYS 14 3HB LYS 14 -1.103 2.407 -14.073 119 HG2 LYS 14 2HG LYS 14 -1.933 0.522 -16.016 120 HG3 LYS 14 3HG LYS 14 -2.653 2.080 -16.425 121 HD2 LYS 14 2HD LYS 14 -0.445 3.132 -16.289 122 HD3 LYS 14 3HD LYS 14 0.273 1.572 -15.881 123 HE2 LYS 14 2HE LYS 14 0.169 0.821 -18.010 124 HE3 LYS 14 3HE LYS 14 -1.364 1.630 -18.332 125 HZ1 LYS 14 3HZ LYS 14 0.825 3.452 -17.963 126 HZ2 LYS 14 1HZ LYS 14 -0.326 3.383 -19.201 127 HZ3 LYS 14 2HZ LYS 14 1.054 2.408 -19.274 128 H ARG 15 H ARG 15 0.014 0.486 -12.379 129 HA ARG 15 HA ARG 15 1.096 -1.499 -14.207 130 HB2 ARG 15 2HB ARG 15 2.435 0.475 -13.437 131 HB3 ARG 15 3HB ARG 15 2.423 -0.211 -11.818 132 HG2 ARG 15 2HG ARG 15 4.058 -1.647 -12.297 133 HG3 ARG 15 3HG ARG 15 3.335 -2.091 -13.844 134 HD2 ARG 15 2HD ARG 15 4.170 0.358 -14.477 135 HD3 ARG 15 3HD ARG 15 5.338 0.000 -13.205 136 HE ARG 15 HE ARG 15 5.433 -2.203 -14.774 137 HH11 ARG 15 1HH1 ARG 15 5.710 1.209 -15.411 138 HH12 ARG 15 2HH1 ARG 15 6.772 1.002 -16.765 139 HH21 ARG 15 1HH2 ARG 15 6.830 -2.488 -16.554 140 HH22 ARG 15 2HH2 ARG 15 7.408 -1.101 -17.414 141 H CYS 16 H CYS 16 0.034 -1.225 -10.876 142 HA CYS 16 HA CYS 16 1.067 -3.649 -9.904 143 HB2 CYS 16 2HB CYS 16 -1.010 -1.719 -9.062 144 HB3 CYS 16 3HB CYS 16 -1.187 -3.350 -8.427 145 HG CYS 16 HG CYS 16 1.641 -1.453 -8.078 146 H SER 17 H SER 17 -1.925 -2.882 -11.600 147 HA SER 17 HA SER 17 -3.300 -5.269 -11.249 148 HB2 SER 17 2HB SER 17 -3.262 -3.459 -13.677 149 HB3 SER 17 3HB SER 17 -4.470 -4.704 -13.362 150 HG SER 17 HG SER 17 -4.310 -2.188 -12.389 151 H ASN 18 H ASN 18 -0.520 -4.570 -13.184 152 HA ASN 18 HA ASN 18 -0.637 -6.545 -15.125 153 HB2 ASN 18 2HB ASN 18 1.094 -4.760 -14.993 154 HB3 ASN 18 3HB ASN 18 1.845 -5.628 -13.657 155 HD21 ASN 18 1HD2 ASN 18 3.737 -5.659 -15.003 156 HD22 ASN 18 2HD2 ASN 18 3.898 -6.865 -16.229 157 H VAL 19 H VAL 19 -0.031 -6.811 -11.720 158 HA VAL 19 HA VAL 19 1.269 -9.294 -11.637 159 HB VAL 19 HB VAL 19 0.587 -9.449 -9.333 160 HG11 VAL 19 1HG1 VAL 19 0.867 -6.658 -9.044 161 HG12 VAL 19 2HG1 VAL 19 2.119 -7.896 -8.925 162 HG13 VAL 19 3HG1 VAL 19 1.786 -7.122 -10.475 163 HG21 VAL 19 3HG2 VAL 19 -1.645 -8.993 -9.135 164 HG22 VAL 19 1HG2 VAL 19 -0.978 -7.465 -8.559 165 HG23 VAL 19 2HG2 VAL 19 -1.570 -7.601 -10.215 166 H ALA 20 H ALA 20 0.518 -11.395 -11.367 167 HA ALA 20 HA ALA 20 -2.216 -11.841 -12.343 168 HB1 ALA 20 1HB ALA 20 -1.511 -13.785 -13.332 169 HB2 ALA 20 2HB ALA 20 -0.036 -12.822 -13.429 170 HB3 ALA 20 3HB ALA 20 -0.213 -14.038 -12.164 171 H VAL 21 H VAL 21 -3.568 -13.390 -11.351 172 HA VAL 21 HA VAL 21 -3.417 -13.423 -8.506 173 HB VAL 21 HB VAL 21 -5.467 -14.707 -8.559 174 HG11 VAL 21 1HG1 VAL 21 -5.279 -12.193 -9.322 175 HG12 VAL 21 2HG1 VAL 21 -5.859 -12.852 -10.853 176 HG13 VAL 21 3HG1 VAL 21 -6.816 -13.053 -9.384 177 HG21 VAL 21 3HG2 VAL 21 -6.311 -15.113 -11.062 178 HG22 VAL 21 1HG2 VAL 21 -4.577 -15.310 -11.316 179 HG23 VAL 21 2HG2 VAL 21 -5.419 -16.328 -10.147 180 H GLY 22 H GLY 22 -2.405 -15.591 -11.013 181 HA2 GLY 22 2HA GLY 22 -1.443 -17.449 -8.942 182 HA3 GLY 22 3HA GLY 22 -2.318 -18.074 -10.331 183 H VAL 23 H VAL 23 0.144 -19.056 -9.874 184 HA VAL 23 HA VAL 23 2.208 -17.608 -11.219 185 HB VAL 23 HB VAL 23 2.100 -20.562 -10.596 186 HG11 VAL 23 1HG1 VAL 23 4.482 -20.536 -10.809 187 HG12 VAL 23 2HG1 VAL 23 3.799 -19.817 -12.269 188 HG13 VAL 23 3HG1 VAL 23 4.497 -18.786 -11.020 189 HG21 VAL 23 3HG2 VAL 23 2.497 -18.212 -8.896 190 HG22 VAL 23 1HG2 VAL 23 2.073 -19.869 -8.464 191 HG23 VAL 23 2HG2 VAL 23 3.759 -19.434 -8.744 192 H GLY 24 H GLY 24 -0.192 -19.973 -12.166 193 HA2 GLY 24 2HA GLY 24 0.157 -19.362 -14.931 194 HA3 GLY 24 3HA GLY 24 0.833 -20.936 -14.539 195 H GLY 25 H GLY 25 -0.844 -21.591 -16.147 196 HA2 GLY 25 2HA GLY 25 -2.705 -22.994 -16.308 197 HA3 GLY 25 3HA GLY 25 -3.201 -22.482 -14.701 198 H LYS 26 H LYS 26 -4.565 -20.742 -14.460 199 HA LYS 26 HA LYS 26 -6.128 -20.060 -16.776 200 HB2 LYS 26 2HB LYS 26 -6.287 -19.259 -13.871 201 HB3 LYS 26 3HB LYS 26 -7.389 -18.633 -15.091 202 HG2 LYS 26 2HG LYS 26 -8.589 -20.517 -15.146 203 HG3 LYS 26 3HG LYS 26 -7.156 -21.547 -15.085 204 HD2 LYS 26 2HD LYS 26 -8.287 -21.991 -13.080 205 HD3 LYS 26 3HD LYS 26 -6.998 -20.874 -12.623 206 HE2 LYS 26 2HE LYS 26 -8.723 -19.023 -12.933 207 HE3 LYS 26 3HE LYS 26 -9.930 -20.307 -12.973 208 HZ1 LYS 26 3HZ LYS 26 -8.178 -20.623 -10.760 209 HZ2 LYS 26 1HZ LYS 26 -9.863 -20.473 -10.777 210 HZ3 LYS 26 2HZ LYS 26 -8.891 -19.089 -10.738 211 H SER 27 H SER 27 -6.710 -17.771 -17.246 212 HA SER 27 HA SER 27 -4.292 -16.099 -17.146 213 HB2 SER 27 2HB SER 27 -6.606 -16.080 -19.098 214 HB3 SER 27 3HB SER 27 -5.258 -14.942 -19.130 215 HG SER 27 HG SER 27 -4.708 -16.549 -20.520 216 H LYS 28 H LYS 28 -5.445 -15.852 -14.851 217 HA LYS 28 HA LYS 28 -7.205 -13.494 -15.008 218 HB2 LYS 28 2HB LYS 28 -7.054 -15.772 -13.077 219 HB3 LYS 28 3HB LYS 28 -7.618 -14.208 -12.505 220 HG2 LYS 28 2HG LYS 28 -9.452 -14.222 -14.006 221 HG3 LYS 28 3HG LYS 28 -8.809 -15.615 -14.880 222 HD2 LYS 28 2HD LYS 28 -9.698 -17.063 -13.424 223 HD3 LYS 28 3HD LYS 28 -9.155 -16.123 -12.032 224 HE2 LYS 28 2HE LYS 28 -11.058 -14.599 -12.343 225 HE3 LYS 28 3HE LYS 28 -11.603 -15.572 -13.708 226 HZ1 LYS 28 3HZ LYS 28 -11.778 -16.115 -10.855 227 HZ2 LYS 28 1HZ LYS 28 -11.432 -17.442 -11.845 228 HZ3 LYS 28 2HZ LYS 28 -12.837 -16.537 -12.105 229 H LYS 29 H LYS 29 -6.714 -11.676 -13.827 230 HA LYS 29 HA LYS 29 -4.209 -11.701 -12.290 231 HB2 LYS 29 2HB LYS 29 -3.785 -9.381 -13.280 232 HB3 LYS 29 3HB LYS 29 -3.491 -10.765 -14.325 233 HG2 LYS 29 2HG LYS 29 -5.561 -10.406 -15.481 234 HG3 LYS 29 3HG LYS 29 -6.021 -9.132 -14.348 235 HD2 LYS 29 2HD LYS 29 -4.252 -7.715 -15.124 236 HD3 LYS 29 3HD LYS 29 -3.574 -9.015 -16.107 237 HE2 LYS 29 2HE LYS 29 -5.113 -8.754 -17.751 238 HE3 LYS 29 3HE LYS 29 -6.395 -8.306 -16.628 239 HZ1 LYS 29 3HZ LYS 29 -5.531 -6.110 -16.474 240 HZ2 LYS 29 1HZ LYS 29 -5.652 -6.486 -18.119 241 HZ3 LYS 29 2HZ LYS 29 -4.144 -6.516 -17.355 242 H PHE 30 H PHE 30 -3.988 -9.424 -11.172 243 HA PHE 30 HA PHE 30 -6.506 -9.010 -9.740 244 HB2 PHE 30 2HB PHE 30 -3.625 -8.450 -9.084 245 HB3 PHE 30 3HB PHE 30 -4.923 -7.678 -8.179 246 HD1 PHE 30 HD2 PHE 30 -6.901 -9.695 -7.807 247 HD2 PHE 30 HD1 PHE 30 -2.663 -10.088 -7.804 248 HE1 PHE 30 HE2 PHE 30 -7.090 -11.690 -6.380 249 HE2 PHE 30 HE1 PHE 30 -2.845 -12.085 -6.378 250 HZ PHE 30 HZ PHE 30 -5.061 -12.887 -5.662 251 H GLY 31 H GLY 31 -6.456 -6.571 -8.772 252 HA2 GLY 31 2HA GLY 31 -5.608 -4.516 -10.531 253 HA3 GLY 31 3HA GLY 31 -7.289 -4.916 -10.847 254 H GLU 32 H GLU 32 -7.265 -2.507 -10.182 255 HA GLU 32 HA GLU 32 -6.876 -1.654 -7.579 256 HB2 GLU 32 2HB GLU 32 -8.236 0.220 -8.097 257 HB3 GLU 32 3HB GLU 32 -7.445 -0.241 -9.598 258 HG2 GLU 32 2HG GLU 32 -9.712 -1.665 -9.816 259 HG3 GLU 32 3HG GLU 32 -10.292 -0.304 -8.858 260 H GLY 33 H GLY 33 -9.458 -3.564 -8.920 261 HA2 GLY 33 2HA GLY 33 -11.382 -3.172 -6.888 262 HA3 GLY 33 3HA GLY 33 -11.302 -4.552 -7.974 263 H ASN 34 H ASN 34 -9.092 -5.867 -7.361 264 HA ASN 34 HA ASN 34 -9.713 -7.213 -4.988 265 HB2 ASN 34 2HB ASN 34 -8.044 -7.673 -7.129 266 HB3 ASN 34 3HB ASN 34 -6.906 -7.434 -5.806 267 HD21 ASN 34 1HD2 ASN 34 -7.482 -8.660 -3.774 268 HD22 ASN 34 2HD2 ASN 34 -8.019 -10.289 -3.983 269 H PHE 35 H PHE 35 -7.397 -4.643 -5.660 270 HA PHE 35 HA PHE 35 -6.071 -4.706 -3.168 271 HB2 PHE 35 2HB PHE 35 -6.430 -2.463 -5.163 272 HB3 PHE 35 3HB PHE 35 -5.363 -2.377 -3.765 273 HD1 PHE 35 HD2 PHE 35 -3.986 -4.851 -3.665 274 HD2 PHE 35 HD1 PHE 35 -5.207 -2.639 -7.090 275 HE1 PHE 35 HE2 PHE 35 -2.184 -5.894 -4.977 276 HE2 PHE 35 HE1 PHE 35 -3.408 -3.679 -8.408 277 HZ PHE 35 HZ PHE 35 -1.893 -5.307 -7.351 278 H ARG 36 H ARG 36 -8.554 -2.439 -4.363 279 HA ARG 36 HA ARG 36 -8.969 -1.062 -1.991 280 HB2 ARG 36 2HB ARG 36 -10.963 -1.697 -4.173 281 HB3 ARG 36 3HB ARG 36 -11.196 -0.486 -2.920 282 HG2 ARG 36 2HG ARG 36 -8.773 -0.325 -4.640 283 HG3 ARG 36 3HG ARG 36 -10.331 0.182 -5.295 284 HD2 ARG 36 2HD ARG 36 -9.692 1.199 -2.607 285 HD3 ARG 36 3HD ARG 36 -8.660 1.795 -3.907 286 HE ARG 36 HE ARG 36 -11.331 2.009 -4.719 287 HH11 ARG 36 1HH1 ARG 36 -9.138 3.390 -2.394 288 HH12 ARG 36 2HH1 ARG 36 -9.948 4.921 -2.345 289 HH21 ARG 36 1HH2 ARG 36 -12.406 4.020 -4.663 290 HH22 ARG 36 2HH2 ARG 36 -11.807 5.278 -3.635 291 H TRP 37 H TRP 37 -10.029 -4.222 -2.942 292 HA TRP 37 HA TRP 37 -12.148 -4.504 -1.075 293 HB2 TRP 37 2HB TRP 37 -12.069 -5.989 -2.958 294 HB3 TRP 37 3HB TRP 37 -10.451 -6.537 -2.529 295 HD1 TRP 37 HD1 TRP 37 -14.118 -6.920 -1.457 296 HE1 TRP 37 HE1 TRP 37 -14.330 -9.046 -0.023 297 HE3 TRP 37 HE3 TRP 37 -9.164 -8.109 -1.033 298 HZ2 TRP 37 HZ2 TRP 37 -12.622 -10.972 1.136 299 HZ3 TRP 37 HZ3 TRP 37 -8.538 -10.109 0.256 300 HH2 TRP 37 HH2 TRP 37 -10.232 -11.509 1.318 301 H ALA 38 H ALA 38 -8.868 -5.915 -1.048 302 HA ALA 38 HA ALA 38 -9.014 -6.805 1.627 303 HB1 ALA 38 1HB ALA 38 -6.408 -6.148 0.319 304 HB2 ALA 38 2HB ALA 38 -6.822 -7.493 1.383 305 HB3 ALA 38 3HB ALA 38 -7.393 -7.481 -0.286 306 H ILE 39 H ILE 39 -7.447 -3.952 0.185 307 HA ILE 39 HA ILE 39 -6.322 -2.847 2.446 308 HB ILE 39 HB ILE 39 -7.628 -1.360 0.164 309 HG12 ILE 39 2HG1 ILE 39 -4.688 -1.896 0.504 310 HG13 ILE 39 3HG1 ILE 39 -5.736 -3.075 -0.278 311 HG21 ILE 39 1HG2 ILE 39 -5.666 0.268 0.967 312 HG22 ILE 39 2HG2 ILE 39 -7.310 0.365 1.594 313 HG23 ILE 39 3HG2 ILE 39 -6.065 -0.480 2.513 314 HD11 ILE 39 3HD1 ILE 39 -5.236 -0.243 -1.159 315 HD12 ILE 39 1HD1 ILE 39 -4.670 -1.718 -1.942 316 HD13 ILE 39 2HD1 ILE 39 -6.393 -1.342 -1.909 317 H ARG 40 H ARG 40 -9.533 -2.025 1.117 318 HA ARG 40 HA ARG 40 -10.393 -0.353 3.136 319 HB2 ARG 40 2HB ARG 40 -11.611 -0.686 1.030 320 HB3 ARG 40 3HB ARG 40 -12.059 -2.308 1.541 321 HG2 ARG 40 2HG ARG 40 -13.116 -1.089 3.578 322 HG3 ARG 40 3HG ARG 40 -13.048 0.327 2.528 323 HD2 ARG 40 2HD ARG 40 -14.105 -1.491 0.834 324 HD3 ARG 40 3HD ARG 40 -14.742 -2.079 2.369 325 HE ARG 40 HE ARG 40 -15.112 0.730 2.077 326 HH11 ARG 40 1HH1 ARG 40 -16.373 -2.369 1.116 327 HH12 ARG 40 2HH1 ARG 40 -17.981 -1.778 0.851 328 HH21 ARG 40 1HH2 ARG 40 -17.224 1.519 1.733 329 HH22 ARG 40 2HH2 ARG 40 -18.463 0.433 1.202 330 H MET 41 H MET 41 -10.776 -3.881 2.918 331 HA MET 41 HA MET 41 -12.250 -4.330 5.206 332 HB2 MET 41 2HB MET 41 -10.684 -5.893 3.399 333 HB3 MET 41 3HB MET 41 -10.307 -6.397 5.041 334 HG2 MET 41 2HG MET 41 -12.499 -7.045 5.476 335 HG3 MET 41 3HG MET 41 -13.140 -6.112 4.125 336 HE1 MET 41 3HE MET 41 -10.063 -8.464 4.335 337 HE2 MET 41 1HE MET 41 -11.256 -9.460 5.170 338 HE3 MET 41 2HE MET 41 -10.646 -9.954 3.591 339 H ALA 42 H ALA 42 -8.789 -3.772 4.877 340 HA ALA 42 HA ALA 42 -8.254 -4.273 7.665 341 HB1 ALA 42 1HB ALA 42 -6.601 -4.705 5.849 342 HB2 ALA 42 2HB ALA 42 -6.451 -2.959 5.641 343 HB3 ALA 42 3HB ALA 42 -5.984 -3.709 7.168 344 H ASN 43 H ASN 43 -8.638 -1.450 5.577 345 HA ASN 43 HA ASN 43 -7.848 0.528 7.383 346 HB2 ASN 43 2HB ASN 43 -8.210 1.007 5.020 347 HB3 ASN 43 3HB ASN 43 -9.929 0.663 5.190 348 HD21 ASN 43 1HD2 ASN 43 -10.432 2.732 4.432 349 HD22 ASN 43 2HD2 ASN 43 -10.256 4.130 5.432 350 H VAL 44 H VAL 44 -10.709 -1.399 7.262 351 HA VAL 44 HA VAL 44 -12.059 0.328 9.213 352 HB VAL 44 HB VAL 44 -13.191 -2.097 7.817 353 HG11 VAL 44 1HG1 VAL 44 -15.277 -0.473 8.432 354 HG12 VAL 44 2HG1 VAL 44 -14.723 -1.812 9.438 355 HG13 VAL 44 3HG1 VAL 44 -14.193 -0.166 9.789 356 HG21 VAL 44 3HG2 VAL 44 -12.805 0.659 6.884 357 HG22 VAL 44 1HG2 VAL 44 -13.076 -0.824 5.969 358 HG23 VAL 44 2HG2 VAL 44 -14.441 0.033 6.684 359 H SER 45 H SER 45 -11.462 -3.153 8.693 360 HA SER 45 HA SER 45 -12.172 -4.062 11.203 361 HB2 SER 45 2HB SER 45 -11.645 -5.535 9.285 362 HB3 SER 45 3HB SER 45 -9.936 -5.138 9.466 363 HG SER 45 HG SER 45 -9.928 -6.775 10.782 364 H THR 46 H THR 46 -9.134 -2.647 10.130 365 HA THR 46 HA THR 46 -8.237 -2.610 12.938 366 HB THR 46 HB THR 46 -5.961 -2.849 12.265 367 HG1 THR 46 HG1 THR 46 -6.620 -3.107 9.543 368 HG21 THR 46 3HG2 THR 46 -7.445 -4.821 10.540 369 HG22 THR 46 1HG2 THR 46 -7.447 -4.911 12.301 370 HG23 THR 46 2HG2 THR 46 -5.930 -5.056 11.411 371 H GLY 47 H GLY 47 -9.816 -0.575 11.921 372 HA2 GLY 47 2HA GLY 47 -8.018 1.672 12.237 373 HA3 GLY 47 3HA GLY 47 -8.802 1.584 10.667 374 H ARG 48 H ARG 48 -10.915 2.180 10.459 375 HA ARG 48 HA ARG 48 -12.801 2.352 12.511 376 HB2 ARG 48 2HB ARG 48 -10.916 4.561 12.417 377 HB3 ARG 48 3HB ARG 48 -12.570 5.109 12.184 378 HG2 ARG 48 2HG ARG 48 -13.162 4.654 14.306 379 HG3 ARG 48 3HG ARG 48 -12.164 3.201 14.386 380 HD2 ARG 48 2HD ARG 48 -11.390 4.992 15.904 381 HD3 ARG 48 3HD ARG 48 -10.179 4.528 14.709 382 HE ARG 48 HE ARG 48 -11.511 6.647 13.592 383 HH11 ARG 48 1HH1 ARG 48 -9.728 6.088 16.529 384 HH12 ARG 48 2HH1 ARG 48 -9.183 7.727 16.664 385 HH21 ARG 48 1HH2 ARG 48 -10.799 8.807 13.758 386 HH22 ARG 48 2HH2 ARG 48 -9.793 9.273 15.088 387 H GLU 49 H GLU 49 -14.021 1.507 10.788 388 HA GLU 49 HA GLU 49 -15.526 1.609 9.086 389 HB2 GLU 49 2HB GLU 49 -15.437 4.326 10.163 390 HB3 GLU 49 3HB GLU 49 -15.930 4.270 8.477 391 HG2 GLU 49 2HG GLU 49 -17.957 4.061 9.475 392 HG3 GLU 49 3HG GLU 49 -17.513 2.359 9.356 393 HA PRO 50 HA PRO 50 -13.328 2.015 5.313 394 HB2 PRO 50 2HB PRO 50 -15.308 2.537 3.531 395 HB3 PRO 50 3HB PRO 50 -15.085 0.953 4.282 396 HG2 PRO 50 2HG PRO 50 -16.999 3.139 5.003 397 HG3 PRO 50 3HG PRO 50 -17.283 1.392 4.904 398 HD2 PRO 50 2HD PRO 50 -16.876 2.671 7.256 399 HD3 PRO 50 3HD PRO 50 -16.355 0.997 6.977 400 H GLY 51 H GLY 51 -15.181 4.675 6.488 401 HA2 GLY 51 2HA GLY 51 -14.487 6.548 4.439 402 HA3 GLY 51 3HA GLY 51 -15.158 6.932 6.017 403 H ASP 52 H ASP 52 -12.154 6.034 4.371 404 HA ASP 52 HA ASP 52 -10.648 8.044 5.651 405 HB2 ASP 52 2HB ASP 52 -11.015 5.756 7.243 406 HB3 ASP 52 3HB ASP 52 -9.374 5.639 6.614 407 H ILE 53 H ILE 53 -8.764 8.389 4.583 408 HA ILE 53 HA ILE 53 -7.699 6.266 2.871 409 HB ILE 53 HB ILE 53 -8.304 9.051 1.868 410 HG12 ILE 53 2HG1 ILE 53 -9.664 7.457 0.207 411 HG13 ILE 53 3HG1 ILE 53 -9.708 6.434 1.639 412 HG21 ILE 53 1HG2 ILE 53 -6.451 7.047 0.988 413 HG22 ILE 53 2HG2 ILE 53 -7.682 7.314 -0.245 414 HG23 ILE 53 3HG2 ILE 53 -6.726 8.669 0.354 415 HD11 ILE 53 3HD1 ILE 53 -10.431 8.836 2.674 416 HD12 ILE 53 1HD1 ILE 53 -11.124 8.922 1.055 417 HD13 ILE 53 2HD1 ILE 53 -11.553 7.590 2.129 418 HA PRO 54 HA PRO 54 -4.370 8.490 5.171 419 HB2 PRO 54 2HB PRO 54 -2.965 6.238 5.744 420 HB3 PRO 54 3HB PRO 54 -4.301 6.818 6.746 421 HG2 PRO 54 2HG PRO 54 -4.292 4.672 4.659 422 HG3 PRO 54 3HG PRO 54 -5.063 4.676 6.256 423 HD2 PRO 54 2HD PRO 54 -6.438 5.160 3.975 424 HD3 PRO 54 3HD PRO 54 -6.863 5.915 5.524 425 H GLU 55 H GLU 55 -2.358 9.042 4.415 426 HA GLU 55 HA GLU 55 -1.340 7.593 2.069 427 HB2 GLU 55 2HB GLU 55 -2.610 9.856 1.647 428 HB3 GLU 55 3HB GLU 55 -1.102 10.572 2.197 429 HG2 GLU 55 2HG GLU 55 -0.518 10.467 0.047 430 HG3 GLU 55 3HG GLU 55 -0.192 8.769 0.390 431 H THR 56 H THR 56 -0.217 6.869 4.265 432 HA THR 56 HA THR 56 2.390 8.183 4.237 433 HB THR 56 HB THR 56 2.581 8.389 6.600 434 HG1 THR 56 HG1 THR 56 1.200 7.463 8.002 435 HG21 THR 56 3HG2 THR 56 1.335 10.199 5.456 436 HG22 THR 56 1HG2 THR 56 0.865 10.008 7.144 437 HG23 THR 56 2HG2 THR 56 -0.174 9.382 5.863 438 H LEU 57 H LEU 57 3.902 6.687 3.973 439 HA LEU 57 HA LEU 57 3.451 3.954 3.888 440 HB2 LEU 57 2HB LEU 57 5.651 5.712 3.565 441 HB3 LEU 57 3HB LEU 57 6.163 4.405 4.630 442 HG LEU 57 HG LEU 57 6.748 3.849 2.371 443 HD11 LEU 57 1HD1 LEU 57 4.318 2.180 2.843 444 HD12 LEU 57 2HD1 LEU 57 5.651 2.142 3.997 445 HD13 LEU 57 3HD1 LEU 57 5.929 1.697 2.314 446 HD21 LEU 57 3HD2 LEU 57 4.579 5.301 1.618 447 HD22 LEU 57 1HD2 LEU 57 4.002 3.655 1.356 448 HD23 LEU 57 2HD2 LEU 57 5.473 4.210 0.558 449 H ASP 58 H ASP 58 4.173 6.001 6.596 450 HA ASP 58 HA ASP 58 5.054 3.988 8.389 451 HB2 ASP 58 2HB ASP 58 5.350 6.502 8.640 452 HB3 ASP 58 3HB ASP 58 3.669 6.555 9.163 453 H GLN 59 H GLN 59 1.887 5.499 7.839 454 HA GLN 59 HA GLN 59 0.522 4.011 9.822 455 HB2 GLN 59 2HB GLN 59 -0.340 6.123 8.895 456 HB3 GLN 59 3HB GLN 59 -0.575 5.341 7.338 457 HG2 GLN 59 2HG GLN 59 -2.612 4.776 7.969 458 HG3 GLN 59 3HG GLN 59 -1.913 3.751 9.221 459 HE21 GLN 59 1HE2 GLN 59 -2.952 4.086 11.046 460 HE22 GLN 59 2HE2 GLN 59 -3.402 5.622 11.696 461 H LEU 60 H LEU 60 0.686 3.632 6.284 462 HA LEU 60 HA LEU 60 -0.896 1.355 6.068 463 HB2 LEU 60 2HB LEU 60 -0.238 2.611 4.129 464 HB3 LEU 60 3HB LEU 60 1.462 2.248 4.419 465 HG LEU 60 HG LEU 60 0.352 -0.251 4.160 466 HD11 LEU 60 1HD1 LEU 60 -1.243 1.715 2.613 467 HD12 LEU 60 2HD1 LEU 60 -1.721 0.175 3.328 468 HD13 LEU 60 3HD1 LEU 60 -0.807 0.201 1.820 469 HD21 LEU 60 3HD2 LEU 60 1.449 -0.261 1.968 470 HD22 LEU 60 1HD2 LEU 60 2.454 0.506 3.198 471 HD23 LEU 60 2HD2 LEU 60 1.581 1.497 2.029 472 H ARG 61 H ARG 61 2.614 1.618 6.542 473 HA ARG 61 HA ARG 61 3.230 -1.100 6.468 474 HB2 ARG 61 2HB ARG 61 4.966 0.587 6.421 475 HB3 ARG 61 3HB ARG 61 4.527 1.135 8.034 476 HG2 ARG 61 2HG ARG 61 5.802 -0.404 9.002 477 HG3 ARG 61 3HG ARG 61 5.147 -1.692 7.989 478 HD2 ARG 61 2HD ARG 61 6.893 -1.631 6.587 479 HD3 ARG 61 3HD ARG 61 6.923 0.132 6.560 480 HE ARG 61 HE ARG 61 7.909 -0.602 9.025 481 HH11 ARG 61 1HH1 ARG 61 8.759 -1.140 5.692 482 HH12 ARG 61 2HH1 ARG 61 10.456 -1.277 6.011 483 HH21 ARG 61 1HH2 ARG 61 10.142 -0.781 9.458 484 HH22 ARG 61 2HH2 ARG 61 11.242 -1.073 8.154 485 H LEU 62 H LEU 62 2.307 0.944 9.220 486 HA LEU 62 HA LEU 62 2.543 -1.042 11.200 487 HB2 LEU 62 2HB LEU 62 1.886 1.652 11.110 488 HB3 LEU 62 3HB LEU 62 0.430 0.872 11.725 489 HG LEU 62 HG LEU 62 1.732 1.582 13.591 490 HD11 LEU 62 1HD1 LEU 62 0.839 -0.950 13.283 491 HD12 LEU 62 2HD1 LEU 62 1.520 -0.313 14.779 492 HD13 LEU 62 3HD1 LEU 62 2.533 -1.244 13.676 493 HD21 LEU 62 3HD2 LEU 62 3.975 1.504 13.751 494 HD22 LEU 62 1HD2 LEU 62 3.902 1.323 11.998 495 HD23 LEU 62 2HD2 LEU 62 4.078 -0.100 13.024 496 H VAL 63 H VAL 63 -0.013 -0.245 8.954 497 HA VAL 63 HA VAL 63 -2.121 -1.641 10.194 498 HB VAL 63 HB VAL 63 -1.685 -1.106 7.252 499 HG11 VAL 63 1HG1 VAL 63 -3.934 -2.286 8.791 500 HG12 VAL 63 2HG1 VAL 63 -4.323 -1.202 7.453 501 HG13 VAL 63 3HG1 VAL 63 -3.360 -2.652 7.164 502 HG21 VAL 63 3HG2 VAL 63 -2.264 0.640 9.424 503 HG22 VAL 63 1HG2 VAL 63 -2.140 1.019 7.705 504 HG23 VAL 63 2HG2 VAL 63 -3.691 0.537 8.393 505 H ILE 64 H ILE 64 -0.004 -2.637 7.499 506 HA ILE 64 HA ILE 64 -0.944 -5.228 7.203 507 HB ILE 64 HB ILE 64 1.897 -4.274 6.823 508 HG12 ILE 64 2HG1 ILE 64 -0.410 -4.438 4.871 509 HG13 ILE 64 3HG1 ILE 64 0.259 -2.956 5.546 510 HG21 ILE 64 1HG2 ILE 64 0.760 -6.867 6.629 511 HG22 ILE 64 2HG2 ILE 64 1.154 -6.317 5.002 512 HG23 ILE 64 3HG2 ILE 64 2.403 -6.355 6.246 513 HD11 ILE 64 3HD1 ILE 64 1.532 -4.858 3.609 514 HD12 ILE 64 1HD1 ILE 64 1.155 -3.150 3.388 515 HD13 ILE 64 2HD1 ILE 64 2.451 -3.632 4.482 516 H CYS 65 H CYS 65 1.630 -4.018 9.323 517 HA CYS 65 HA CYS 65 2.432 -6.503 10.355 518 HB2 CYS 65 2HB CYS 65 2.572 -3.718 11.515 519 HB3 CYS 65 3HB CYS 65 3.300 -5.120 12.291 520 HG CYS 65 HG CYS 65 5.273 -5.523 10.530 521 H ASP 66 H ASP 66 0.244 -4.066 11.765 522 HA ASP 66 HA ASP 66 -0.510 -5.514 14.019 523 HB2 ASP 66 2HB ASP 66 -1.044 -3.164 13.812 524 HB3 ASP 66 3HB ASP 66 -2.075 -3.480 12.419 525 H LEU 67 H LEU 67 -2.036 -5.394 10.812 526 HA LEU 67 HA LEU 67 -4.162 -7.140 11.405 527 HB2 LEU 67 2HB LEU 67 -3.421 -5.614 9.262 528 HB3 LEU 67 3HB LEU 67 -3.152 -7.248 8.658 529 HG LEU 67 HG LEU 67 -5.745 -6.074 9.652 530 HD11 LEU 67 1HD1 LEU 67 -6.492 -6.224 7.437 531 HD12 LEU 67 2HD1 LEU 67 -5.139 -7.248 6.957 532 HD13 LEU 67 3HD1 LEU 67 -4.868 -5.544 7.319 533 HD21 LEU 67 3HD2 LEU 67 -6.407 -8.473 8.598 534 HD22 LEU 67 1HD2 LEU 67 -6.164 -8.181 10.320 535 HD23 LEU 67 2HD2 LEU 67 -4.859 -8.863 9.350 536 H GLN 68 H GLN 68 -0.894 -7.711 10.209 537 HA GLN 68 HA GLN 68 -1.110 -10.387 9.498 538 HB2 GLN 68 2HB GLN 68 0.876 -9.031 9.034 539 HB3 GLN 68 3HB GLN 68 1.249 -8.972 10.752 540 HG2 GLN 68 2HG GLN 68 2.671 -10.593 9.792 541 HG3 GLN 68 3HG GLN 68 1.440 -11.468 10.702 542 HE21 GLN 68 1HE2 GLN 68 -0.379 -12.327 9.468 543 HE22 GLN 68 2HE2 GLN 68 -0.105 -12.873 7.852 544 H GLU 69 H GLU 69 -0.290 -8.983 12.660 545 HA GLU 69 HA GLU 69 0.023 -11.442 14.004 546 HB2 GLU 69 2HB GLU 69 0.705 -9.041 14.723 547 HB3 GLU 69 3HB GLU 69 -0.924 -8.946 15.376 548 HG2 GLU 69 2HG GLU 69 -0.463 -10.938 16.746 549 HG3 GLU 69 3HG GLU 69 1.189 -10.951 16.131 550 H ARG 70 H ARG 70 -2.762 -9.313 13.555 551 HA ARG 70 HA ARG 70 -4.537 -10.656 15.270 552 HB2 ARG 70 2HB ARG 70 -4.665 -8.535 13.325 553 HB3 ARG 70 3HB ARG 70 -6.046 -9.607 13.136 554 HG2 ARG 70 2HG ARG 70 -5.386 -8.783 15.894 555 HG3 ARG 70 3HG ARG 70 -6.016 -7.534 14.817 556 HD2 ARG 70 2HD ARG 70 -8.035 -8.650 14.505 557 HD3 ARG 70 3HD ARG 70 -7.369 -10.196 15.030 558 HE ARG 70 HE ARG 70 -8.496 -8.146 16.688 559 HH11 ARG 70 1HH1 ARG 70 -6.258 -10.811 16.581 560 HH12 ARG 70 2HH1 ARG 70 -6.346 -11.123 18.283 561 HH21 ARG 70 1HH2 ARG 70 -8.621 -8.548 18.930 562 HH22 ARG 70 2HH2 ARG 70 -7.692 -9.837 19.618 563 H ARG 71 H ARG 71 -4.188 -10.888 11.728 564 HA ARG 71 HA ARG 71 -6.043 -12.951 11.356 565 HB2 ARG 71 2HB ARG 71 -5.062 -13.249 9.177 566 HB3 ARG 71 3HB ARG 71 -5.092 -11.530 9.547 567 HG2 ARG 71 2HG ARG 71 -2.767 -11.480 9.960 568 HG3 ARG 71 3HG ARG 71 -2.662 -13.241 9.979 569 HD2 ARG 71 2HD ARG 71 -2.081 -13.103 7.832 570 HD3 ARG 71 3HD ARG 71 -3.761 -12.677 7.509 571 HE ARG 71 HE ARG 71 -1.476 -10.906 7.489 572 HH11 ARG 71 1HH1 ARG 71 -4.944 -11.178 7.641 573 HH12 ARG 71 2HH1 ARG 71 -5.226 -9.565 7.075 574 HH21 ARG 71 1HH2 ARG 71 -1.834 -8.781 6.743 575 HH22 ARG 71 2HH2 ARG 71 -3.456 -8.203 6.563 576 H GLU 72 H GLU 72 -2.738 -12.999 12.432 577 HA GLU 72 HA GLU 72 -2.150 -15.708 11.915 578 HB2 GLU 72 2HB GLU 72 -0.476 -13.945 12.503 579 HB3 GLU 72 3HB GLU 72 -1.065 -13.999 14.158 580 HG2 GLU 72 2HG GLU 72 -0.533 -16.555 13.931 581 HG3 GLU 72 3HG GLU 72 0.539 -15.996 12.648 582 H LYS 73 H LYS 73 -3.093 -14.147 14.982 583 HA LYS 73 HA LYS 73 -3.456 -16.549 16.404 584 HB2 LYS 73 2HB LYS 73 -3.332 -13.989 17.150 585 HB3 LYS 73 3HB LYS 73 -5.082 -14.162 17.128 586 HG2 LYS 73 2HG LYS 73 -4.470 -16.350 18.525 587 HG3 LYS 73 3HG LYS 73 -3.077 -15.350 18.945 588 HD2 LYS 73 2HD LYS 73 -5.545 -13.843 19.070 589 HD3 LYS 73 3HD LYS 73 -5.605 -15.271 20.107 590 HE2 LYS 73 2HE LYS 73 -3.413 -14.571 21.070 591 HE3 LYS 73 3HE LYS 73 -3.530 -13.082 20.133 592 HZ1 LYS 73 3HZ LYS 73 -5.201 -12.282 21.438 593 HZ2 LYS 73 1HZ LYS 73 -4.371 -13.199 22.592 594 HZ3 LYS 73 2HZ LYS 73 -5.772 -13.814 21.872 595 H PHE 74 H PHE 74 -5.468 -14.854 14.164 596 HA PHE 74 HA PHE 74 -7.898 -16.199 14.973 597 HB2 PHE 74 2HB PHE 74 -7.706 -13.838 13.943 598 HB3 PHE 74 3HB PHE 74 -7.532 -14.675 12.405 599 HD1 PHE 74 HD2 PHE 74 -9.384 -15.990 11.490 600 HD2 PHE 74 HD1 PHE 74 -9.805 -13.731 15.073 601 HE1 PHE 74 HE2 PHE 74 -11.831 -16.163 11.308 602 HE2 PHE 74 HE1 PHE 74 -12.253 -13.902 14.897 603 HZ PHE 74 HZ PHE 74 -13.269 -15.118 13.012 604 H GLY 75 H GLY 75 -5.282 -16.740 12.802 605 HA2 GLY 75 2HA GLY 75 -4.950 -18.990 11.972 606 HA3 GLY 75 3HA GLY 75 -6.690 -19.115 11.765 607 H SER 76 H SER 76 -5.072 -19.815 9.700 608 HA SER 76 HA SER 76 -5.040 -17.523 7.872 609 HB2 SER 76 2HB SER 76 -2.987 -18.512 7.591 610 HB3 SER 76 3HB SER 76 -3.586 -20.120 7.996 611 HG SER 76 HG SER 76 -3.500 -20.384 5.906 612 H SER 77 H SER 77 -6.233 -17.456 6.015 613 HA SER 77 HA SER 77 -7.875 -19.753 5.285 614 HB2 SER 77 2HB SER 77 -9.953 -18.615 5.408 615 HB3 SER 77 3HB SER 77 -9.144 -18.268 6.937 616 HG SER 77 HG SER 77 -9.999 -16.371 6.055 617 H LYS 78 H LYS 78 -8.984 -19.428 3.193 618 HA LYS 78 HA LYS 78 -7.232 -18.554 1.211 619 HB2 LYS 78 2HB LYS 78 -9.755 -19.826 1.325 620 HB3 LYS 78 3HB LYS 78 -9.936 -18.448 0.248 621 HG2 LYS 78 2HG LYS 78 -8.086 -19.232 -1.109 622 HG3 LYS 78 3HG LYS 78 -7.829 -20.585 -0.005 623 HD2 LYS 78 2HD LYS 78 -9.428 -21.789 -0.988 624 HD3 LYS 78 3HD LYS 78 -10.578 -20.453 -0.899 625 HE2 LYS 78 2HE LYS 78 -8.408 -20.640 -2.979 626 HE3 LYS 78 3HE LYS 78 -10.035 -21.276 -3.218 627 HZ1 LYS 78 3HZ LYS 78 -9.100 -18.559 -3.310 628 HZ2 LYS 78 1HZ LYS 78 -10.488 -18.751 -2.361 629 HZ3 LYS 78 2HZ LYS 78 -10.494 -19.246 -3.978 630 H GLU 79 H GLU 79 -9.974 -16.916 2.720 631 HA GLU 79 HA GLU 79 -9.916 -14.644 1.010 632 HB2 GLU 79 2HB GLU 79 -11.549 -15.601 3.101 633 HB3 GLU 79 3HB GLU 79 -10.973 -14.020 3.612 634 HG2 GLU 79 2HG GLU 79 -11.724 -13.175 1.343 635 HG3 GLU 79 3HG GLU 79 -12.558 -14.718 1.163 636 H ILE 80 H ILE 80 -9.016 -14.931 4.453 637 HA ILE 80 HA ILE 80 -7.794 -12.477 4.748 638 HB ILE 80 HB ILE 80 -6.963 -15.064 6.067 639 HG12 ILE 80 2HG1 ILE 80 -8.887 -12.937 7.030 640 HG13 ILE 80 3HG1 ILE 80 -9.375 -14.469 6.314 641 HG21 ILE 80 1HG2 ILE 80 -6.620 -12.822 7.756 642 HG22 ILE 80 2HG2 ILE 80 -5.386 -13.894 7.097 643 HG23 ILE 80 3HG2 ILE 80 -5.858 -12.445 6.211 644 HD11 ILE 80 3HD1 ILE 80 -8.135 -15.616 8.160 645 HD12 ILE 80 1HD1 ILE 80 -7.931 -14.034 8.911 646 HD13 ILE 80 2HD1 ILE 80 -9.549 -14.691 8.663 647 H ASP 81 H ASP 81 -6.449 -15.472 3.464 648 HA ASP 81 HA ASP 81 -3.759 -14.687 3.342 649 HB2 ASP 81 2HB ASP 81 -5.412 -16.707 1.866 650 HB3 ASP 81 3HB ASP 81 -3.754 -16.393 1.359 651 H MET 82 H MET 82 -6.252 -14.613 0.793 652 HA MET 82 HA MET 82 -4.701 -13.376 -1.169 653 HB2 MET 82 2HB MET 82 -7.564 -13.853 -0.702 654 HB3 MET 82 3HB MET 82 -7.218 -12.456 -1.712 655 HG2 MET 82 2HG MET 82 -5.565 -14.432 -2.716 656 HG3 MET 82 3HG MET 82 -7.062 -15.276 -2.328 657 HE1 MET 82 3HE MET 82 -9.683 -14.107 -4.450 658 HE2 MET 82 1HE MET 82 -9.248 -14.363 -2.760 659 HE3 MET 82 2HE MET 82 -9.453 -12.725 -3.379 660 H ALA 83 H ALA 83 -6.263 -12.076 1.635 661 HA ALA 83 HA ALA 83 -6.386 -9.363 0.825 662 HB1 ALA 83 1HB ALA 83 -7.249 -8.973 2.868 663 HB2 ALA 83 2HB ALA 83 -7.358 -10.732 2.936 664 HB3 ALA 83 3HB ALA 83 -5.998 -9.903 3.692 665 H ILE 84 H ILE 84 -4.126 -10.955 3.087 666 HA ILE 84 HA ILE 84 -2.349 -8.822 3.329 667 HB ILE 84 HB ILE 84 -2.246 -10.678 4.865 668 HG12 ILE 84 2HG1 ILE 84 0.380 -11.090 3.597 669 HG13 ILE 84 3HG1 ILE 84 -0.073 -9.402 3.808 670 HG21 ILE 84 1HG2 ILE 84 -1.395 -12.315 2.482 671 HG22 ILE 84 2HG2 ILE 84 -1.328 -12.868 4.154 672 HG23 ILE 84 3HG2 ILE 84 -2.883 -12.488 3.412 673 HD11 ILE 84 3HD1 ILE 84 -0.232 -11.368 6.061 674 HD12 ILE 84 1HD1 ILE 84 1.260 -10.516 5.665 675 HD13 ILE 84 2HD1 ILE 84 -0.178 -9.607 6.130 676 H VAL 85 H VAL 85 -2.613 -11.301 0.874 677 HA VAL 85 HA VAL 85 -0.091 -10.965 -0.335 678 HB VAL 85 HB VAL 85 -2.700 -11.865 -1.564 679 HG11 VAL 85 1HG1 VAL 85 -0.912 -13.038 -3.115 680 HG12 VAL 85 2HG1 VAL 85 -1.494 -11.406 -3.450 681 HG13 VAL 85 3HG1 VAL 85 0.059 -11.642 -2.648 682 HG21 VAL 85 3HG2 VAL 85 -2.285 -13.940 -0.793 683 HG22 VAL 85 1HG2 VAL 85 -0.543 -13.791 -1.032 684 HG23 VAL 85 2HG2 VAL 85 -1.300 -13.097 0.402 685 H THR 86 H THR 86 -3.253 -9.520 -1.083 686 HA THR 86 HA THR 86 -2.430 -7.978 -3.272 687 HB THR 86 HB THR 86 -4.442 -6.655 -2.939 688 HG1 THR 86 HG1 THR 86 -4.800 -6.277 -0.865 689 HG21 THR 86 3HG2 THR 86 -5.449 -8.419 -3.861 690 HG22 THR 86 1HG2 THR 86 -5.879 -8.945 -2.234 691 HG23 THR 86 2HG2 THR 86 -4.402 -9.542 -2.992 692 H LEU 87 H LEU 87 -2.650 -7.146 0.176 693 HA LEU 87 HA LEU 87 -1.868 -4.468 -0.041 694 HB2 LEU 87 2HB LEU 87 -2.094 -6.466 2.085 695 HB3 LEU 87 3HB LEU 87 -0.872 -5.234 2.389 696 HG LEU 87 HG LEU 87 -3.800 -4.735 1.858 697 HD11 LEU 87 1HD1 LEU 87 -4.143 -4.652 4.072 698 HD12 LEU 87 2HD1 LEU 87 -2.579 -3.903 4.391 699 HD13 LEU 87 3HD1 LEU 87 -2.691 -5.648 4.161 700 HD21 LEU 87 3HD2 LEU 87 -1.438 -2.932 2.155 701 HD22 LEU 87 1HD2 LEU 87 -3.021 -2.406 2.728 702 HD23 LEU 87 2HD2 LEU 87 -2.794 -2.833 1.031 703 H LYS 88 H LYS 88 0.009 -7.426 0.099 704 HA LYS 88 HA LYS 88 2.533 -6.156 0.497 705 HB2 LYS 88 2HB LYS 88 1.551 -8.886 -0.019 706 HB3 LYS 88 3HB LYS 88 3.160 -8.551 -0.644 707 HG2 LYS 88 2HG LYS 88 4.081 -8.469 1.403 708 HG3 LYS 88 3HG LYS 88 2.682 -7.662 2.115 709 HD2 LYS 88 2HD LYS 88 1.497 -9.723 2.307 710 HD3 LYS 88 3HD LYS 88 2.706 -10.576 1.344 711 HE2 LYS 88 2HE LYS 88 4.355 -9.857 3.192 712 HE3 LYS 88 3HE LYS 88 2.910 -9.546 4.153 713 HZ1 LYS 88 3HZ LYS 88 2.966 -11.689 4.672 714 HZ2 LYS 88 1HZ LYS 88 4.152 -12.030 3.515 715 HZ3 LYS 88 2HZ LYS 88 2.518 -12.034 3.078 716 H VAL 89 H VAL 89 1.300 -7.924 -2.349 717 HA VAL 89 HA VAL 89 3.217 -7.112 -4.161 718 HB VAL 89 HB VAL 89 1.482 -8.845 -4.592 719 HG11 VAL 89 1HG1 VAL 89 -0.336 -6.565 -5.330 720 HG12 VAL 89 2HG1 VAL 89 -0.719 -8.286 -5.251 721 HG13 VAL 89 3HG1 VAL 89 -0.409 -7.381 -3.768 722 HG21 VAL 89 3HG2 VAL 89 1.005 -7.390 -6.980 723 HG22 VAL 89 1HG2 VAL 89 2.619 -6.976 -6.404 724 HG23 VAL 89 2HG2 VAL 89 2.191 -8.663 -6.689 725 H PHE 90 H PHE 90 0.424 -5.378 -2.980 726 HA PHE 90 HA PHE 90 0.419 -3.347 -4.972 727 HB2 PHE 90 2HB PHE 90 -1.592 -3.682 -3.729 728 HB3 PHE 90 3HB PHE 90 -0.752 -3.486 -2.194 729 HD1 PHE 90 HD2 PHE 90 -0.650 -1.415 -5.284 730 HD2 PHE 90 HD1 PHE 90 -1.697 -1.649 -1.165 731 HE1 PHE 90 HE2 PHE 90 -1.205 0.982 -5.292 732 HE2 PHE 90 HE1 PHE 90 -2.254 0.748 -1.167 733 HZ PHE 90 HZ PHE 90 -2.007 2.067 -3.232 734 H ALA 91 H ALA 91 1.725 -3.514 -1.673 735 HA ALA 91 HA ALA 91 2.815 -0.897 -1.682 736 HB1 ALA 91 1HB ALA 91 3.420 -1.334 0.440 737 HB2 ALA 91 2HB ALA 91 2.389 -2.751 0.239 738 HB3 ALA 91 3HB ALA 91 4.134 -2.893 0.027 739 H VAL 92 H VAL 92 4.088 -4.060 -2.566 740 HA VAL 92 HA VAL 92 6.777 -3.135 -2.937 741 HB VAL 92 HB VAL 92 5.541 -5.656 -4.045 742 HG11 VAL 92 1HG1 VAL 92 7.605 -6.294 -4.646 743 HG12 VAL 92 2HG1 VAL 92 7.994 -4.575 -4.545 744 HG13 VAL 92 3HG1 VAL 92 8.338 -5.640 -3.181 745 HG21 VAL 92 3HG2 VAL 92 6.010 -4.890 -1.315 746 HG22 VAL 92 1HG2 VAL 92 5.292 -6.368 -1.954 747 HG23 VAL 92 2HG2 VAL 92 7.040 -6.253 -1.753 748 H ALA 93 H ALA 93 4.426 -4.451 -5.280 749 HA ALA 93 HA ALA 93 5.795 -3.523 -7.554 750 HB1 ALA 93 1HB ALA 93 4.087 -5.338 -7.526 751 HB2 ALA 93 2HB ALA 93 2.844 -4.097 -7.356 752 HB3 ALA 93 3HB ALA 93 3.851 -4.144 -8.803 753 H GLY 94 H GLY 94 3.873 -1.872 -5.277 754 HA2 GLY 94 2HA GLY 94 3.216 0.289 -7.143 755 HA3 GLY 94 3HA GLY 94 2.622 0.128 -5.497 756 H LEU 95 H LEU 95 4.324 0.361 -3.766 757 HA LEU 95 HA LEU 95 5.551 2.868 -3.977 758 HB2 LEU 95 2HB LEU 95 6.411 0.741 -2.041 759 HB3 LEU 95 3HB LEU 95 6.424 2.490 -1.822 760 HG LEU 95 HG LEU 95 3.997 0.697 -1.877 761 HD11 LEU 95 1HD1 LEU 95 5.592 2.005 0.270 762 HD12 LEU 95 2HD1 LEU 95 4.847 0.408 0.229 763 HD13 LEU 95 3HD1 LEU 95 3.849 1.840 0.478 764 HD21 LEU 95 3HD2 LEU 95 4.259 3.491 -2.448 765 HD22 LEU 95 1HD2 LEU 95 3.361 3.272 -0.946 766 HD23 LEU 95 2HD2 LEU 95 2.808 2.488 -2.426 767 H LEU 96 H LEU 96 6.936 -0.395 -4.162 768 HA LEU 96 HA LEU 96 9.564 0.666 -4.772 769 HB2 LEU 96 2HB LEU 96 8.720 -1.601 -3.532 770 HB3 LEU 96 3HB LEU 96 9.075 -2.206 -5.149 771 HG LEU 96 HG LEU 96 11.171 -0.541 -3.902 772 HD11 LEU 96 1HD1 LEU 96 11.850 -2.921 -2.840 773 HD12 LEU 96 2HD1 LEU 96 10.100 -2.972 -2.630 774 HD13 LEU 96 3HD1 LEU 96 11.032 -1.642 -1.942 775 HD21 LEU 96 3HD2 LEU 96 11.804 -1.428 -5.936 776 HD22 LEU 96 1HD2 LEU 96 10.965 -2.954 -5.653 777 HD23 LEU 96 2HD2 LEU 96 12.472 -2.606 -4.806 778 H ASN 97 H ASN 97 6.820 0.256 -6.511 779 HA ASN 97 HA ASN 97 6.306 0.021 -8.718 780 HB2 ASN 97 2HB ASN 97 9.118 0.891 -9.338 781 HB3 ASN 97 3HB ASN 97 7.632 1.264 -10.208 782 HD21 ASN 97 1HD2 ASN 97 9.816 2.247 -7.813 783 HD22 ASN 97 2HD2 ASN 97 8.959 3.644 -7.265 784 H MET 98 H MET 98 7.502 -2.284 -7.354 785 HA MET 98 HA MET 98 9.362 -3.655 -8.902 786 HB2 MET 98 2HB MET 98 7.633 -4.239 -6.711 787 HB3 MET 98 3HB MET 98 7.479 -5.536 -7.889 788 HG2 MET 98 2HG MET 98 10.210 -4.629 -7.177 789 HG3 MET 98 3HG MET 98 9.310 -5.567 -5.988 790 HE1 MET 98 3HE MET 98 11.561 -5.362 -8.605 791 HE2 MET 98 1HE MET 98 12.230 -6.825 -7.881 792 HE3 MET 98 2HE MET 98 11.597 -6.867 -9.526 793 H THR 99 H THR 99 8.898 -5.666 -10.195 794 HA THR 99 HA THR 99 6.564 -5.245 -11.947 795 HB THR 99 HB THR 99 8.596 -4.595 -13.130 796 HG1 THR 99 HG1 THR 99 7.081 -5.573 -14.440 797 HG21 THR 99 3HG2 THR 99 9.824 -7.169 -13.447 798 HG22 THR 99 1HG2 THR 99 9.747 -6.753 -11.736 799 HG23 THR 99 2HG2 THR 99 10.536 -5.661 -12.874 800 H VAL 100 H VAL 100 6.269 -6.885 -9.809 801 HA VAL 100 HA VAL 100 6.872 -9.618 -10.530 802 HB VAL 100 HB VAL 100 5.548 -10.188 -8.491 803 HG11 VAL 100 1HG1 VAL 100 7.387 -9.914 -7.237 804 HG12 VAL 100 2HG1 VAL 100 8.085 -9.207 -8.695 805 HG13 VAL 100 3HG1 VAL 100 7.391 -8.164 -7.453 806 HG21 VAL 100 3HG2 VAL 100 4.107 -8.712 -7.666 807 HG22 VAL 100 1HG2 VAL 100 5.457 -7.660 -7.241 808 HG23 VAL 100 2HG2 VAL 100 4.666 -7.490 -8.808 809 H SER 101 H SER 101 5.664 -10.838 -11.809 810 HA SER 101 HA SER 101 2.956 -9.962 -12.475 811 HB2 SER 101 2HB SER 101 4.969 -11.753 -13.782 812 HB3 SER 101 3HB SER 101 3.261 -11.951 -14.175 813 HG SER 101 HG SER 101 4.243 -10.482 -15.594 814 H THR 102 H THR 102 3.965 -11.517 -9.998 815 HA THR 102 HA THR 102 1.709 -13.365 -9.951 816 HB THR 102 HB THR 102 2.946 -15.251 -9.181 817 HG1 THR 102 HG1 THR 102 5.362 -13.772 -9.402 818 HG21 THR 102 3HG2 THR 102 4.409 -15.744 -11.080 819 HG22 THR 102 1HG2 THR 102 4.428 -14.036 -11.517 820 HG23 THR 102 2HG2 THR 102 2.926 -14.955 -11.614 821 H ALA 103 H ALA 103 0.607 -13.068 -8.134 822 HA ALA 103 HA ALA 103 1.305 -11.302 -6.118 823 HB1 ALA 103 1HB ALA 103 -0.898 -12.899 -6.725 824 HB2 ALA 103 2HB ALA 103 -0.419 -13.373 -5.095 825 HB3 ALA 103 3HB ALA 103 -0.780 -11.684 -5.452 826 H ALA 104 H ALA 104 2.154 -14.644 -6.520 827 HA ALA 104 HA ALA 104 2.881 -15.196 -3.834 828 HB1 ALA 104 1HB ALA 104 3.998 -16.512 -6.301 829 HB2 ALA 104 2HB ALA 104 3.897 -17.181 -4.672 830 HB3 ALA 104 3HB ALA 104 2.426 -16.906 -5.605 831 H ALA 105 H ALA 105 4.773 -14.215 -6.681 832 HA ALA 105 HA ALA 105 7.281 -14.172 -5.410 833 HB1 ALA 105 1HB ALA 105 7.038 -14.183 -7.835 834 HB2 ALA 105 2HB ALA 105 6.338 -12.564 -7.781 835 HB3 ALA 105 3HB ALA 105 8.018 -12.815 -7.305 836 H ALA 106 H ALA 106 4.742 -11.753 -5.696 837 HA ALA 106 HA ALA 106 6.197 -9.533 -4.766 838 HB1 ALA 106 1HB ALA 106 3.469 -9.351 -3.936 839 HB2 ALA 106 2HB ALA 106 4.292 -8.504 -5.246 840 HB3 ALA 106 3HB ALA 106 3.544 -10.072 -5.544 841 H GLU 107 H GLU 107 3.972 -11.696 -3.003 842 HA GLU 107 HA GLU 107 4.363 -10.589 -0.470 843 HB2 GLU 107 2HB GLU 107 2.526 -12.082 -0.838 844 HB3 GLU 107 3HB GLU 107 3.607 -13.386 -1.312 845 HG2 GLU 107 2HG GLU 107 4.031 -12.289 1.386 846 HG3 GLU 107 3HG GLU 107 2.514 -13.148 1.130 847 H ASN 108 H ASN 108 6.093 -13.192 -2.129 848 HA ASN 108 HA ASN 108 7.756 -13.920 0.028 849 HB2 ASN 108 2HB ASN 108 7.401 -15.311 -2.000 850 HB3 ASN 108 3HB ASN 108 8.343 -14.151 -2.932 851 HD21 ASN 108 1HD2 ASN 108 9.845 -15.740 -3.475 852 HD22 ASN 108 2HD2 ASN 108 11.010 -16.319 -2.338 853 H MET 109 H MET 109 8.038 -11.467 -2.472 854 HA MET 109 HA MET 109 10.750 -10.796 -1.938 855 HB2 MET 109 2HB MET 109 8.668 -9.936 -3.727 856 HB3 MET 109 3HB MET 109 9.447 -8.534 -3.005 857 HG2 MET 109 2HG MET 109 10.867 -10.769 -4.435 858 HG3 MET 109 3HG MET 109 10.475 -9.196 -5.126 859 HE1 MET 109 3HE MET 109 11.084 -7.332 -2.419 860 HE2 MET 109 1HE MET 109 12.663 -6.780 -2.980 861 HE3 MET 109 2HE MET 109 11.328 -6.938 -4.121 862 H TYR 110 H TYR 110 7.642 -9.554 -0.812 863 HA TYR 110 HA TYR 110 8.612 -7.313 0.578 864 HB2 TYR 110 2HB TYR 110 6.179 -7.966 -0.012 865 HB3 TYR 110 3HB TYR 110 6.217 -8.892 1.484 866 HD1 TYR 110 HD2 TYR 110 7.377 -5.483 0.456 867 HD2 TYR 110 HD1 TYR 110 5.127 -7.825 3.205 868 HE1 TYR 110 HE2 TYR 110 6.818 -3.450 1.722 869 HE2 TYR 110 HE1 TYR 110 4.561 -5.798 4.478 870 HH TYR 110 HH TYR 110 6.148 -2.940 4.183 871 H SER 111 H SER 111 8.083 -10.660 1.599 872 HA SER 111 HA SER 111 8.849 -10.185 4.314 873 HB2 SER 111 2HB SER 111 8.976 -12.911 3.084 874 HB3 SER 111 3HB SER 111 8.407 -12.429 4.682 875 HG SER 111 HG SER 111 6.995 -12.780 2.433 876 H GLN 112 H GLN 112 10.438 -11.756 1.545 877 HA GLN 112 HA GLN 112 12.841 -12.395 2.808 878 HB2 GLN 112 2HB GLN 112 12.041 -13.145 0.521 879 HB3 GLN 112 3HB GLN 112 12.585 -11.587 -0.088 880 HG2 GLN 112 2HG GLN 112 14.849 -12.072 0.487 881 HG3 GLN 112 3HG GLN 112 14.371 -13.539 1.340 882 HE21 GLN 112 1HE2 GLN 112 13.011 -15.047 -0.130 883 HE22 GLN 112 2HE2 GLN 112 13.682 -15.338 -1.694 884 H MET 113 H MET 113 11.646 -9.365 1.620 885 HA MET 113 HA MET 113 14.196 -8.053 1.540 886 HB2 MET 113 2HB MET 113 12.310 -7.301 0.150 887 HB3 MET 113 3HB MET 113 11.407 -6.887 1.601 888 HG2 MET 113 2HG MET 113 12.476 -4.946 1.860 889 HG3 MET 113 3HG MET 113 14.043 -5.645 1.461 890 HE1 MET 113 3HE MET 113 14.428 -3.105 -1.241 891 HE2 MET 113 1HE MET 113 13.704 -2.678 0.310 892 HE3 MET 113 2HE MET 113 15.010 -3.861 0.242 893 H GLY 114 H GLY 114 11.772 -8.665 3.946 894 HA2 GLY 114 2HA GLY 114 12.288 -8.552 6.271 895 HA3 GLY 114 3HA GLY 114 13.460 -7.291 5.918 896 H LEU 115 H LEU 115 10.391 -7.056 4.384 897 HA LEU 115 HA LEU 115 9.773 -4.723 6.034 898 HB2 LEU 115 2HB LEU 115 8.460 -5.646 3.484 899 HB3 LEU 115 3HB LEU 115 8.236 -4.092 4.284 900 HG LEU 115 HG LEU 115 10.983 -4.811 3.410 901 HD11 LEU 115 1HD1 LEU 115 9.375 -5.428 1.544 902 HD12 LEU 115 2HD1 LEU 115 10.638 -4.261 1.152 903 HD13 LEU 115 3HD1 LEU 115 8.990 -3.709 1.451 904 HD21 LEU 115 3HD2 LEU 115 10.802 -2.323 2.759 905 HD22 LEU 115 1HD2 LEU 115 10.864 -2.746 4.470 906 HD23 LEU 115 2HD2 LEU 115 9.321 -2.337 3.718 907 H ASP 116 H ASP 116 8.626 -7.915 5.294 908 HA ASP 116 HA ASP 116 6.022 -7.520 6.466 909 HB2 ASP 116 2HB ASP 116 6.557 -9.174 4.614 910 HB3 ASP 116 3HB ASP 116 7.350 -10.158 5.841 911 H THR 117 H THR 117 5.265 -8.830 8.302 912 HA THR 117 HA THR 117 6.713 -8.365 10.617 913 HB THR 117 HB THR 117 4.710 -10.605 10.338 914 HG1 THR 117 HG1 THR 117 4.089 -7.893 10.915 915 HG21 THR 117 3HG2 THR 117 6.042 -10.228 12.489 916 HG22 THR 117 1HG2 THR 117 4.286 -10.294 12.631 917 HG23 THR 117 2HG2 THR 117 5.116 -8.738 12.660 918 H ARG 118 H ARG 118 6.175 -11.554 9.100 919 HA ARG 118 HA ARG 118 8.829 -12.366 10.065 920 HB2 ARG 118 2HB ARG 118 6.241 -13.478 10.803 921 HB3 ARG 118 3HB ARG 118 7.316 -14.693 10.125 922 HG2 ARG 118 2HG ARG 118 9.058 -13.799 11.775 923 HG3 ARG 118 3HG ARG 118 7.695 -13.010 12.572 924 HD2 ARG 118 2HD ARG 118 6.834 -15.614 12.141 925 HD3 ARG 118 3HD ARG 118 8.521 -15.786 12.622 926 HE ARG 118 HE ARG 118 7.085 -14.004 14.329 927 HH11 ARG 118 1HH1 ARG 118 7.713 -17.362 13.659 928 HH12 ARG 118 2HH1 ARG 118 7.383 -17.882 15.278 929 HH21 ARG 118 1HH2 ARG 118 6.647 -14.676 16.465 930 HH22 ARG 118 2HH2 ARG 118 6.775 -16.354 16.873 931 HA PRO 119 HA PRO 119 9.543 -14.017 6.065 932 HB2 PRO 119 2HB PRO 119 10.942 -16.281 6.603 933 HB3 PRO 119 3HB PRO 119 11.621 -14.661 6.803 934 HG2 PRO 119 2HG PRO 119 10.465 -16.498 8.865 935 HG3 PRO 119 3HG PRO 119 11.925 -15.496 8.952 936 HD2 PRO 119 2HD PRO 119 9.584 -14.760 10.095 937 HD3 PRO 119 3HD PRO 119 10.736 -13.582 9.435 938 H SER 120 H SER 120 8.921 -15.610 4.560 939 HA SER 120 HA SER 120 6.956 -17.563 5.568 940 HB2 SER 120 2HB SER 120 5.444 -16.998 3.948 941 HB3 SER 120 3HB SER 120 6.269 -15.444 4.072 942 HG SER 120 HG SER 120 6.255 -17.276 2.022 943 H MET 121 H MET 121 6.544 -19.344 3.903 944 HA MET 121 HA MET 121 9.107 -20.149 2.691 945 HB2 MET 121 2HB MET 121 7.504 -21.474 4.671 946 HB3 MET 121 3HB MET 121 7.568 -22.461 3.217 947 HG2 MET 121 2HG MET 121 10.182 -21.621 3.589 948 HG3 MET 121 3HG MET 121 9.596 -21.971 5.213 949 HE1 MET 121 3HE MET 121 10.658 -23.886 1.696 950 HE2 MET 121 1HE MET 121 11.641 -23.024 2.880 951 HE3 MET 121 2HE MET 121 11.645 -24.787 2.849 952 H LYS 122 H LYS 122 9.079 -20.932 0.642 953 HA LYS 122 HA LYS 122 6.826 -21.988 -0.675 954 HB2 LYS 122 2HB LYS 122 6.965 -19.112 -0.597 955 HB3 LYS 122 3HB LYS 122 7.141 -19.673 -2.254 956 HG2 LYS 122 2HG LYS 122 4.987 -20.972 -0.751 957 HG3 LYS 122 3HG LYS 122 4.775 -19.238 -1.006 958 HD2 LYS 122 2HD LYS 122 5.093 -19.547 -3.408 959 HD3 LYS 122 3HD LYS 122 5.336 -21.278 -3.161 960 HE2 LYS 122 2HE LYS 122 3.100 -21.607 -2.518 961 HE3 LYS 122 3HE LYS 122 2.831 -19.883 -2.267 962 HZ1 LYS 122 3HZ LYS 122 2.500 -21.417 -4.629 963 HZ2 LYS 122 1HZ LYS 122 3.591 -20.153 -4.903 964 HZ3 LYS 122 2HZ LYS 122 2.039 -19.818 -4.321 965 H GLU 123 H GLU 123 7.783 -23.372 -2.000 966 HA GLU 123 HA GLU 123 10.314 -22.593 -3.277 967 HB2 GLU 123 2HB GLU 123 10.566 -25.083 -3.656 968 HB3 GLU 123 3HB GLU 123 10.641 -24.551 -1.982 969 HG2 GLU 123 2HG GLU 123 8.646 -25.519 -1.435 970 HG3 GLU 123 3HG GLU 123 8.017 -25.413 -3.078 971 H ALA 124 H ALA 124 8.328 -21.432 -4.543 972 HA ALA 124 HA ALA 124 7.924 -23.087 -6.946 973 HB1 ALA 124 1HB ALA 124 5.737 -23.020 -6.514 974 HB2 ALA 124 2HB ALA 124 5.932 -21.773 -5.282 975 HB3 ALA 124 3HB ALA 124 5.814 -21.322 -6.983 976 H GLY 125 H GLY 125 7.439 -19.692 -5.940 977 HA2 GLY 125 2HA GLY 125 8.729 -17.858 -6.718 978 HA3 GLY 125 3HA GLY 125 9.298 -18.857 -8.048 979 H GLY 126 H GLY 126 8.776 -17.429 -9.676 980 HA2 GLY 126 2HA GLY 126 6.113 -17.543 -10.654 981 HA3 GLY 126 3HA GLY 126 6.432 -15.965 -9.948 982 H LYS 127 H LYS 127 8.487 -18.150 -11.859 983 HA LYS 127 HA LYS 127 9.190 -15.899 -13.578 984 HB2 LYS 127 2HB LYS 127 10.381 -18.592 -13.036 985 HB3 LYS 127 3HB LYS 127 10.782 -17.757 -14.531 986 HG2 LYS 127 2HG LYS 127 11.076 -16.412 -11.870 987 HG3 LYS 127 3HG LYS 127 12.337 -17.460 -12.523 988 HD2 LYS 127 2HD LYS 127 11.188 -15.205 -14.137 989 HD3 LYS 127 3HD LYS 127 12.496 -14.935 -12.983 990 HE2 LYS 127 2HE LYS 127 13.222 -17.190 -14.497 991 HE3 LYS 127 3HE LYS 127 12.609 -16.000 -15.644 992 HZ1 LYS 127 3HZ LYS 127 15.085 -15.956 -14.980 993 HZ2 LYS 127 1HZ LYS 127 14.539 -15.189 -13.574 994 HZ3 LYS 127 2HZ LYS 127 14.241 -14.494 -15.086 995 H GLU 128 H GLU 128 8.304 -15.609 -15.511 996 HA GLU 128 HA GLU 128 7.499 -17.869 -17.134 997 HB2 GLU 128 2HB GLU 128 5.568 -16.070 -15.784 998 HB3 GLU 128 3HB GLU 128 5.241 -16.445 -17.470 999 HG2 GLU 128 2HG GLU 128 5.920 -18.846 -16.076 1000 HG3 GLU 128 3HG GLU 128 4.648 -17.991 -15.204 1001 H GLU 129 H GLU 129 7.978 -17.477 -19.195 1002 HA GLU 129 HA GLU 129 8.024 -14.696 -20.139 1003 HB2 GLU 129 2HB GLU 129 10.323 -16.050 -19.576 1004 HB3 GLU 129 3HB GLU 129 10.102 -16.447 -21.274 1005 HG2 GLU 129 2HG GLU 129 11.482 -14.521 -21.151 1006 HG3 GLU 129 3HG GLU 129 9.904 -14.013 -21.750 1007 H GLY 130 H GLY 130 8.079 -14.553 -22.548 1008 HA2 GLY 130 2HA GLY 130 7.413 -15.227 -24.662 1009 HA3 GLY 130 3HA GLY 130 7.264 -16.869 -24.055 1010 HA PRO 131 HA PRO 131 3.118 -14.583 -23.003 1011 HB2 PRO 131 2HB PRO 131 2.724 -12.210 -24.262 1012 HB3 PRO 131 3HB PRO 131 3.481 -12.339 -22.670 1013 HG2 PRO 131 2HG PRO 131 4.762 -12.013 -25.355 1014 HG3 PRO 131 3HG PRO 131 5.154 -11.210 -23.824 1015 HD2 PRO 131 2HD PRO 131 6.583 -13.303 -24.779 1016 HD3 PRO 131 3HD PRO 131 6.359 -13.012 -23.042 1017 HA PRO 132 HA PRO 132 1.007 -15.923 -26.620 1018 HB2 PRO 132 2HB PRO 132 -1.396 -14.676 -26.410 1019 HB3 PRO 132 3HB PRO 132 -0.913 -16.014 -25.361 1020 HG2 PRO 132 2HG PRO 132 -0.857 -13.070 -24.823 1021 HG3 PRO 132 3HG PRO 132 -1.377 -14.392 -23.761 1022 HD2 PRO 132 2HD PRO 132 1.053 -13.217 -23.541 1023 HD3 PRO 132 3HD PRO 132 0.783 -14.931 -23.165 1024 H GLN 133 H GLN 133 1.248 -12.473 -26.089 1025 HA GLN 133 HA GLN 133 1.459 -10.708 -27.507 1026 HB2 GLN 133 2HB GLN 133 3.075 -12.477 -28.555 1027 HB3 GLN 133 3HB GLN 133 1.853 -12.577 -29.815 1028 HG2 GLN 133 2HG GLN 133 2.265 -9.857 -29.469 1029 HG3 GLN 133 3HG GLN 133 3.873 -10.569 -29.355 1030 HE21 GLN 133 1HE2 GLN 133 2.014 -9.084 -31.435 1031 HE22 GLN 133 2HE2 GLN 133 2.414 -9.897 -32.906 1032 H ALA 134 H ALA 134 -1.034 -10.996 -26.986 1033 HA ALA 134 HA ALA 134 -2.698 -11.621 -29.237 1034 HB1 ALA 134 1HB ALA 134 -3.132 -10.640 -26.469 1035 HB2 ALA 134 2HB ALA 134 -4.402 -10.347 -27.657 1036 HB3 ALA 134 3HB ALA 134 -3.872 -11.995 -27.321 1037 H TYR 135 H TYR 135 -2.064 -10.292 -30.933 1038 HA TYR 135 HA TYR 135 -2.844 -7.473 -30.635 1039 HB2 TYR 135 2HB TYR 135 -0.294 -7.942 -30.707 1040 HB3 TYR 135 3HB TYR 135 -0.559 -8.278 -32.414 1041 HD1 TYR 135 HD2 TYR 135 -0.791 -5.665 -29.809 1042 HD2 TYR 135 HD1 TYR 135 -0.873 -6.517 -33.977 1043 HE1 TYR 135 HE2 TYR 135 -0.650 -3.259 -30.298 1044 HE2 TYR 135 HE1 TYR 135 -0.731 -4.113 -34.477 1045 HH TYR 135 HH TYR 135 0.280 -1.878 -32.487 Start of MODEL 19 1 H21 MYR 1 1H2 MYR 1 6.259 10.693 2.973 2 H22 MYR 1 2H2 MYR 1 7.656 11.183 2.035 3 H31 MYR 1 1H3 MYR 1 6.619 9.823 0.411 4 H32 MYR 1 2H3 MYR 1 5.806 11.339 0.016 5 H41 MYR 1 1H4 MYR 1 3.778 10.399 0.505 6 H42 MYR 1 2H4 MYR 1 4.277 10.154 2.181 7 H51 MYR 1 1H5 MYR 1 5.289 7.936 1.613 8 H52 MYR 1 2H5 MYR 1 4.976 8.191 -0.105 9 H61 MYR 1 1H6 MYR 1 2.539 8.459 1.664 10 H62 MYR 1 2H6 MYR 1 3.260 6.848 1.652 11 H71 MYR 1 1H7 MYR 1 3.096 7.979 -1.103 12 H72 MYR 1 2H7 MYR 1 1.513 7.968 -0.322 13 H81 MYR 1 1H8 MYR 1 3.193 5.441 -0.038 14 H82 MYR 1 2H8 MYR 1 2.555 5.790 -1.646 15 H91 MYR 1 1H9 MYR 1 0.739 4.587 -0.806 16 H92 MYR 1 2H9 MYR 1 0.235 6.200 -0.302 17 H101 MYR 1 1H10 MYR 1 0.239 5.557 1.877 18 H102 MYR 1 2H10 MYR 1 1.962 5.221 1.818 19 H111 MYR 1 1H11 MYR 1 -0.373 3.274 1.284 20 H112 MYR 1 2H11 MYR 1 0.792 3.231 2.597 21 H121 MYR 1 1H12 MYR 1 1.955 1.700 1.364 22 H122 MYR 1 2H12 MYR 1 2.517 3.062 0.395 23 H131 MYR 1 1H13 MYR 1 1.379 2.308 -1.448 24 H132 MYR 1 2H13 MYR 1 -0.152 2.314 -0.570 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 7.847 13.190 3.201 29 HA2 GLY 2 2HA GLY 2 6.666 15.455 2.211 30 HA3 GLY 2 3HA GLY 2 5.609 14.955 3.523 31 H ASN 3 H ASN 3 6.472 17.273 4.054 32 HA ASN 3 HA ASN 3 9.099 17.364 5.221 33 HB2 ASN 3 2HB ASN 3 6.786 19.298 5.153 34 HB3 ASN 3 3HB ASN 3 8.255 19.628 6.067 35 HD21 ASN 3 1HD2 ASN 3 10.210 19.916 4.950 36 HD22 ASN 3 2HD2 ASN 3 10.234 20.338 3.275 37 H GLY 4 H GLY 4 5.864 16.704 6.312 38 HA2 GLY 4 2HA GLY 4 6.187 17.196 9.063 39 HA3 GLY 4 3HA GLY 4 5.022 16.087 8.355 40 H ALA 5 H ALA 5 6.134 13.996 7.488 41 HA ALA 5 HA ALA 5 8.492 13.060 8.709 42 HB1 ALA 5 1HB ALA 5 7.858 12.463 10.747 43 HB2 ALA 5 2HB ALA 5 6.239 13.091 10.435 44 HB3 ALA 5 3HB ALA 5 6.621 11.411 10.058 45 H SER 6 H SER 6 9.000 10.921 8.117 46 HA SER 6 HA SER 6 7.066 9.598 6.339 47 HB2 SER 6 2HB SER 6 8.737 9.173 4.686 48 HB3 SER 6 3HB SER 6 8.848 10.889 5.074 49 HG SER 6 HG SER 6 10.832 9.344 5.049 50 H ARG 7 H ARG 7 7.454 8.926 9.004 51 HA ARG 7 HA ARG 7 9.372 6.882 9.391 52 HB2 ARG 7 2HB ARG 7 7.788 8.267 11.060 53 HB3 ARG 7 3HB ARG 7 6.841 6.790 10.937 54 HG2 ARG 7 2HG ARG 7 8.138 5.898 12.489 55 HG3 ARG 7 3HG ARG 7 9.481 5.963 11.347 56 HD2 ARG 7 2HD ARG 7 8.693 8.281 13.096 57 HD3 ARG 7 3HD ARG 7 9.872 7.065 13.586 58 HE ARG 7 HE ARG 7 10.713 7.973 11.128 59 HH11 ARG 7 1HH1 ARG 7 10.094 9.364 14.259 60 HH12 ARG 7 2HH1 ARG 7 11.279 10.615 14.082 61 HH21 ARG 7 1HH2 ARG 7 12.276 9.616 10.883 62 HH22 ARG 7 2HH2 ARG 7 12.519 10.759 12.161 63 H ASP 8 H ASP 8 5.867 6.725 8.770 64 HA ASP 8 HA ASP 8 5.648 3.947 8.640 65 HB2 ASP 8 2HB ASP 8 4.049 6.165 7.377 66 HB3 ASP 8 3HB ASP 8 3.628 4.471 7.140 67 H TRP 9 H TRP 9 6.593 6.290 6.197 68 HA TRP 9 HA TRP 9 6.522 4.510 3.990 69 HB2 TRP 9 2HB TRP 9 6.486 6.885 3.591 70 HB3 TRP 9 3HB TRP 9 8.019 7.099 4.432 71 HD1 TRP 9 HD1 TRP 9 10.219 6.728 3.060 72 HE1 TRP 9 HE1 TRP 9 10.708 6.257 0.577 73 HE3 TRP 9 HE3 TRP 9 5.484 5.595 1.500 74 HZ2 TRP 9 HZ2 TRP 9 9.276 5.505 -1.736 75 HZ3 TRP 9 HZ3 TRP 9 5.129 5.011 -0.864 76 HH2 TRP 9 HH2 TRP 9 6.987 4.968 -2.447 77 H LYS 10 H LYS 10 9.263 5.766 5.898 78 HA LYS 10 HA LYS 10 11.272 4.264 4.706 79 HB2 LYS 10 2HB LYS 10 10.936 5.553 7.377 80 HB3 LYS 10 3HB LYS 10 12.295 4.462 7.142 81 HG2 LYS 10 2HG LYS 10 12.822 5.869 5.069 82 HG3 LYS 10 3HG LYS 10 11.710 7.054 5.758 83 HD2 LYS 10 2HD LYS 10 13.101 6.865 7.891 84 HD3 LYS 10 3HD LYS 10 14.298 6.031 6.897 85 HE2 LYS 10 2HE LYS 10 14.563 7.942 5.489 86 HE3 LYS 10 3HE LYS 10 13.193 8.756 6.243 87 HZ1 LYS 10 3HZ LYS 10 15.932 8.546 7.137 88 HZ2 LYS 10 1HZ LYS 10 14.781 8.291 8.351 89 HZ3 LYS 10 2HZ LYS 10 14.773 9.733 7.467 90 H MET 11 H MET 11 9.215 3.459 7.483 91 HA MET 11 HA MET 11 10.429 0.961 8.026 92 HB2 MET 11 2HB MET 11 7.900 2.322 8.819 93 HB3 MET 11 3HB MET 11 8.009 0.584 9.069 94 HG2 MET 11 2HG MET 11 10.070 0.933 10.375 95 HG3 MET 11 3HG MET 11 9.869 2.673 10.179 96 HE1 MET 11 3HE MET 11 7.690 -0.097 13.059 97 HE2 MET 11 1HE MET 11 8.113 -0.590 11.420 98 HE3 MET 11 2HE MET 11 9.382 -0.157 12.565 99 H ALA 12 H ALA 12 7.498 1.845 6.218 100 HA ALA 12 HA ALA 12 6.586 -0.668 5.538 101 HB1 ALA 12 1HB ALA 12 5.497 0.377 3.629 102 HB2 ALA 12 2HB ALA 12 5.368 1.402 5.059 103 HB3 ALA 12 3HB ALA 12 6.534 1.794 3.796 104 H ILE 13 H ILE 13 9.190 1.205 4.086 105 HA ILE 13 HA ILE 13 9.599 -0.699 1.954 106 HB ILE 13 HB ILE 13 11.294 1.646 2.821 107 HG12 ILE 13 2HG1 ILE 13 9.029 2.250 2.014 108 HG13 ILE 13 3HG1 ILE 13 10.301 2.820 0.938 109 HG21 ILE 13 1HG2 ILE 13 12.856 0.687 1.544 110 HG22 ILE 13 2HG2 ILE 13 11.714 -0.471 0.866 111 HG23 ILE 13 3HG2 ILE 13 11.841 1.147 0.177 112 HD11 ILE 13 3HD1 ILE 13 9.852 1.046 -0.612 113 HD12 ILE 13 1HD1 ILE 13 8.687 0.321 0.495 114 HD13 ILE 13 2HD1 ILE 13 8.347 1.887 -0.242 115 H LYS 14 H LYS 14 11.074 0.099 5.048 116 HA LYS 14 HA LYS 14 13.406 -1.429 4.832 117 HB2 LYS 14 2HB LYS 14 11.826 -0.244 7.023 118 HB3 LYS 14 3HB LYS 14 12.831 -1.611 7.485 119 HG2 LYS 14 2HG LYS 14 14.685 -0.306 6.182 120 HG3 LYS 14 3HG LYS 14 13.628 1.076 6.479 121 HD2 LYS 14 2HD LYS 14 15.111 1.055 8.298 122 HD3 LYS 14 3HD LYS 14 13.628 0.331 8.922 123 HE2 LYS 14 2HE LYS 14 14.549 -1.756 9.073 124 HE3 LYS 14 3HE LYS 14 15.676 -1.474 7.747 125 HZ1 LYS 14 3HZ LYS 14 15.897 -0.356 10.490 126 HZ2 LYS 14 1HZ LYS 14 16.965 -0.036 9.217 127 HZ3 LYS 14 2HZ LYS 14 16.841 -1.602 9.844 128 H ARG 15 H ARG 15 10.113 -2.363 5.368 129 HA ARG 15 HA ARG 15 10.874 -5.058 6.190 130 HB2 ARG 15 2HB ARG 15 8.443 -3.413 6.338 131 HB3 ARG 15 3HB ARG 15 8.150 -5.100 5.936 132 HG2 ARG 15 2HG ARG 15 8.236 -5.537 8.105 133 HG3 ARG 15 3HG ARG 15 9.964 -5.183 8.039 134 HD2 ARG 15 2HD ARG 15 9.316 -2.745 8.368 135 HD3 ARG 15 3HD ARG 15 7.708 -3.340 8.779 136 HE ARG 15 HE ARG 15 8.515 -3.964 10.819 137 HH11 ARG 15 1HH1 ARG 15 11.195 -3.547 8.637 138 HH12 ARG 15 2HH1 ARG 15 12.397 -3.772 9.864 139 HH21 ARG 15 1HH2 ARG 15 10.088 -4.262 12.443 140 HH22 ARG 15 2HH2 ARG 15 11.767 -4.180 12.028 141 H CYS 16 H CYS 16 8.823 -3.562 3.683 142 HA CYS 16 HA CYS 16 8.398 -5.870 2.174 143 HB2 CYS 16 2HB CYS 16 7.203 -3.653 1.947 144 HB3 CYS 16 3HB CYS 16 8.602 -3.073 1.052 145 HG CYS 16 HG CYS 16 7.134 -3.611 -1.055 146 H SER 17 H SER 17 11.182 -3.867 2.463 147 HA SER 17 HA SER 17 12.473 -4.197 0.048 148 HB2 SER 17 2HB SER 17 13.345 -3.749 2.845 149 HB3 SER 17 3HB SER 17 14.578 -4.346 1.734 150 HG SER 17 HG SER 17 14.603 -2.136 1.608 151 H ASN 18 H ASN 18 11.978 -6.508 2.610 152 HA ASN 18 HA ASN 18 13.761 -8.443 1.342 153 HB2 ASN 18 2HB ASN 18 12.227 -8.495 3.946 154 HB3 ASN 18 3HB ASN 18 13.163 -9.860 3.343 155 HD21 ASN 18 1HD2 ASN 18 13.465 -6.408 4.068 156 HD22 ASN 18 2HD2 ASN 18 15.086 -6.498 4.659 157 H VAL 19 H VAL 19 11.482 -7.703 -0.141 158 HA VAL 19 HA VAL 19 9.571 -9.883 0.160 159 HB VAL 19 HB VAL 19 8.725 -7.620 -0.324 160 HG11 VAL 19 1HG1 VAL 19 10.062 -7.932 -3.009 161 HG12 VAL 19 2HG1 VAL 19 9.089 -6.567 -2.460 162 HG13 VAL 19 3HG1 VAL 19 10.650 -6.896 -1.709 163 HG21 VAL 19 3HG2 VAL 19 7.447 -9.604 -1.008 164 HG22 VAL 19 1HG2 VAL 19 7.186 -8.244 -2.099 165 HG23 VAL 19 2HG2 VAL 19 8.248 -9.568 -2.579 166 H ALA 20 H ALA 20 9.366 -11.581 -1.213 167 HA ALA 20 HA ALA 20 11.299 -11.749 -3.433 168 HB1 ALA 20 1HB ALA 20 10.350 -14.259 -2.190 169 HB2 ALA 20 2HB ALA 20 11.934 -13.842 -2.844 170 HB3 ALA 20 3HB ALA 20 11.464 -13.272 -1.243 171 H VAL 21 H VAL 21 10.644 -12.875 -5.307 172 HA VAL 21 HA VAL 21 7.966 -12.454 -6.076 173 HB VAL 21 HB VAL 21 10.025 -14.226 -7.399 174 HG11 VAL 21 1HG1 VAL 21 8.685 -13.800 -9.442 175 HG12 VAL 21 2HG1 VAL 21 7.816 -14.727 -8.217 176 HG13 VAL 21 3HG1 VAL 21 7.468 -13.012 -8.438 177 HG21 VAL 21 3HG2 VAL 21 11.059 -12.400 -8.141 178 HG22 VAL 21 1HG2 VAL 21 9.537 -11.676 -8.660 179 HG23 VAL 21 2HG2 VAL 21 10.091 -11.469 -6.998 180 H GLY 22 H GLY 22 9.733 -15.416 -5.218 181 HA2 GLY 22 2HA GLY 22 7.137 -16.819 -5.099 182 HA3 GLY 22 3HA GLY 22 8.673 -17.606 -5.430 183 H VAL 23 H VAL 23 7.776 -19.004 -3.649 184 HA VAL 23 HA VAL 23 8.228 -17.852 -0.987 185 HB VAL 23 HB VAL 23 6.990 -20.508 -1.726 186 HG11 VAL 23 1HG1 VAL 23 7.529 -19.139 0.878 187 HG12 VAL 23 2HG1 VAL 23 6.160 -20.241 0.717 188 HG13 VAL 23 3HG1 VAL 23 7.799 -20.820 0.421 189 HG21 VAL 23 3HG2 VAL 23 5.659 -17.972 -0.776 190 HG22 VAL 23 1HG2 VAL 23 5.643 -18.569 -2.435 191 HG23 VAL 23 2HG2 VAL 23 4.862 -19.498 -1.156 192 H GLY 24 H GLY 24 8.943 -20.885 -2.737 193 HA2 GLY 24 2HA GLY 24 11.394 -21.112 -1.106 194 HA3 GLY 24 3HA GLY 24 10.518 -22.481 -1.774 195 H GLY 25 H GLY 25 12.841 -22.908 -2.467 196 HA2 GLY 25 2HA GLY 25 14.271 -23.191 -4.243 197 HA3 GLY 25 3HA GLY 25 13.035 -22.459 -5.257 198 H LYS 26 H LYS 26 14.874 -21.508 -6.384 199 HA LYS 26 HA LYS 26 16.194 -19.323 -4.948 200 HB2 LYS 26 2HB LYS 26 16.767 -20.797 -7.494 201 HB3 LYS 26 3HB LYS 26 17.444 -19.193 -7.245 202 HG2 LYS 26 2HG LYS 26 17.805 -21.424 -5.268 203 HG3 LYS 26 3HG LYS 26 18.910 -21.150 -6.617 204 HD2 LYS 26 2HD LYS 26 19.160 -18.783 -5.765 205 HD3 LYS 26 3HD LYS 26 18.302 -19.307 -4.314 206 HE2 LYS 26 2HE LYS 26 20.028 -20.668 -3.625 207 HE3 LYS 26 3HE LYS 26 20.663 -20.867 -5.257 208 HZ1 LYS 26 3HZ LYS 26 21.349 -18.500 -5.160 209 HZ2 LYS 26 1HZ LYS 26 22.146 -19.484 -4.038 210 HZ3 LYS 26 2HZ LYS 26 20.895 -18.466 -3.531 211 H SER 27 H SER 27 14.278 -18.008 -4.862 212 HA SER 27 HA SER 27 13.321 -16.964 -7.421 213 HB2 SER 27 2HB SER 27 12.171 -17.304 -4.773 214 HB3 SER 27 3HB SER 27 11.928 -15.668 -5.382 215 HG SER 27 HG SER 27 11.133 -18.116 -6.554 216 H LYS 28 H LYS 28 12.816 -14.529 -7.374 217 HA LYS 28 HA LYS 28 15.261 -13.153 -6.516 218 HB2 LYS 28 2HB LYS 28 13.171 -12.399 -8.565 219 HB3 LYS 28 3HB LYS 28 14.551 -11.395 -8.140 220 HG2 LYS 28 2HG LYS 28 15.639 -13.884 -8.747 221 HG3 LYS 28 3HG LYS 28 14.387 -13.619 -9.962 222 HD2 LYS 28 2HD LYS 28 16.229 -11.371 -9.325 223 HD3 LYS 28 3HD LYS 28 16.853 -12.714 -10.285 224 HE2 LYS 28 2HE LYS 28 15.096 -12.409 -11.918 225 HE3 LYS 28 3HE LYS 28 14.357 -11.149 -10.931 226 HZ1 LYS 28 3HZ LYS 28 17.021 -10.442 -11.352 227 HZ2 LYS 28 1HZ LYS 28 15.634 -9.678 -11.949 228 HZ3 LYS 28 2HZ LYS 28 16.385 -10.893 -12.854 229 H LYS 29 H LYS 29 14.899 -10.754 -6.003 230 HA LYS 29 HA LYS 29 12.467 -10.414 -4.380 231 HB2 LYS 29 2HB LYS 29 15.302 -9.721 -3.592 232 HB3 LYS 29 3HB LYS 29 13.874 -9.212 -2.700 233 HG2 LYS 29 2HG LYS 29 14.019 -11.085 -1.532 234 HG3 LYS 29 3HG LYS 29 13.611 -11.975 -3.001 235 HD2 LYS 29 2HD LYS 29 15.594 -12.985 -2.593 236 HD3 LYS 29 3HD LYS 29 16.233 -11.567 -3.428 237 HE2 LYS 29 2HE LYS 29 15.811 -11.054 -0.610 238 HE3 LYS 29 3HE LYS 29 16.878 -12.434 -0.865 239 HZ1 LYS 29 3HZ LYS 29 18.102 -10.345 -0.746 240 HZ2 LYS 29 1HZ LYS 29 17.239 -9.743 -2.071 241 HZ3 LYS 29 2HZ LYS 29 18.275 -11.065 -2.267 242 H PHE 30 H PHE 30 12.055 -8.104 -3.815 243 HA PHE 30 HA PHE 30 12.815 -6.377 -6.075 244 HB2 PHE 30 2HB PHE 30 10.391 -6.034 -4.309 245 HB3 PHE 30 3HB PHE 30 10.717 -5.258 -5.855 246 HD1 PHE 30 HD1 PHE 30 11.451 -7.358 -7.631 247 HD2 PHE 30 HD2 PHE 30 8.565 -7.405 -4.502 248 HE1 PHE 30 HE1 PHE 30 10.229 -9.152 -8.789 249 HE2 PHE 30 HE2 PHE 30 7.339 -9.199 -5.655 250 HZ PHE 30 HZ PHE 30 8.171 -10.076 -7.801 251 H GLY 31 H GLY 31 12.656 -3.969 -5.495 252 HA2 GLY 31 2HA GLY 31 13.636 -3.478 -2.763 253 HA3 GLY 31 3HA GLY 31 14.582 -2.922 -4.136 254 H GLU 32 H GLU 32 14.188 -0.874 -2.813 255 HA GLU 32 HA GLU 32 11.711 0.374 -2.649 256 HB2 GLU 32 2HB GLU 32 14.318 1.802 -3.173 257 HB3 GLU 32 3HB GLU 32 12.901 2.432 -2.346 258 HG2 GLU 32 2HG GLU 32 13.837 1.827 -0.438 259 HG3 GLU 32 3HG GLU 32 13.607 0.147 -0.922 260 H GLY 33 H GLY 33 14.108 0.476 -5.268 261 HA2 GLY 33 2HA GLY 33 12.721 2.291 -6.918 262 HA3 GLY 33 3HA GLY 33 13.936 1.142 -7.458 263 H ASN 34 H ASN 34 12.539 -1.219 -6.631 264 HA ASN 34 HA ASN 34 11.017 -1.715 -8.936 265 HB2 ASN 34 2HB ASN 34 12.204 -3.364 -7.303 266 HB3 ASN 34 3HB ASN 34 10.676 -3.332 -6.429 267 HD21 ASN 34 1HD2 ASN 34 8.723 -3.776 -7.767 268 HD22 ASN 34 2HD2 ASN 34 8.854 -4.999 -8.980 269 H PHE 35 H PHE 35 10.041 -0.999 -5.606 270 HA PHE 35 HA PHE 35 7.271 -1.305 -5.986 271 HB2 PHE 35 2HB PHE 35 8.553 0.605 -4.032 272 HB3 PHE 35 3HB PHE 35 7.003 -0.217 -3.880 273 HD1 PHE 35 HD1 PHE 35 7.694 -2.971 -4.578 274 HD2 PHE 35 HD2 PHE 35 9.818 -0.119 -2.238 275 HE1 PHE 35 HE1 PHE 35 8.785 -4.799 -3.345 276 HE2 PHE 35 HE2 PHE 35 10.913 -1.943 -1.002 277 HZ PHE 35 HZ PHE 35 10.397 -4.287 -1.556 278 H ARG 36 H ARG 36 9.323 1.599 -6.078 279 HA ARG 36 HA ARG 36 7.333 3.472 -6.605 280 HB2 ARG 36 2HB ARG 36 10.135 3.574 -7.724 281 HB3 ARG 36 3HB ARG 36 9.079 4.931 -7.354 282 HG2 ARG 36 2HG ARG 36 9.374 3.444 -4.976 283 HG3 ARG 36 3HG ARG 36 10.981 3.630 -5.683 284 HD2 ARG 36 2HD ARG 36 10.058 6.124 -6.015 285 HD3 ARG 36 3HD ARG 36 9.133 5.663 -4.587 286 HE ARG 36 HE ARG 36 11.062 5.736 -3.353 287 HH11 ARG 36 1HH1 ARG 36 11.865 5.722 -6.741 288 HH12 ARG 36 2HH1 ARG 36 13.548 6.038 -6.477 289 HH21 ARG 36 1HH2 ARG 36 13.276 6.153 -2.993 290 HH22 ARG 36 2HH2 ARG 36 14.349 6.282 -4.345 291 H TRP 37 H TRP 37 9.218 1.475 -8.841 292 HA TRP 37 HA TRP 37 8.315 2.582 -11.239 293 HB2 TRP 37 2HB TRP 37 10.177 1.065 -11.252 294 HB3 TRP 37 3HB TRP 37 9.195 -0.232 -10.577 295 HD1 TRP 37 HD1 TRP 37 9.974 1.539 -13.857 296 HE1 TRP 37 HE1 TRP 37 8.964 0.181 -15.797 297 HE3 TRP 37 HE3 TRP 37 7.253 -1.840 -11.152 298 HZ2 TRP 37 HZ2 TRP 37 7.241 -2.029 -16.135 299 HZ3 TRP 37 HZ3 TRP 37 5.951 -3.543 -12.360 300 HH2 TRP 37 HH2 TRP 37 5.946 -3.633 -14.800 301 H ALA 38 H ALA 38 7.022 -0.171 -9.393 302 HA ALA 38 HA ALA 38 4.859 -0.678 -11.148 303 HB1 ALA 38 1HB ALA 38 5.571 -2.422 -9.694 304 HB2 ALA 38 2HB ALA 38 5.315 -1.419 -8.266 305 HB3 ALA 38 3HB ALA 38 3.934 -1.975 -9.212 306 H ILE 39 H ILE 39 4.914 0.872 -7.933 307 HA ILE 39 HA ILE 39 2.270 1.640 -7.790 308 HB ILE 39 HB ILE 39 4.653 3.189 -6.767 309 HG12 ILE 39 2HG1 ILE 39 2.913 1.312 -5.184 310 HG13 ILE 39 3HG1 ILE 39 4.311 0.722 -6.076 311 HG21 ILE 39 1HG2 ILE 39 2.545 3.587 -5.037 312 HG22 ILE 39 2HG2 ILE 39 3.138 4.735 -6.235 313 HG23 ILE 39 3HG2 ILE 39 1.791 3.667 -6.628 314 HD11 ILE 39 3HD1 ILE 39 4.806 1.137 -3.717 315 HD12 ILE 39 1HD1 ILE 39 5.772 2.151 -4.788 316 HD13 ILE 39 2HD1 ILE 39 4.387 2.836 -3.938 317 H ARG 40 H ARG 40 4.983 3.410 -9.243 318 HA ARG 40 HA ARG 40 3.556 5.717 -9.961 319 HB2 ARG 40 2HB ARG 40 6.062 4.433 -11.011 320 HB3 ARG 40 3HB ARG 40 5.406 5.881 -11.762 321 HG2 ARG 40 2HG ARG 40 5.750 5.945 -8.828 322 HG3 ARG 40 3HG ARG 40 7.217 5.945 -9.809 323 HD2 ARG 40 2HD ARG 40 6.871 8.180 -9.791 324 HD3 ARG 40 3HD ARG 40 5.800 7.790 -11.136 325 HE ARG 40 HE ARG 40 4.268 7.586 -8.850 326 HH11 ARG 40 1HH1 ARG 40 6.102 10.057 -10.478 327 HH12 ARG 40 2HH1 ARG 40 5.096 11.353 -9.922 328 HH21 ARG 40 1HH2 ARG 40 2.936 9.284 -8.112 329 HH22 ARG 40 2HH2 ARG 40 3.296 10.913 -8.575 330 H MET 41 H MET 41 4.239 2.749 -11.789 331 HA MET 41 HA MET 41 3.137 3.430 -14.225 332 HB2 MET 41 2HB MET 41 4.354 1.292 -13.599 333 HB3 MET 41 3HB MET 41 2.824 0.710 -12.958 334 HG2 MET 41 2HG MET 41 2.077 0.172 -14.975 335 HG3 MET 41 3HG MET 41 2.541 1.734 -15.647 336 HE1 MET 41 3HE MET 41 5.191 1.703 -17.435 337 HE2 MET 41 1HE MET 41 4.317 0.444 -18.308 338 HE3 MET 41 2HE MET 41 3.428 1.726 -17.487 339 H ALA 42 H ALA 42 1.505 2.189 -11.339 340 HA ALA 42 HA ALA 42 -1.080 2.147 -12.594 341 HB1 ALA 42 1HB ALA 42 -1.334 2.149 -9.769 342 HB2 ALA 42 2HB ALA 42 -1.518 0.798 -10.889 343 HB3 ALA 42 3HB ALA 42 0.061 1.156 -10.190 344 H ASN 43 H ASN 43 0.645 4.298 -10.382 345 HA ASN 43 HA ASN 43 -1.454 6.022 -9.740 346 HB2 ASN 43 2HB ASN 43 1.135 5.870 -9.003 347 HB3 ASN 43 3HB ASN 43 1.227 7.235 -10.111 348 HD21 ASN 43 1HD2 ASN 43 0.548 9.178 -9.452 349 HD22 ASN 43 2HD2 ASN 43 -0.199 9.496 -7.927 350 H VAL 44 H VAL 44 0.297 5.630 -12.673 351 HA VAL 44 HA VAL 44 -0.563 8.218 -13.720 352 HB VAL 44 HB VAL 44 1.091 6.056 -15.031 353 HG11 VAL 44 1HG1 VAL 44 1.692 8.136 -16.494 354 HG12 VAL 44 2HG1 VAL 44 0.228 7.209 -16.828 355 HG13 VAL 44 3HG1 VAL 44 0.127 8.730 -15.940 356 HG21 VAL 44 3HG2 VAL 44 2.408 8.575 -14.453 357 HG22 VAL 44 1HG2 VAL 44 1.815 7.783 -12.993 358 HG23 VAL 44 2HG2 VAL 44 2.911 6.927 -14.079 359 H SER 45 H SER 45 -0.629 4.868 -14.953 360 HA SER 45 HA SER 45 -2.525 5.224 -16.923 361 HB2 SER 45 2HB SER 45 -1.274 3.001 -15.614 362 HB3 SER 45 3HB SER 45 -2.993 2.658 -15.807 363 HG SER 45 HG SER 45 -1.198 3.460 -17.856 364 H THR 46 H THR 46 -3.007 4.580 -13.488 365 HA THR 46 HA THR 46 -5.892 5.057 -13.872 366 HB THR 46 HB THR 46 -6.399 3.630 -12.040 367 HG1 THR 46 HG1 THR 46 -4.990 3.214 -10.507 368 HG21 THR 46 3HG2 THR 46 -5.898 2.475 -14.160 369 HG22 THR 46 1HG2 THR 46 -5.519 1.478 -12.756 370 HG23 THR 46 2HG2 THR 46 -4.223 2.281 -13.643 371 H GLY 47 H GLY 47 -4.279 7.244 -13.627 372 HA2 GLY 47 2HA GLY 47 -5.380 8.546 -11.363 373 HA3 GLY 47 3HA GLY 47 -3.690 8.165 -11.069 374 H ARG 48 H ARG 48 -2.422 8.644 -13.354 375 HA ARG 48 HA ARG 48 -1.532 10.278 -14.663 376 HB2 ARG 48 2HB ARG 48 -4.254 10.343 -15.166 377 HB3 ARG 48 3HB ARG 48 -3.870 12.019 -14.798 378 HG2 ARG 48 2HG ARG 48 -1.887 10.955 -16.561 379 HG3 ARG 48 3HG ARG 48 -3.496 10.649 -17.218 380 HD2 ARG 48 2HD ARG 48 -4.052 12.965 -17.135 381 HD3 ARG 48 3HD ARG 48 -2.600 13.340 -16.208 382 HE ARG 48 HE ARG 48 -1.764 12.209 -18.598 383 HH11 ARG 48 1HH1 ARG 48 -3.501 15.036 -17.544 384 HH12 ARG 48 2HH1 ARG 48 -2.982 16.012 -18.878 385 HH21 ARG 48 1HH2 ARG 48 -1.074 13.483 -20.359 386 HH22 ARG 48 2HH2 ARG 48 -1.603 15.127 -20.479 387 H GLU 49 H GLU 49 -0.892 12.571 -14.678 388 HA GLU 49 HA GLU 49 -0.127 14.447 -13.644 389 HB2 GLU 49 2HB GLU 49 -2.826 14.067 -12.590 390 HB3 GLU 49 3HB GLU 49 -1.778 14.945 -11.485 391 HG2 GLU 49 2HG GLU 49 -1.191 16.306 -13.660 392 HG3 GLU 49 3HG GLU 49 -2.767 15.711 -14.177 393 HA PRO 50 HA PRO 50 2.401 13.226 -10.274 394 HB2 PRO 50 2HB PRO 50 2.834 15.575 -8.984 395 HB3 PRO 50 3HB PRO 50 3.557 15.192 -10.551 396 HG2 PRO 50 2HG PRO 50 1.142 16.851 -9.932 397 HG3 PRO 50 3HG PRO 50 2.452 17.168 -11.085 398 HD2 PRO 50 2HD PRO 50 0.046 16.188 -11.848 399 HD3 PRO 50 3HD PRO 50 1.555 15.768 -12.682 400 H GLY 51 H GLY 51 -0.095 15.541 -9.188 401 HA2 GLY 51 2HA GLY 51 -0.145 14.387 -6.541 402 HA3 GLY 51 3HA GLY 51 -1.167 15.688 -7.134 403 H ASP 52 H ASP 52 -0.692 12.184 -7.254 404 HA ASP 52 HA ASP 52 -3.562 11.802 -7.137 405 HB2 ASP 52 2HB ASP 52 -2.639 11.931 -9.624 406 HB3 ASP 52 3HB ASP 52 -2.199 10.258 -9.294 407 H ILE 53 H ILE 53 -1.895 11.254 -5.131 408 HA ILE 53 HA ILE 53 -1.905 8.327 -5.072 409 HB ILE 53 HB ILE 53 0.388 8.801 -5.572 410 HG12 ILE 53 2HG1 ILE 53 0.758 8.476 -2.670 411 HG13 ILE 53 3HG1 ILE 53 -0.428 7.386 -3.378 412 HG21 ILE 53 1HG2 ILE 53 1.355 10.276 -3.395 413 HG22 ILE 53 2HG2 ILE 53 1.239 10.790 -5.077 414 HG23 ILE 53 3HG2 ILE 53 -0.082 11.127 -3.959 415 HD11 ILE 53 3HD1 ILE 53 2.495 7.619 -3.959 416 HD12 ILE 53 1HD1 ILE 53 1.563 6.201 -3.480 417 HD13 ILE 53 2HD1 ILE 53 1.391 6.862 -5.106 418 HA PRO 54 HA PRO 54 -3.886 10.132 -1.321 419 HB2 PRO 54 2HB PRO 54 -5.867 8.277 -1.218 420 HB3 PRO 54 3HB PRO 54 -5.968 9.736 -2.210 421 HG2 PRO 54 2HG PRO 54 -5.240 6.946 -3.013 422 HG3 PRO 54 3HG PRO 54 -6.286 8.112 -3.843 423 HD2 PRO 54 2HD PRO 54 -3.722 7.666 -4.591 424 HD3 PRO 54 3HD PRO 54 -4.503 9.251 -4.759 425 H GLU 55 H GLU 55 -2.907 9.617 0.525 426 HA GLU 55 HA GLU 55 -1.746 7.032 0.964 427 HB2 GLU 55 2HB GLU 55 -2.064 9.248 2.987 428 HB3 GLU 55 3HB GLU 55 -0.891 7.939 3.007 429 HG2 GLU 55 2HG GLU 55 0.527 9.369 2.084 430 HG3 GLU 55 3HG GLU 55 -0.407 9.184 0.600 431 H THR 56 H THR 56 -3.975 6.025 0.666 432 HA THR 56 HA THR 56 -5.057 5.482 3.322 433 HB THR 56 HB THR 56 -7.340 5.785 2.720 434 HG1 THR 56 HG1 THR 56 -8.016 6.047 0.669 435 HG21 THR 56 3HG2 THR 56 -6.031 7.842 3.303 436 HG22 THR 56 1HG2 THR 56 -7.477 8.147 2.343 437 HG23 THR 56 2HG2 THR 56 -5.889 8.171 1.577 438 H LEU 57 H LEU 57 -6.018 3.448 3.536 439 HA LEU 57 HA LEU 57 -5.040 1.455 1.750 440 HB2 LEU 57 2HB LEU 57 -6.598 1.511 4.267 441 HB3 LEU 57 3HB LEU 57 -6.756 0.072 3.263 442 HG LEU 57 HG LEU 57 -4.118 1.141 4.256 443 HD11 LEU 57 1HD1 LEU 57 -4.957 0.486 6.257 444 HD12 LEU 57 2HD1 LEU 57 -4.443 -1.094 5.667 445 HD13 LEU 57 3HD1 LEU 57 -6.134 -0.610 5.534 446 HD21 LEU 57 3HD2 LEU 57 -3.607 -0.204 2.459 447 HD22 LEU 57 1HD2 LEU 57 -4.998 -1.258 2.713 448 HD23 LEU 57 2HD2 LEU 57 -3.598 -1.374 3.779 449 H ASP 58 H ASP 58 -8.128 3.037 2.231 450 HA ASP 58 HA ASP 58 -9.722 1.262 0.727 451 HB2 ASP 58 2HB ASP 58 -10.267 3.400 2.276 452 HB3 ASP 58 3HB ASP 58 -10.422 4.143 0.687 453 H GLN 59 H GLN 59 -8.040 4.259 -0.176 454 HA GLN 59 HA GLN 59 -8.868 4.266 -2.873 455 HB2 GLN 59 2HB GLN 59 -6.508 5.527 -1.481 456 HB3 GLN 59 3HB GLN 59 -6.855 5.779 -3.186 457 HG2 GLN 59 2HG GLN 59 -9.061 6.279 -1.284 458 HG3 GLN 59 3HG GLN 59 -7.713 7.414 -1.270 459 HE21 GLN 59 1HE2 GLN 59 -8.533 9.156 -2.239 460 HE22 GLN 59 2HE2 GLN 59 -9.231 9.178 -3.820 461 H LEU 60 H LEU 60 -5.728 3.332 -1.457 462 HA LEU 60 HA LEU 60 -4.546 2.368 -3.774 463 HB2 LEU 60 2HB LEU 60 -3.351 2.739 -1.670 464 HB3 LEU 60 3HB LEU 60 -4.189 1.364 -0.953 465 HG LEU 60 HG LEU 60 -2.980 0.280 -3.186 466 HD11 LEU 60 1HD1 LEU 60 -0.538 1.066 -2.582 467 HD12 LEU 60 2HD1 LEU 60 -1.376 2.552 -2.138 468 HD13 LEU 60 3HD1 LEU 60 -1.510 1.922 -3.779 469 HD21 LEU 60 3HD2 LEU 60 -1.328 -0.586 -1.437 470 HD22 LEU 60 1HD2 LEU 60 -3.041 -0.918 -1.177 471 HD23 LEU 60 2HD2 LEU 60 -2.246 0.375 -0.277 472 H ARG 61 H ARG 61 -6.832 0.836 -1.608 473 HA ARG 61 HA ARG 61 -6.545 -1.812 -2.531 474 HB2 ARG 61 2HB ARG 61 -7.687 -1.355 -0.452 475 HB3 ARG 61 3HB ARG 61 -8.905 -0.398 -1.284 476 HG2 ARG 61 2HG ARG 61 -9.746 -2.368 -2.400 477 HG3 ARG 61 3HG ARG 61 -8.468 -3.350 -1.681 478 HD2 ARG 61 2HD ARG 61 -10.449 -3.708 -0.408 479 HD3 ARG 61 3HD ARG 61 -9.365 -2.716 0.566 480 HE ARG 61 HE ARG 61 -10.926 -1.053 0.523 481 HH11 ARG 61 1HH1 ARG 61 -11.593 -3.283 -2.066 482 HH12 ARG 61 2HH1 ARG 61 -13.085 -2.523 -2.512 483 HH21 ARG 61 1HH2 ARG 61 -12.888 -0.043 -0.055 484 HH22 ARG 61 2HH2 ARG 61 -13.820 -0.679 -1.368 485 H LEU 62 H LEU 62 -8.855 0.739 -3.439 486 HA LEU 62 HA LEU 62 -10.168 -0.778 -5.430 487 HB2 LEU 62 2HB LEU 62 -11.218 1.156 -4.454 488 HB3 LEU 62 3HB LEU 62 -9.924 2.200 -5.039 489 HG LEU 62 HG LEU 62 -10.670 1.598 -7.380 490 HD11 LEU 62 1HD1 LEU 62 -13.376 1.013 -6.665 491 HD12 LEU 62 2HD1 LEU 62 -12.304 -0.202 -5.970 492 HD13 LEU 62 3HD1 LEU 62 -12.277 0.109 -7.706 493 HD21 LEU 62 3HD2 LEU 62 -12.177 3.242 -5.417 494 HD22 LEU 62 1HD2 LEU 62 -12.871 3.017 -7.023 495 HD23 LEU 62 2HD2 LEU 62 -11.269 3.734 -6.848 496 H VAL 63 H VAL 63 -7.183 0.938 -5.387 497 HA VAL 63 HA VAL 63 -6.936 1.417 -8.178 498 HB VAL 63 HB VAL 63 -4.775 1.135 -6.085 499 HG11 VAL 63 1HG1 VAL 63 -3.634 2.700 -7.876 500 HG12 VAL 63 2HG1 VAL 63 -3.562 0.942 -8.016 501 HG13 VAL 63 3HG1 VAL 63 -4.730 1.857 -8.971 502 HG21 VAL 63 3HG2 VAL 63 -5.159 3.251 -5.461 503 HG22 VAL 63 1HG2 VAL 63 -5.395 3.793 -7.123 504 HG23 VAL 63 2HG2 VAL 63 -6.729 3.053 -6.238 505 H ILE 64 H ILE 64 -5.259 -0.966 -6.114 506 HA ILE 64 HA ILE 64 -4.112 -2.458 -8.152 507 HB ILE 64 HB ILE 64 -3.439 -2.792 -5.860 508 HG12 ILE 64 2HG1 ILE 64 -4.716 -5.301 -6.971 509 HG13 ILE 64 3HG1 ILE 64 -3.136 -4.672 -7.422 510 HG21 ILE 64 1HG2 ILE 64 -6.137 -4.042 -5.369 511 HG22 ILE 64 2HG2 ILE 64 -4.839 -3.821 -4.197 512 HG23 ILE 64 3HG2 ILE 64 -5.676 -2.418 -4.860 513 HD11 ILE 64 3HD1 ILE 64 -2.353 -5.011 -5.135 514 HD12 ILE 64 1HD1 ILE 64 -3.935 -5.653 -4.693 515 HD13 ILE 64 2HD1 ILE 64 -2.930 -6.511 -5.861 516 H CYS 65 H CYS 65 -7.314 -2.739 -6.689 517 HA CYS 65 HA CYS 65 -8.054 -5.125 -8.029 518 HB2 CYS 65 2HB CYS 65 -9.539 -2.980 -6.558 519 HB3 CYS 65 3HB CYS 65 -10.438 -4.170 -7.491 520 HG CYS 65 HG CYS 65 -10.568 -5.793 -5.515 521 H ASP 66 H ASP 66 -9.107 -1.762 -8.592 522 HA ASP 66 HA ASP 66 -10.498 -2.183 -10.945 523 HB2 ASP 66 2HB ASP 66 -10.380 -0.051 -9.581 524 HB3 ASP 66 3HB ASP 66 -8.847 0.282 -10.381 525 H LEU 67 H LEU 67 -7.044 -1.728 -10.448 526 HA LEU 67 HA LEU 67 -6.371 -1.496 -13.201 527 HB2 LEU 67 2HB LEU 67 -4.934 -0.702 -11.365 528 HB3 LEU 67 3HB LEU 67 -4.655 -2.374 -10.883 529 HG LEU 67 HG LEU 67 -3.836 -2.463 -13.459 530 HD11 LEU 67 1HD1 LEU 67 -3.093 0.282 -12.458 531 HD12 LEU 67 2HD1 LEU 67 -4.215 -0.061 -13.774 532 HD13 LEU 67 3HD1 LEU 67 -2.511 -0.488 -13.935 533 HD21 LEU 67 3HD2 LEU 67 -2.564 -3.336 -11.631 534 HD22 LEU 67 1HD2 LEU 67 -2.265 -1.717 -10.998 535 HD23 LEU 67 2HD2 LEU 67 -1.535 -2.215 -12.524 536 H GLN 68 H GLN 68 -5.855 -4.181 -10.905 537 HA GLN 68 HA GLN 68 -4.982 -6.082 -12.705 538 HB2 GLN 68 2HB GLN 68 -4.877 -6.497 -10.338 539 HB3 GLN 68 3HB GLN 68 -6.628 -6.423 -10.197 540 HG2 GLN 68 2HG GLN 68 -6.915 -8.534 -10.926 541 HG3 GLN 68 3HG GLN 68 -5.570 -8.441 -12.062 542 HE21 GLN 68 1HE2 GLN 68 -3.588 -9.149 -11.456 543 HE22 GLN 68 2HE2 GLN 68 -3.251 -9.888 -9.932 544 H GLU 69 H GLU 69 -8.220 -4.937 -12.108 545 HA GLU 69 HA GLU 69 -9.594 -7.058 -13.404 546 HB2 GLU 69 2HB GLU 69 -10.693 -5.523 -11.821 547 HB3 GLU 69 3HB GLU 69 -10.466 -4.198 -12.954 548 HG2 GLU 69 2HG GLU 69 -11.947 -5.214 -14.536 549 HG3 GLU 69 3HG GLU 69 -12.066 -6.673 -13.554 550 H ARG 70 H ARG 70 -9.028 -3.703 -14.485 551 HA ARG 70 HA ARG 70 -9.856 -4.106 -17.128 552 HB2 ARG 70 2HB ARG 70 -8.106 -2.062 -15.798 553 HB3 ARG 70 3HB ARG 70 -8.318 -2.050 -17.543 554 HG2 ARG 70 2HG ARG 70 -10.845 -2.068 -16.999 555 HG3 ARG 70 3HG ARG 70 -10.330 -1.543 -15.395 556 HD2 ARG 70 2HD ARG 70 -8.969 0.242 -16.665 557 HD3 ARG 70 3HD ARG 70 -10.013 -0.151 -18.030 558 HE ARG 70 HE ARG 70 -11.682 0.317 -15.876 559 HH11 ARG 70 1HH1 ARG 70 -9.320 2.089 -17.721 560 HH12 ARG 70 2HH1 ARG 70 -10.082 3.624 -17.467 561 HH21 ARG 70 1HH2 ARG 70 -12.694 2.332 -15.535 562 HH22 ARG 70 2HH2 ARG 70 -12.001 3.762 -16.223 563 H ARG 71 H ARG 71 -6.570 -4.073 -15.756 564 HA ARG 71 HA ARG 71 -5.138 -4.557 -18.076 565 HB2 ARG 71 2HB ARG 71 -4.673 -5.038 -15.183 566 HB3 ARG 71 3HB ARG 71 -3.627 -5.895 -16.307 567 HG2 ARG 71 2HG ARG 71 -2.659 -3.774 -15.551 568 HG3 ARG 71 3HG ARG 71 -2.917 -3.809 -17.296 569 HD2 ARG 71 2HD ARG 71 -5.143 -2.741 -15.685 570 HD3 ARG 71 3HD ARG 71 -3.671 -1.770 -15.700 571 HE ARG 71 HE ARG 71 -4.264 -2.472 -18.334 572 HH11 ARG 71 1HH1 ARG 71 -5.608 -0.558 -15.756 573 HH12 ARG 71 2HH1 ARG 71 -6.388 0.565 -16.820 574 HH21 ARG 71 1HH2 ARG 71 -5.285 -1.001 -19.746 575 HH22 ARG 71 2HH2 ARG 71 -6.204 0.312 -19.090 576 H GLU 72 H GLU 72 -6.698 -6.867 -15.895 577 HA GLU 72 HA GLU 72 -5.745 -9.225 -17.053 578 HB2 GLU 72 2HB GLU 72 -6.854 -9.316 -14.932 579 HB3 GLU 72 3HB GLU 72 -8.324 -8.628 -15.606 580 HG2 GLU 72 2HG GLU 72 -9.060 -10.603 -16.343 581 HG3 GLU 72 3HG GLU 72 -7.465 -11.100 -16.905 582 H LYS 73 H LYS 73 -8.752 -7.438 -17.708 583 HA LYS 73 HA LYS 73 -9.769 -9.112 -19.690 584 HB2 LYS 73 2HB LYS 73 -10.804 -7.032 -18.497 585 HB3 LYS 73 3HB LYS 73 -10.115 -6.137 -19.845 586 HG2 LYS 73 2HG LYS 73 -11.472 -7.224 -21.410 587 HG3 LYS 73 3HG LYS 73 -11.893 -8.512 -20.279 588 HD2 LYS 73 2HD LYS 73 -12.631 -5.665 -19.702 589 HD3 LYS 73 3HD LYS 73 -13.628 -6.656 -20.770 590 HE2 LYS 73 2HE LYS 73 -14.635 -7.459 -18.958 591 HE3 LYS 73 3HE LYS 73 -13.120 -8.258 -18.541 592 HZ1 LYS 73 3HZ LYS 73 -13.332 -7.036 -16.683 593 HZ2 LYS 73 1HZ LYS 73 -14.332 -5.879 -17.406 594 HZ3 LYS 73 2HZ LYS 73 -12.657 -5.804 -17.626 595 H PHE 74 H PHE 74 -7.335 -6.600 -19.853 596 HA PHE 74 HA PHE 74 -7.240 -6.570 -22.729 597 HB2 PHE 74 2HB PHE 74 -6.638 -4.622 -21.213 598 HB3 PHE 74 3HB PHE 74 -5.151 -5.486 -20.840 599 HD1 PHE 74 HD2 PHE 74 -7.096 -4.611 -23.907 600 HD2 PHE 74 HD1 PHE 74 -3.307 -4.755 -21.972 601 HE1 PHE 74 HE2 PHE 74 -6.040 -3.647 -25.910 602 HE2 PHE 74 HE1 PHE 74 -2.246 -3.791 -23.972 603 HZ PHE 74 HZ PHE 74 -3.612 -3.237 -25.944 604 H GLY 75 H GLY 75 -5.701 -8.325 -20.165 605 HA2 GLY 75 2HA GLY 75 -4.827 -10.523 -21.181 606 HA3 GLY 75 3HA GLY 75 -3.745 -9.450 -22.057 607 H SER 76 H SER 76 -2.647 -11.398 -20.545 608 HA SER 76 HA SER 76 -1.858 -10.142 -18.014 609 HB2 SER 76 2HB SER 76 -2.198 -12.886 -18.910 610 HB3 SER 76 3HB SER 76 -0.617 -12.638 -18.168 611 HG SER 76 HG SER 76 -1.775 -12.937 -16.413 612 H SER 77 H SER 77 0.320 -9.837 -17.468 613 HA SER 77 HA SER 77 2.388 -10.345 -19.422 614 HB2 SER 77 2HB SER 77 2.710 -8.256 -20.225 615 HB3 SER 77 3HB SER 77 1.054 -7.963 -19.692 616 HG SER 77 HG SER 77 3.063 -6.615 -18.928 617 H LYS 78 H LYS 78 4.357 -10.546 -18.494 618 HA LYS 78 HA LYS 78 4.639 -10.933 -15.776 619 HB2 LYS 78 2HB LYS 78 6.248 -11.276 -17.958 620 HB3 LYS 78 3HB LYS 78 7.077 -9.973 -17.116 621 HG2 LYS 78 2HG LYS 78 7.995 -11.456 -15.760 622 HG3 LYS 78 3HG LYS 78 6.390 -11.907 -15.178 623 HD2 LYS 78 2HD LYS 78 6.973 -13.939 -15.974 624 HD3 LYS 78 3HD LYS 78 6.444 -13.254 -17.512 625 HE2 LYS 78 2HE LYS 78 8.832 -12.496 -17.847 626 HE3 LYS 78 3HE LYS 78 9.253 -13.493 -16.456 627 HZ1 LYS 78 3HZ LYS 78 7.714 -15.046 -18.193 628 HZ2 LYS 78 1HZ LYS 78 9.347 -15.236 -17.792 629 HZ3 LYS 78 2HZ LYS 78 8.907 -14.287 -19.121 630 H GLU 79 H GLU 79 4.952 -7.984 -17.630 631 HA GLU 79 HA GLU 79 6.194 -6.449 -15.574 632 HB2 GLU 79 2HB GLU 79 5.020 -5.932 -18.235 633 HB3 GLU 79 3HB GLU 79 4.980 -4.577 -17.115 634 HG2 GLU 79 2HG GLU 79 7.465 -5.031 -16.755 635 HG3 GLU 79 3HG GLU 79 7.360 -6.039 -18.197 636 H ILE 80 H ILE 80 2.857 -6.492 -16.831 637 HA ILE 80 HA ILE 80 1.772 -4.750 -14.928 638 HB ILE 80 HB ILE 80 0.382 -7.001 -16.386 639 HG12 ILE 80 2HG1 ILE 80 0.404 -4.076 -17.117 640 HG13 ILE 80 3HG1 ILE 80 1.595 -5.206 -17.752 641 HG21 ILE 80 1HG2 ILE 80 -0.922 -6.250 -14.492 642 HG22 ILE 80 2HG2 ILE 80 -0.730 -4.571 -14.993 643 HG23 ILE 80 3HG2 ILE 80 -1.664 -5.685 -15.990 644 HD11 ILE 80 3HD1 ILE 80 -0.394 -6.578 -18.558 645 HD12 ILE 80 1HD1 ILE 80 -1.360 -5.140 -18.228 646 HD13 ILE 80 2HD1 ILE 80 -0.045 -5.069 -19.401 647 H ASP 81 H ASP 81 1.799 -8.311 -14.986 648 HA ASP 81 HA ASP 81 0.463 -8.754 -12.588 649 HB2 ASP 81 2HB ASP 81 2.703 -10.415 -13.765 650 HB3 ASP 81 3HB ASP 81 1.518 -10.963 -12.583 651 H MET 82 H MET 82 3.937 -8.321 -13.178 652 HA MET 82 HA MET 82 4.818 -8.737 -10.557 653 HB2 MET 82 2HB MET 82 5.909 -7.321 -12.944 654 HB3 MET 82 3HB MET 82 6.684 -7.047 -11.390 655 HG2 MET 82 2HG MET 82 7.214 -9.349 -11.155 656 HG3 MET 82 3HG MET 82 6.210 -9.782 -12.537 657 HE1 MET 82 3HE MET 82 9.351 -10.767 -12.297 658 HE2 MET 82 1HE MET 82 10.519 -9.512 -12.713 659 HE3 MET 82 2HE MET 82 9.538 -9.355 -11.256 660 H ALA 83 H ALA 83 3.596 -5.846 -12.158 661 HA ALA 83 HA ALA 83 4.248 -3.966 -10.185 662 HB1 ALA 83 1HB ALA 83 2.843 -2.485 -11.298 663 HB2 ALA 83 2HB ALA 83 3.341 -3.605 -12.567 664 HB3 ALA 83 3HB ALA 83 1.749 -3.765 -11.824 665 H ILE 84 H ILE 84 1.216 -5.772 -10.684 666 HA ILE 84 HA ILE 84 -0.150 -4.768 -8.459 667 HB ILE 84 HB ILE 84 -0.443 -7.487 -9.742 668 HG12 ILE 84 2HG1 ILE 84 -2.449 -5.426 -10.299 669 HG13 ILE 84 3HG1 ILE 84 -0.843 -5.012 -10.890 670 HG21 ILE 84 1HG2 ILE 84 -2.889 -6.561 -8.713 671 HG22 ILE 84 2HG2 ILE 84 -1.924 -7.925 -8.151 672 HG23 ILE 84 3HG2 ILE 84 -1.690 -6.327 -7.442 673 HD11 ILE 84 3HD1 ILE 84 -0.814 -7.293 -11.983 674 HD12 ILE 84 1HD1 ILE 84 -2.536 -7.378 -11.612 675 HD13 ILE 84 2HD1 ILE 84 -1.922 -6.101 -12.662 676 H VAL 85 H VAL 85 2.157 -7.393 -8.766 677 HA VAL 85 HA VAL 85 1.732 -8.645 -6.293 678 HB VAL 85 HB VAL 85 4.311 -8.403 -7.850 679 HG11 VAL 85 1HG1 VAL 85 4.502 -10.752 -6.560 680 HG12 VAL 85 2HG1 VAL 85 5.143 -9.238 -5.921 681 HG13 VAL 85 3HG1 VAL 85 3.575 -9.833 -5.375 682 HG21 VAL 85 3HG2 VAL 85 3.504 -9.904 -9.281 683 HG22 VAL 85 1HG2 VAL 85 2.993 -10.962 -7.966 684 HG23 VAL 85 2HG2 VAL 85 1.922 -9.681 -8.534 685 H THR 86 H THR 86 4.114 -6.153 -7.195 686 HA THR 86 HA THR 86 5.260 -5.819 -4.672 687 HB THR 86 HB THR 86 6.017 -3.616 -5.456 688 HG1 THR 86 HG1 THR 86 4.580 -2.660 -6.706 689 HG21 THR 86 3HG2 THR 86 6.277 -6.070 -7.076 690 HG22 THR 86 1HG2 THR 86 7.520 -5.073 -6.323 691 HG23 THR 86 2HG2 THR 86 6.797 -4.575 -7.852 692 H LEU 87 H LEU 87 2.497 -4.167 -6.159 693 HA LEU 87 HA LEU 87 2.022 -2.302 -4.131 694 HB2 LEU 87 2HB LEU 87 0.490 -3.467 -6.361 695 HB3 LEU 87 3HB LEU 87 -0.473 -2.784 -5.053 696 HG LEU 87 HG LEU 87 1.626 -1.295 -6.630 697 HD11 LEU 87 1HD1 LEU 87 -0.291 -0.103 -7.604 698 HD12 LEU 87 2HD1 LEU 87 -1.384 -1.216 -6.782 699 HD13 LEU 87 3HD1 LEU 87 -0.283 -1.816 -8.022 700 HD21 LEU 87 3HD2 LEU 87 0.403 0.668 -5.520 701 HD22 LEU 87 1HD2 LEU 87 1.529 -0.268 -4.537 702 HD23 LEU 87 2HD2 LEU 87 -0.208 -0.534 -4.381 703 H LYS 88 H LYS 88 1.076 -5.668 -4.446 704 HA LYS 88 HA LYS 88 -0.761 -5.691 -2.278 705 HB2 LYS 88 2HB LYS 88 0.305 -7.575 -4.176 706 HB3 LYS 88 3HB LYS 88 0.337 -8.274 -2.562 707 HG2 LYS 88 2HG LYS 88 -1.905 -8.419 -2.434 708 HG3 LYS 88 3HG LYS 88 -2.162 -6.910 -3.313 709 HD2 LYS 88 2HD LYS 88 -2.963 -8.493 -4.802 710 HD3 LYS 88 3HD LYS 88 -1.306 -8.256 -5.362 711 HE2 LYS 88 2HE LYS 88 -0.639 -10.321 -4.688 712 HE3 LYS 88 3HE LYS 88 -1.746 -10.351 -3.316 713 HZ1 LYS 88 3HZ LYS 88 -3.452 -11.136 -4.590 714 HZ2 LYS 88 1HZ LYS 88 -2.148 -11.862 -5.386 715 HZ3 LYS 88 2HZ LYS 88 -2.859 -10.468 -6.027 716 H VAL 89 H VAL 89 2.506 -7.113 -2.514 717 HA VAL 89 HA VAL 89 2.820 -7.705 0.183 718 HB VAL 89 HB VAL 89 5.043 -6.876 -1.685 719 HG11 VAL 89 1HG1 VAL 89 6.464 -7.514 -0.095 720 HG12 VAL 89 2HG1 VAL 89 5.088 -7.561 1.010 721 HG13 VAL 89 3HG1 VAL 89 5.594 -9.026 0.167 722 HG21 VAL 89 3HG2 VAL 89 4.991 -9.620 -1.670 723 HG22 VAL 89 1HG2 VAL 89 3.279 -9.199 -1.713 724 HG23 VAL 89 2HG2 VAL 89 4.369 -8.589 -2.958 725 H PHE 90 H PHE 90 3.727 -4.766 -1.590 726 HA PHE 90 HA PHE 90 4.918 -3.432 0.586 727 HB2 PHE 90 2HB PHE 90 5.367 -2.640 -1.625 728 HB3 PHE 90 3HB PHE 90 3.653 -2.408 -1.957 729 HD1 PHE 90 HD1 PHE 90 5.689 -1.393 0.986 730 HD2 PHE 90 HD2 PHE 90 3.382 -0.150 -2.368 731 HE1 PHE 90 HE1 PHE 90 5.866 0.945 1.734 732 HE2 PHE 90 HE2 PHE 90 3.556 2.189 -1.626 733 HZ PHE 90 HZ PHE 90 4.800 2.739 0.427 734 H ALA 91 H ALA 91 1.600 -3.735 -0.473 735 HA ALA 91 HA ALA 91 0.490 -1.633 1.044 736 HB1 ALA 91 1HB ALA 91 -1.559 -3.384 0.883 737 HB2 ALA 91 2HB ALA 91 -1.081 -2.300 -0.424 738 HB3 ALA 91 3HB ALA 91 -0.526 -3.974 -0.419 739 H VAL 92 H VAL 92 0.513 -5.141 1.711 740 HA VAL 92 HA VAL 92 -0.454 -4.845 4.366 741 HB VAL 92 HB VAL 92 1.061 -7.206 3.254 742 HG11 VAL 92 1HG1 VAL 92 0.439 -8.352 5.084 743 HG12 VAL 92 2HG1 VAL 92 0.254 -6.753 5.806 744 HG13 VAL 92 3HG1 VAL 92 -1.150 -7.591 5.145 745 HG21 VAL 92 3HG2 VAL 92 -0.599 -7.457 1.791 746 HG22 VAL 92 1HG2 VAL 92 -1.663 -7.763 3.163 747 HG23 VAL 92 2HG2 VAL 92 -1.517 -6.133 2.508 748 H ALA 93 H ALA 93 2.768 -5.724 3.111 749 HA ALA 93 HA ALA 93 4.076 -5.723 5.593 750 HB1 ALA 93 1HB ALA 93 6.123 -5.750 4.362 751 HB2 ALA 93 2HB ALA 93 4.946 -6.719 3.474 752 HB3 ALA 93 3HB ALA 93 5.334 -5.087 2.931 753 H GLY 94 H GLY 94 2.960 -3.136 3.644 754 HA2 GLY 94 2HA GLY 94 4.773 -1.204 4.887 755 HA3 GLY 94 3HA GLY 94 3.647 -0.875 3.579 756 H LEU 95 H LEU 95 1.289 -1.044 4.196 757 HA LEU 95 HA LEU 95 0.721 0.770 6.246 758 HB2 LEU 95 2HB LEU 95 -0.972 -1.158 4.694 759 HB3 LEU 95 3HB LEU 95 -1.664 -0.142 5.956 760 HG LEU 95 HG LEU 95 -2.073 0.878 3.826 761 HD11 LEU 95 1HD1 LEU 95 -1.349 2.272 5.829 762 HD12 LEU 95 2HD1 LEU 95 -1.261 3.037 4.243 763 HD13 LEU 95 3HD1 LEU 95 0.206 2.432 5.012 764 HD21 LEU 95 3HD2 LEU 95 -0.008 -0.317 2.805 765 HD22 LEU 95 1HD2 LEU 95 0.858 1.141 3.292 766 HD23 LEU 95 2HD2 LEU 95 -0.500 1.255 2.172 767 H LEU 96 H LEU 96 0.356 -2.764 6.156 768 HA LEU 96 HA LEU 96 -0.432 -2.842 8.941 769 HB2 LEU 96 2HB LEU 96 -0.724 -4.527 6.703 770 HB3 LEU 96 3HB LEU 96 0.245 -5.416 7.877 771 HG LEU 96 HG LEU 96 -2.050 -6.006 8.187 772 HD11 LEU 96 1HD1 LEU 96 -0.590 -5.606 10.196 773 HD12 LEU 96 2HD1 LEU 96 -2.326 -5.535 10.492 774 HD13 LEU 96 3HD1 LEU 96 -1.391 -4.045 10.371 775 HD21 LEU 96 3HD2 LEU 96 -2.476 -3.166 7.706 776 HD22 LEU 96 1HD2 LEU 96 -3.393 -3.778 9.082 777 HD23 LEU 96 2HD2 LEU 96 -3.576 -4.530 7.497 778 H ASN 97 H ASN 97 2.441 -2.441 7.436 779 HA ASN 97 HA ASN 97 4.630 -2.777 7.974 780 HB2 ASN 97 2HB ASN 97 3.710 -3.120 10.822 781 HB3 ASN 97 3HB ASN 97 5.202 -2.394 10.233 782 HD21 ASN 97 1HD2 ASN 97 4.891 -0.418 8.866 783 HD22 ASN 97 2HD2 ASN 97 3.680 0.705 9.375 784 H MET 98 H MET 98 3.021 -5.139 7.340 785 HA MET 98 HA MET 98 3.717 -7.296 9.033 786 HB2 MET 98 2HB MET 98 2.414 -6.932 6.452 787 HB3 MET 98 3HB MET 98 3.394 -8.390 6.505 788 HG2 MET 98 2HG MET 98 1.364 -7.718 8.612 789 HG3 MET 98 3HG MET 98 0.974 -8.635 7.159 790 HE1 MET 98 3HE MET 98 2.145 -8.393 10.499 791 HE2 MET 98 1HE MET 98 1.138 -9.824 10.719 792 HE3 MET 98 2HE MET 98 2.880 -9.925 10.974 793 H THR 99 H THR 99 5.052 -9.189 8.191 794 HA THR 99 HA THR 99 7.547 -8.169 6.996 795 HB THR 99 HB THR 99 8.673 -10.032 8.327 796 HG1 THR 99 HG1 THR 99 6.815 -11.169 8.965 797 HG21 THR 99 3HG2 THR 99 9.052 -7.785 8.995 798 HG22 THR 99 1HG2 THR 99 8.623 -8.668 10.459 799 HG23 THR 99 2HG2 THR 99 7.429 -7.638 9.669 800 H VAL 100 H VAL 100 5.664 -9.095 5.289 801 HA VAL 100 HA VAL 100 6.046 -11.912 4.770 802 HB VAL 100 HB VAL 100 4.665 -11.473 2.737 803 HG11 VAL 100 1HG1 VAL 100 3.476 -10.438 5.309 804 HG12 VAL 100 2HG1 VAL 100 2.591 -11.114 3.939 805 HG13 VAL 100 3HG1 VAL 100 3.668 -12.140 4.889 806 HG21 VAL 100 3HG2 VAL 100 4.418 -9.409 1.956 807 HG22 VAL 100 1HG2 VAL 100 3.634 -8.922 3.459 808 HG23 VAL 100 2HG2 VAL 100 5.385 -8.789 3.293 809 H SER 101 H SER 101 7.662 -12.741 3.635 810 HA SER 101 HA SER 101 9.229 -10.956 1.903 811 HB2 SER 101 2HB SER 101 9.926 -13.494 3.374 812 HB3 SER 101 3HB SER 101 10.945 -12.863 2.080 813 HG SER 101 HG SER 101 11.774 -11.667 3.590 814 H THR 102 H THR 102 6.685 -12.639 1.394 815 HA THR 102 HA THR 102 7.555 -13.587 -1.224 816 HB THR 102 HB THR 102 6.556 -15.742 -1.054 817 HG1 THR 102 HG1 THR 102 5.778 -15.133 1.616 818 HG21 THR 102 3HG2 THR 102 7.831 -16.790 0.788 819 HG22 THR 102 1HG2 THR 102 8.163 -15.187 1.443 820 HG23 THR 102 2HG2 THR 102 8.801 -15.643 -0.136 821 H ALA 103 H ALA 103 6.145 -13.049 -2.769 822 HA ALA 103 HA ALA 103 3.980 -11.389 -2.361 823 HB1 ALA 103 1HB ALA 103 5.038 -11.605 -4.523 824 HB2 ALA 103 2HB ALA 103 4.469 -13.268 -4.668 825 HB3 ALA 103 3HB ALA 103 3.312 -11.936 -4.671 826 H ALA 104 H ALA 104 4.122 -14.874 -2.277 827 HA ALA 104 HA ALA 104 1.339 -15.374 -2.479 828 HB1 ALA 104 1HB ALA 104 1.962 -17.512 -2.446 829 HB2 ALA 104 2HB ALA 104 3.624 -16.923 -2.390 830 HB3 ALA 104 3HB ALA 104 2.783 -17.331 -0.895 831 H ALA 105 H ALA 105 3.519 -14.900 0.270 832 HA ALA 105 HA ALA 105 1.625 -15.447 2.292 833 HB1 ALA 105 1HB ALA 105 3.965 -15.493 2.809 834 HB2 ALA 105 2HB ALA 105 4.148 -13.800 2.350 835 HB3 ALA 105 3HB ALA 105 3.206 -14.229 3.778 836 H ALA 106 H ALA 106 2.535 -12.484 0.607 837 HA ALA 106 HA ALA 106 1.113 -10.670 2.216 838 HB1 ALA 106 1HB ALA 106 1.197 -9.188 0.200 839 HB2 ALA 106 2HB ALA 106 2.757 -9.836 0.707 840 HB3 ALA 106 3HB ALA 106 1.922 -10.533 -0.681 841 H GLU 107 H GLU 107 0.187 -12.170 -0.886 842 HA GLU 107 HA GLU 107 -2.376 -11.110 -1.064 843 HB2 GLU 107 2HB GLU 107 -1.326 -12.270 -2.925 844 HB3 GLU 107 3HB GLU 107 -1.350 -13.783 -2.031 845 HG2 GLU 107 2HG GLU 107 -3.956 -12.462 -2.388 846 HG3 GLU 107 3HG GLU 107 -3.195 -13.086 -3.850 847 H ASN 108 H ASN 108 -1.289 -14.115 0.477 848 HA ASN 108 HA ASN 108 -3.777 -15.123 1.217 849 HB2 ASN 108 2HB ASN 108 -1.125 -15.854 1.607 850 HB3 ASN 108 3HB ASN 108 -1.732 -15.591 3.239 851 HD21 ASN 108 1HD2 ASN 108 -3.671 -16.742 3.863 852 HD22 ASN 108 2HD2 ASN 108 -3.990 -18.295 3.175 853 H MET 109 H MET 109 -1.602 -12.952 2.999 854 HA MET 109 HA MET 109 -3.257 -12.710 5.281 855 HB2 MET 109 2HB MET 109 -0.723 -11.777 4.467 856 HB3 MET 109 3HB MET 109 -1.670 -10.348 4.860 857 HG2 MET 109 2HG MET 109 -1.265 -12.715 6.673 858 HG3 MET 109 3HG MET 109 -0.384 -11.192 6.768 859 HE1 MET 109 3HE MET 109 -1.226 -9.101 7.064 860 HE2 MET 109 1HE MET 109 -2.935 -8.685 6.943 861 HE3 MET 109 2HE MET 109 -2.177 -8.845 8.527 862 H TYR 110 H TYR 110 -2.858 -10.697 2.386 863 HA TYR 110 HA TYR 110 -4.541 -8.601 3.086 864 HB2 TYR 110 2HB TYR 110 -3.016 -9.033 0.967 865 HB3 TYR 110 3HB TYR 110 -4.535 -9.575 0.262 866 HD1 TYR 110 HD2 TYR 110 -3.584 -6.737 2.509 867 HD2 TYR 110 HD1 TYR 110 -5.427 -7.967 -1.124 868 HE1 TYR 110 HE2 TYR 110 -4.189 -4.402 2.032 869 HE2 TYR 110 HE1 TYR 110 -6.036 -5.635 -1.612 870 HH TYR 110 HH TYR 110 -5.430 -3.415 -1.035 871 H SER 111 H SER 111 -5.293 -11.811 1.935 872 HA SER 111 HA SER 111 -8.089 -11.191 1.500 873 HB2 SER 111 2HB SER 111 -6.895 -13.957 1.562 874 HB3 SER 111 3HB SER 111 -8.314 -13.394 0.679 875 HG SER 111 HG SER 111 -6.593 -13.583 -0.745 876 H GLN 112 H GLN 112 -6.209 -13.240 3.722 877 HA GLN 112 HA GLN 112 -8.315 -14.162 5.285 878 HB2 GLN 112 2HB GLN 112 -5.394 -13.760 5.749 879 HB3 GLN 112 3HB GLN 112 -6.418 -14.138 7.128 880 HG2 GLN 112 2HG GLN 112 -6.953 -15.893 4.896 881 HG3 GLN 112 3HG GLN 112 -5.255 -15.933 5.369 882 HE21 GLN 112 1HE2 GLN 112 -4.802 -16.312 7.656 883 HE22 GLN 112 2HE2 GLN 112 -5.858 -17.345 8.552 884 H MET 113 H MET 113 -6.662 -11.087 5.309 885 HA MET 113 HA MET 113 -7.720 -10.226 7.829 886 HB2 MET 113 2HB MET 113 -5.615 -9.330 6.873 887 HB3 MET 113 3HB MET 113 -6.543 -8.578 5.583 888 HG2 MET 113 2HG MET 113 -7.053 -6.831 6.848 889 HG3 MET 113 3HG MET 113 -7.569 -7.858 8.184 890 HE1 MET 113 3HE MET 113 -5.079 -7.615 10.737 891 HE2 MET 113 1HE MET 113 -6.268 -6.357 10.401 892 HE3 MET 113 2HE MET 113 -6.680 -8.051 10.138 893 H GLY 114 H GLY 114 -8.784 -10.155 4.522 894 HA2 GLY 114 2HA GLY 114 -11.123 -9.923 4.031 895 HA3 GLY 114 3HA GLY 114 -11.266 -8.849 5.415 896 H LEU 115 H LEU 115 -8.586 -8.485 3.250 897 HA LEU 115 HA LEU 115 -9.708 -5.923 2.369 898 HB2 LEU 115 2HB LEU 115 -6.870 -6.927 2.221 899 HB3 LEU 115 3HB LEU 115 -7.424 -5.306 1.809 900 HG LEU 115 HG LEU 115 -7.886 -6.313 4.576 901 HD11 LEU 115 1HD1 LEU 115 -5.276 -5.051 3.810 902 HD12 LEU 115 2HD1 LEU 115 -5.482 -6.802 3.845 903 HD13 LEU 115 3HD1 LEU 115 -5.720 -5.857 5.315 904 HD21 LEU 115 3HD2 LEU 115 -6.931 -3.683 4.508 905 HD22 LEU 115 1HD2 LEU 115 -8.593 -4.216 4.758 906 HD23 LEU 115 2HD2 LEU 115 -8.026 -3.830 3.133 907 H ASP 116 H ASP 116 -8.562 -9.001 1.211 908 HA ASP 116 HA ASP 116 -8.839 -8.126 -1.573 909 HB2 ASP 116 2HB ASP 116 -6.885 -9.610 -0.488 910 HB3 ASP 116 3HB ASP 116 -7.999 -10.902 -0.928 911 H THR 117 H THR 117 -9.602 -10.270 -2.920 912 HA THR 117 HA THR 117 -12.056 -11.292 -1.681 913 HB THR 117 HB THR 117 -12.694 -9.310 -3.010 914 HG1 THR 117 HG1 THR 117 -13.904 -11.483 -2.932 915 HG21 THR 117 3HG2 THR 117 -10.810 -9.610 -4.681 916 HG22 THR 117 1HG2 THR 117 -12.382 -9.184 -5.356 917 HG23 THR 117 2HG2 THR 117 -11.808 -10.849 -5.442 918 H ARG 118 H ARG 118 -9.526 -12.562 -2.216 919 HA ARG 118 HA ARG 118 -10.510 -14.800 -3.778 920 HB2 ARG 118 2HB ARG 118 -9.390 -13.339 -5.440 921 HB3 ARG 118 3HB ARG 118 -7.908 -13.441 -4.500 922 HG2 ARG 118 2HG ARG 118 -8.219 -16.010 -4.816 923 HG3 ARG 118 3HG ARG 118 -9.242 -15.519 -6.167 924 HD2 ARG 118 2HD ARG 118 -6.920 -13.957 -6.347 925 HD3 ARG 118 3HD ARG 118 -6.374 -15.592 -5.977 926 HE ARG 118 HE ARG 118 -7.000 -16.230 -8.080 927 HH11 ARG 118 1HH1 ARG 118 -8.551 -13.210 -7.309 928 HH12 ARG 118 2HH1 ARG 118 -9.198 -12.987 -8.900 929 HH21 ARG 118 1HH2 ARG 118 -7.846 -15.947 -10.179 930 HH22 ARG 118 2HH2 ARG 118 -8.797 -14.544 -10.532 931 HA PRO 119 HA PRO 119 -7.953 -15.829 -0.012 932 HB2 PRO 119 2HB PRO 119 -9.815 -17.449 1.120 933 HB3 PRO 119 3HB PRO 119 -9.768 -15.703 1.392 934 HG2 PRO 119 2HG PRO 119 -11.490 -17.282 -0.479 935 HG3 PRO 119 3HG PRO 119 -11.934 -15.928 0.575 936 HD2 PRO 119 2HD PRO 119 -11.487 -15.623 -2.078 937 HD3 PRO 119 3HD PRO 119 -11.117 -14.351 -0.895 938 H SER 120 H SER 120 -6.517 -17.406 -0.288 939 HA SER 120 HA SER 120 -7.185 -19.673 -2.000 940 HB2 SER 120 2HB SER 120 -5.128 -18.671 -2.613 941 HB3 SER 120 3HB SER 120 -4.585 -18.572 -0.938 942 HG SER 120 HG SER 120 -4.671 -20.781 -2.661 943 H MET 121 H MET 121 -5.884 -19.033 1.242 944 HA MET 121 HA MET 121 -5.811 -20.293 3.133 945 HB2 MET 121 2HB MET 121 -8.048 -21.843 1.817 946 HB3 MET 121 3HB MET 121 -7.641 -21.860 3.528 947 HG2 MET 121 2HG MET 121 -8.184 -19.464 3.656 948 HG3 MET 121 3HG MET 121 -8.658 -19.504 1.959 949 HE1 MET 121 3HE MET 121 -11.690 -21.623 1.750 950 HE2 MET 121 1HE MET 121 -10.034 -21.506 1.156 951 HE3 MET 121 2HE MET 121 -10.462 -22.745 2.336 952 H LYS 122 H LYS 122 -3.719 -21.080 2.588 953 HA LYS 122 HA LYS 122 -3.440 -23.859 2.715 954 HB2 LYS 122 2HB LYS 122 -3.730 -22.796 0.031 955 HB3 LYS 122 3HB LYS 122 -2.178 -23.597 0.238 956 HG2 LYS 122 2HG LYS 122 -3.773 -25.432 1.361 957 HG3 LYS 122 3HG LYS 122 -4.906 -24.718 0.211 958 HD2 LYS 122 2HD LYS 122 -3.776 -25.505 -1.593 959 HD3 LYS 122 3HD LYS 122 -2.202 -25.345 -0.812 960 HE2 LYS 122 2HE LYS 122 -3.165 -27.299 0.693 961 HE3 LYS 122 3HE LYS 122 -4.148 -27.592 -0.741 962 HZ1 LYS 122 3HZ LYS 122 -2.333 -28.156 -1.984 963 HZ2 LYS 122 1HZ LYS 122 -1.824 -28.710 -0.469 964 HZ3 LYS 122 2HZ LYS 122 -1.254 -27.233 -1.063 965 H GLU 123 H GLU 123 -1.831 -23.634 4.161 966 HA GLU 123 HA GLU 123 0.641 -22.349 3.222 967 HB2 GLU 123 2HB GLU 123 1.039 -21.357 5.370 968 HB3 GLU 123 3HB GLU 123 -0.568 -20.880 4.841 969 HG2 GLU 123 2HG GLU 123 -0.965 -23.217 6.295 970 HG3 GLU 123 3HG GLU 123 0.244 -22.312 7.205 971 H ALA 124 H ALA 124 2.512 -22.978 4.776 972 HA ALA 124 HA ALA 124 3.910 -24.628 5.487 973 HB1 ALA 124 1HB ALA 124 1.338 -25.180 6.811 974 HB2 ALA 124 2HB ALA 124 2.497 -26.510 6.795 975 HB3 ALA 124 3HB ALA 124 2.947 -24.957 7.498 976 H GLY 125 H GLY 125 4.076 -25.109 3.118 977 HA2 GLY 125 2HA GLY 125 2.651 -27.306 2.002 978 HA3 GLY 125 3HA GLY 125 4.111 -26.579 1.348 979 H GLY 126 H GLY 126 6.133 -27.097 2.764 980 HA2 GLY 126 2HA GLY 126 6.222 -29.490 4.251 981 HA3 GLY 126 3HA GLY 126 6.608 -29.849 2.575 982 H LYS 127 H LYS 127 8.656 -30.533 3.677 983 HA LYS 127 HA LYS 127 10.869 -30.232 4.112 984 HB2 LYS 127 2HB LYS 127 10.475 -28.983 1.839 985 HB3 LYS 127 3HB LYS 127 10.764 -27.540 2.802 986 HG2 LYS 127 2HG LYS 127 12.839 -28.097 1.870 987 HG3 LYS 127 3HG LYS 127 12.922 -28.643 3.547 988 HD2 LYS 127 2HD LYS 127 13.132 -30.794 2.950 989 HD3 LYS 127 3HD LYS 127 11.886 -30.664 1.706 990 HE2 LYS 127 2HE LYS 127 14.301 -29.217 1.001 991 HE3 LYS 127 3HE LYS 127 14.615 -30.926 1.297 992 HZ1 LYS 127 3HZ LYS 127 12.395 -31.023 -0.206 993 HZ2 LYS 127 1HZ LYS 127 13.967 -31.152 -0.819 994 HZ3 LYS 127 2HZ LYS 127 13.163 -29.665 -0.858 995 H GLU 128 H GLU 128 9.421 -29.679 6.276 996 HA GLU 128 HA GLU 128 10.135 -27.050 7.297 997 HB2 GLU 128 2HB GLU 128 8.505 -29.331 8.402 998 HB3 GLU 128 3HB GLU 128 8.934 -27.931 9.376 999 HG2 GLU 128 2HG GLU 128 7.498 -26.559 8.296 1000 HG3 GLU 128 3HG GLU 128 7.688 -27.391 6.754 1001 H GLU 129 H GLU 129 12.465 -28.012 6.867 1002 HA GLU 129 HA GLU 129 13.419 -29.026 9.462 1003 HB2 GLU 129 2HB GLU 129 14.633 -29.715 6.783 1004 HB3 GLU 129 3HB GLU 129 15.103 -30.350 8.353 1005 HG2 GLU 129 2HG GLU 129 12.619 -31.166 8.429 1006 HG3 GLU 129 3HG GLU 129 12.732 -30.999 6.678 1007 H GLY 130 H GLY 130 14.051 -27.047 10.252 1008 HA2 GLY 130 2HA GLY 130 16.551 -26.093 9.930 1009 HA3 GLY 130 3HA GLY 130 15.679 -25.269 8.647 1010 HA PRO 131 HA PRO 131 13.735 -23.759 12.820 1011 HB2 PRO 131 2HB PRO 131 15.075 -24.436 15.082 1012 HB3 PRO 131 3HB PRO 131 13.782 -25.428 14.398 1013 HG2 PRO 131 2HG PRO 131 16.748 -25.753 14.157 1014 HG3 PRO 131 3HG PRO 131 15.507 -26.987 14.446 1015 HD2 PRO 131 2HD PRO 131 16.606 -26.569 12.006 1016 HD3 PRO 131 3HD PRO 131 14.927 -27.105 12.218 1017 HA PRO 132 HA PRO 132 16.371 -20.270 13.276 1018 HB2 PRO 132 2HB PRO 132 15.589 -19.233 15.660 1019 HB3 PRO 132 3HB PRO 132 14.591 -19.154 14.204 1020 HG2 PRO 132 2HG PRO 132 14.430 -21.056 16.509 1021 HG3 PRO 132 3HG PRO 132 13.119 -20.231 15.646 1022 HD2 PRO 132 2HD PRO 132 13.776 -22.814 15.170 1023 HD3 PRO 132 3HD PRO 132 13.145 -21.741 13.905 1024 H GLN 133 H GLN 133 17.777 -19.095 15.039 1025 HA GLN 133 HA GLN 133 18.904 -20.598 17.140 1026 HB2 GLN 133 2HB GLN 133 21.037 -21.219 16.219 1027 HB3 GLN 133 3HB GLN 133 19.775 -21.919 15.216 1028 HG2 GLN 133 2HG GLN 133 20.400 -19.380 14.143 1029 HG3 GLN 133 3HG GLN 133 21.919 -20.217 14.461 1030 HE21 GLN 133 1HE2 GLN 133 22.635 -21.326 12.804 1031 HE22 GLN 133 2HE2 GLN 133 21.673 -22.115 11.605 1032 H ALA 134 H ALA 134 20.554 -19.465 18.259 1033 HA ALA 134 HA ALA 134 21.376 -16.870 17.233 1034 HB1 ALA 134 1HB ALA 134 19.702 -17.176 19.718 1035 HB2 ALA 134 2HB ALA 134 20.615 -15.721 19.316 1036 HB3 ALA 134 3HB ALA 134 19.309 -16.262 18.261 1037 H TYR 135 H TYR 135 21.327 -18.909 20.157 1038 HA TYR 135 HA TYR 135 24.012 -18.020 20.844 1039 HB2 TYR 135 2HB TYR 135 22.001 -18.427 22.476 1040 HB3 TYR 135 3HB TYR 135 22.511 -20.109 22.380 1041 HD1 TYR 135 HD1 TYR 135 24.640 -20.821 23.323 1042 HD2 TYR 135 HD2 TYR 135 23.379 -16.766 23.582 1043 HE1 TYR 135 HE1 TYR 135 26.357 -20.403 25.034 1044 HE2 TYR 135 HE2 TYR 135 25.093 -16.336 25.293 1045 HH TYR 135 HH TYR 135 26.765 -18.807 26.880 Start of MODEL 20 1 H21 MYR 1 1H2 MYR 1 8.150 10.329 -3.080 2 H22 MYR 1 2H2 MYR 1 7.251 10.670 -4.545 3 H31 MYR 1 1H3 MYR 1 6.049 9.389 -1.977 4 H32 MYR 1 2H3 MYR 1 6.564 8.483 -3.402 5 H41 MYR 1 1H4 MYR 1 4.795 10.554 -4.389 6 H42 MYR 1 2H4 MYR 1 4.024 9.923 -2.931 7 H51 MYR 1 1H5 MYR 1 4.954 7.577 -4.284 8 H52 MYR 1 2H5 MYR 1 4.395 8.624 -5.591 9 H61 MYR 1 1H6 MYR 1 2.238 8.985 -4.019 10 H62 MYR 1 2H6 MYR 1 2.791 7.513 -3.218 11 H71 MYR 1 1H7 MYR 1 2.921 6.480 -5.674 12 H72 MYR 1 2H7 MYR 1 1.935 7.863 -6.155 13 H81 MYR 1 1H8 MYR 1 0.182 6.431 -5.629 14 H82 MYR 1 2H8 MYR 1 0.434 7.072 -4.003 15 H91 MYR 1 1H9 MYR 1 2.253 4.773 -4.605 16 H92 MYR 1 2H9 MYR 1 0.553 4.334 -4.777 17 H101 MYR 1 1H10 MYR 1 0.026 4.935 -2.493 18 H102 MYR 1 2H10 MYR 1 1.498 5.869 -2.275 19 H111 MYR 1 1H11 MYR 1 2.264 3.972 -1.195 20 H112 MYR 1 2H11 MYR 1 2.604 3.399 -2.820 21 H121 MYR 1 1H12 MYR 1 1.075 1.710 -2.681 22 H122 MYR 1 2H12 MYR 1 -0.214 2.806 -2.185 23 H131 MYR 1 1H13 MYR 1 0.036 2.318 0.073 24 H132 MYR 1 2H13 MYR 1 1.799 2.317 -0.007 25 H141 MYR 1 2H14 MYR 1 0.892 0.000 -1.539 26 H142 MYR 1 3H14 MYR 1 1.783 0.000 0.000 27 H143 MYR 1 1H14 MYR 1 0.000 0.000 0.000 28 H GLY 2 H GLY 2 7.525 12.954 -4.434 29 HA2 GLY 2 2HA GLY 2 6.050 14.277 -2.262 30 HA3 GLY 2 3HA GLY 2 7.691 14.793 -2.621 31 H ASN 3 H ASN 3 5.176 13.832 -4.916 32 HA ASN 3 HA ASN 3 5.098 16.608 -5.891 33 HB2 ASN 3 2HB ASN 3 5.999 14.237 -7.283 34 HB3 ASN 3 3HB ASN 3 4.624 14.960 -8.112 35 HD21 ASN 3 1HD2 ASN 3 4.942 17.587 -7.771 36 HD22 ASN 3 2HD2 ASN 3 6.424 18.130 -8.475 37 H GLY 4 H GLY 4 3.475 13.488 -6.531 38 HA2 GLY 4 2HA GLY 4 0.945 14.528 -5.614 39 HA3 GLY 4 3HA GLY 4 1.038 14.345 -7.359 40 H ALA 5 H ALA 5 -0.851 12.892 -6.659 41 HA ALA 5 HA ALA 5 0.195 10.161 -6.499 42 HB1 ALA 5 1HB ALA 5 -0.473 10.041 -4.364 43 HB2 ALA 5 2HB ALA 5 -1.492 11.475 -4.499 44 HB3 ALA 5 3HB ALA 5 -2.095 9.911 -5.045 45 H SER 6 H SER 6 -0.318 9.618 -8.563 46 HA SER 6 HA SER 6 -3.032 9.019 -9.167 47 HB2 SER 6 2HB SER 6 -2.293 11.633 -9.793 48 HB3 SER 6 3HB SER 6 -2.163 10.767 -11.324 49 HG SER 6 HG SER 6 -4.319 11.709 -10.482 50 H ARG 7 H ARG 7 -0.018 9.848 -10.890 51 HA ARG 7 HA ARG 7 -0.292 7.832 -12.846 52 HB2 ARG 7 2HB ARG 7 1.648 9.854 -12.126 53 HB3 ARG 7 3HB ARG 7 2.447 8.352 -12.575 54 HG2 ARG 7 2HG ARG 7 1.906 8.562 -14.738 55 HG3 ARG 7 3HG ARG 7 0.288 9.170 -14.379 56 HD2 ARG 7 2HD ARG 7 0.994 11.358 -14.247 57 HD3 ARG 7 3HD ARG 7 2.649 10.908 -13.835 58 HE ARG 7 HE ARG 7 3.145 10.871 -16.063 59 HH11 ARG 7 1HH1 ARG 7 -0.311 10.708 -15.678 60 HH12 ARG 7 2HH1 ARG 7 -0.638 10.854 -17.373 61 HH21 ARG 7 1HH2 ARG 7 2.727 11.064 -18.298 62 HH22 ARG 7 2HH2 ARG 7 1.091 11.055 -18.862 63 H ASP 8 H ASP 8 1.766 7.988 -9.941 64 HA ASP 8 HA ASP 8 2.795 5.372 -10.196 65 HB2 ASP 8 2HB ASP 8 2.692 7.413 -8.021 66 HB3 ASP 8 3HB ASP 8 3.111 5.757 -7.588 67 H TRP 9 H TRP 9 -0.161 6.624 -8.877 68 HA TRP 9 HA TRP 9 -0.859 4.445 -7.227 69 HB2 TRP 9 2HB TRP 9 -2.006 6.563 -7.006 70 HB3 TRP 9 3HB TRP 9 -2.588 6.467 -8.666 71 HD1 TRP 9 HD1 TRP 9 -4.867 5.305 -9.045 72 HE1 TRP 9 HE1 TRP 9 -6.533 4.047 -7.540 73 HE3 TRP 9 HE3 TRP 9 -2.013 4.918 -4.820 74 HZ2 TRP 9 HZ2 TRP 9 -6.626 3.026 -4.910 75 HZ3 TRP 9 HZ3 TRP 9 -2.966 3.786 -2.854 76 HH2 TRP 9 HH2 TRP 9 -5.225 2.861 -2.900 77 H LYS 10 H LYS 10 -1.923 5.252 -10.535 78 HA LYS 10 HA LYS 10 -3.355 2.868 -10.961 79 HB2 LYS 10 2HB LYS 10 -2.493 5.161 -12.545 80 HB3 LYS 10 3HB LYS 10 -2.497 3.668 -13.474 81 HG2 LYS 10 2HG LYS 10 -4.897 3.844 -11.923 82 HG3 LYS 10 3HG LYS 10 -4.674 5.323 -12.860 83 HD2 LYS 10 2HD LYS 10 -4.574 4.120 -14.901 84 HD3 LYS 10 3HD LYS 10 -4.426 2.574 -14.062 85 HE2 LYS 10 2HE LYS 10 -6.634 2.355 -14.161 86 HE3 LYS 10 3HE LYS 10 -6.790 3.768 -13.118 87 HZ1 LYS 10 3HZ LYS 10 -8.009 3.887 -15.283 88 HZ2 LYS 10 1HZ LYS 10 -6.509 3.959 -16.062 89 HZ3 LYS 10 2HZ LYS 10 -6.962 5.182 -14.985 90 H MET 11 H MET 11 0.013 3.732 -11.512 91 HA MET 11 HA MET 11 0.718 1.421 -12.986 92 HB2 MET 11 2HB MET 11 1.988 3.697 -12.584 93 HB3 MET 11 3HB MET 11 2.703 2.816 -11.239 94 HG2 MET 11 2HG MET 11 4.201 2.043 -12.671 95 HG3 MET 11 3HG MET 11 2.912 1.073 -13.379 96 HE1 MET 11 3HE MET 11 4.966 4.653 -14.029 97 HE2 MET 11 1HE MET 11 5.645 3.029 -13.904 98 HE3 MET 11 2HE MET 11 5.499 3.805 -15.481 99 H ALA 12 H ALA 12 0.931 2.221 -9.535 100 HA ALA 12 HA ALA 12 2.219 -0.086 -8.653 101 HB1 ALA 12 1HB ALA 12 0.240 1.716 -7.277 102 HB2 ALA 12 2HB ALA 12 1.084 0.402 -6.458 103 HB3 ALA 12 3HB ALA 12 1.999 1.739 -7.155 104 H ILE 13 H ILE 13 -1.263 0.567 -8.969 105 HA ILE 13 HA ILE 13 -2.035 -2.045 -8.108 106 HB ILE 13 HB ILE 13 -3.629 0.031 -9.615 107 HG12 ILE 13 2HG1 ILE 13 -3.486 -0.610 -6.661 108 HG13 ILE 13 3HG1 ILE 13 -2.835 0.830 -7.436 109 HG21 ILE 13 1HG2 ILE 13 -4.574 -2.197 -9.868 110 HG22 ILE 13 2HG2 ILE 13 -4.539 -2.424 -8.120 111 HG23 ILE 13 3HG2 ILE 13 -5.595 -1.202 -8.829 112 HD11 ILE 13 3HD1 ILE 13 -4.836 1.539 -6.501 113 HD12 ILE 13 1HD1 ILE 13 -5.240 1.266 -8.196 114 HD13 ILE 13 2HD1 ILE 13 -5.691 0.072 -6.978 115 H LYS 14 H LYS 14 -1.369 -0.539 -11.197 116 HA LYS 14 HA LYS 14 -2.548 -2.364 -12.930 117 HB2 LYS 14 2HB LYS 14 -1.619 -0.302 -13.761 118 HB3 LYS 14 3HB LYS 14 -0.006 -0.758 -13.229 119 HG2 LYS 14 2HG LYS 14 0.129 -2.476 -14.882 120 HG3 LYS 14 3HG LYS 14 -1.566 -2.254 -15.323 121 HD2 LYS 14 2HD LYS 14 -0.693 0.241 -15.726 122 HD3 LYS 14 3HD LYS 14 0.814 -0.631 -16.019 123 HE2 LYS 14 2HE LYS 14 -0.983 -2.131 -17.419 124 HE3 LYS 14 3HE LYS 14 -1.642 -0.508 -17.616 125 HZ1 LYS 14 3HZ LYS 14 0.218 0.209 -18.730 126 HZ2 LYS 14 1HZ LYS 14 0.120 -1.391 -19.272 127 HZ3 LYS 14 2HZ LYS 14 1.227 -0.973 -18.063 128 H ARG 15 H ARG 15 0.671 -2.439 -11.438 129 HA ARG 15 HA ARG 15 1.380 -4.929 -12.674 130 HB2 ARG 15 2HB ARG 15 2.677 -2.920 -11.054 131 HB3 ARG 15 3HB ARG 15 3.033 -4.529 -10.440 132 HG2 ARG 15 2HG ARG 15 4.723 -3.831 -12.020 133 HG3 ARG 15 3HG ARG 15 3.811 -5.198 -12.664 134 HD2 ARG 15 2HD ARG 15 2.674 -2.608 -13.377 135 HD3 ARG 15 3HD ARG 15 4.318 -2.834 -13.974 136 HE ARG 15 HE ARG 15 2.653 -5.094 -14.497 137 HH11 ARG 15 1HH1 ARG 15 3.499 -1.904 -15.606 138 HH12 ARG 15 2HH1 ARG 15 3.050 -2.215 -17.251 139 HH21 ARG 15 1HH2 ARG 15 2.059 -5.516 -16.659 140 HH22 ARG 15 2HH2 ARG 15 2.230 -4.270 -17.848 141 H CYS 16 H CYS 16 0.332 -3.924 -9.440 142 HA CYS 16 HA CYS 16 0.544 -6.417 -8.184 143 HB2 CYS 16 2HB CYS 16 0.205 -4.268 -6.993 144 HB3 CYS 16 3HB CYS 16 -1.447 -4.217 -7.595 145 HG CYS 16 HG CYS 16 -1.735 -4.967 -4.999 146 H SER 17 H SER 17 -1.802 -5.166 -10.397 147 HA SER 17 HA SER 17 -3.977 -6.840 -9.780 148 HB2 SER 17 2HB SER 17 -4.927 -6.129 -11.816 149 HB3 SER 17 3HB SER 17 -3.906 -4.778 -11.325 150 HG SER 17 HG SER 17 -3.676 -5.418 -13.559 151 H ASN 18 H ASN 18 -0.953 -7.526 -11.171 152 HA ASN 18 HA ASN 18 -1.900 -9.942 -12.512 153 HB2 ASN 18 2HB ASN 18 -0.179 -8.390 -13.550 154 HB3 ASN 18 3HB ASN 18 0.948 -8.957 -12.321 155 HD21 ASN 18 1HD2 ASN 18 -1.233 -10.128 -14.847 156 HD22 ASN 18 2HD2 ASN 18 -0.253 -11.472 -15.314 157 H VAL 19 H VAL 19 -1.853 -9.525 -9.537 158 HA VAL 19 HA VAL 19 -0.044 -11.729 -8.797 159 HB VAL 19 HB VAL 19 -1.286 -9.620 -7.025 160 HG11 VAL 19 1HG1 VAL 19 0.096 -12.152 -6.463 161 HG12 VAL 19 2HG1 VAL 19 0.685 -10.757 -5.556 162 HG13 VAL 19 3HG1 VAL 19 -1.015 -11.217 -5.463 163 HG21 VAL 19 3HG2 VAL 19 1.453 -9.425 -6.829 164 HG22 VAL 19 1HG2 VAL 19 1.195 -9.741 -8.545 165 HG23 VAL 19 2HG2 VAL 19 0.407 -8.365 -7.773 166 H ALA 20 H ALA 20 -0.814 -13.478 -7.646 167 HA ALA 20 HA ALA 20 -3.712 -13.862 -7.775 168 HB1 ALA 20 1HB ALA 20 -2.086 -16.139 -6.923 169 HB2 ALA 20 2HB ALA 20 -3.308 -16.025 -8.191 170 HB3 ALA 20 3HB ALA 20 -1.655 -15.499 -8.510 171 H VAL 21 H VAL 21 -4.926 -14.591 -6.006 172 HA VAL 21 HA VAL 21 -4.308 -13.442 -3.525 173 HB VAL 21 HB VAL 21 -6.251 -14.581 -2.646 174 HG11 VAL 21 1HG1 VAL 21 -7.732 -13.370 -3.834 175 HG12 VAL 21 2HG1 VAL 21 -6.290 -12.786 -4.667 176 HG13 VAL 21 3HG1 VAL 21 -7.249 -14.089 -5.369 177 HG21 VAL 21 3HG2 VAL 21 -7.411 -16.105 -4.528 178 HG22 VAL 21 1HG2 VAL 21 -5.715 -16.428 -4.887 179 HG23 VAL 21 2HG2 VAL 21 -6.353 -16.753 -3.275 180 H GLY 22 H GLY 22 -3.521 -16.531 -4.877 181 HA2 GLY 22 2HA GLY 22 -1.679 -17.125 -2.806 182 HA3 GLY 22 3HA GLY 22 -3.139 -18.081 -2.599 183 H VAL 23 H VAL 23 -0.917 -19.480 -2.948 184 HA VAL 23 HA VAL 23 -0.114 -19.994 -5.594 185 HB VAL 23 HB VAL 23 1.169 -20.724 -3.613 186 HG11 VAL 23 1HG1 VAL 23 0.443 -22.233 -2.089 187 HG12 VAL 23 2HG1 VAL 23 -1.136 -21.641 -2.606 188 HG13 VAL 23 3HG1 VAL 23 -0.494 -23.143 -3.273 189 HG21 VAL 23 3HG2 VAL 23 0.584 -23.251 -5.057 190 HG22 VAL 23 1HG2 VAL 23 1.119 -21.865 -6.007 191 HG23 VAL 23 2HG2 VAL 23 2.131 -22.482 -4.701 192 H GLY 24 H GLY 24 -2.853 -21.069 -3.739 193 HA2 GLY 24 2HA GLY 24 -3.504 -23.264 -5.490 194 HA3 GLY 24 3HA GLY 24 -4.504 -22.631 -4.191 195 H GLY 25 H GLY 25 -5.768 -23.362 -6.440 196 HA2 GLY 25 2HA GLY 25 -7.571 -22.267 -7.536 197 HA3 GLY 25 3HA GLY 25 -6.649 -20.771 -7.497 198 H LYS 26 H LYS 26 -6.741 -20.276 -9.644 199 HA LYS 26 HA LYS 26 -5.088 -21.927 -11.391 200 HB2 LYS 26 2HB LYS 26 -7.985 -21.616 -11.642 201 HB3 LYS 26 3HB LYS 26 -7.117 -21.167 -13.104 202 HG2 LYS 26 2HG LYS 26 -5.934 -23.546 -12.329 203 HG3 LYS 26 3HG LYS 26 -7.651 -23.785 -11.994 204 HD2 LYS 26 2HD LYS 26 -7.824 -22.645 -14.417 205 HD3 LYS 26 3HD LYS 26 -6.245 -23.419 -14.572 206 HE2 LYS 26 2HE LYS 26 -8.214 -25.170 -13.355 207 HE3 LYS 26 3HE LYS 26 -8.719 -24.611 -14.948 208 HZ1 LYS 26 3HZ LYS 26 -7.304 -26.016 -15.877 209 HZ2 LYS 26 1HZ LYS 26 -6.886 -26.612 -14.349 210 HZ3 LYS 26 2HZ LYS 26 -6.002 -25.342 -15.032 211 H SER 27 H SER 27 -7.137 -19.010 -11.324 212 HA SER 27 HA SER 27 -4.880 -17.365 -12.062 213 HB2 SER 27 2HB SER 27 -5.905 -18.320 -14.224 214 HB3 SER 27 3HB SER 27 -7.278 -17.266 -13.885 215 HG SER 27 HG SER 27 -5.528 -16.398 -15.260 216 H LYS 28 H LYS 28 -6.629 -17.549 -9.799 217 HA LYS 28 HA LYS 28 -8.497 -15.359 -9.945 218 HB2 LYS 28 2HB LYS 28 -7.578 -17.212 -7.768 219 HB3 LYS 28 3HB LYS 28 -8.532 -15.786 -7.381 220 HG2 LYS 28 2HG LYS 28 -10.421 -16.740 -8.064 221 HG3 LYS 28 3HG LYS 28 -9.681 -17.334 -9.553 222 HD2 LYS 28 2HD LYS 28 -8.753 -18.745 -7.178 223 HD3 LYS 28 3HD LYS 28 -10.496 -18.877 -7.421 224 HE2 LYS 28 2HE LYS 28 -9.048 -19.213 -9.902 225 HE3 LYS 28 3HE LYS 28 -8.507 -20.363 -8.680 226 HZ1 LYS 28 3HZ LYS 28 -10.586 -20.814 -10.233 227 HZ2 LYS 28 1HZ LYS 28 -11.385 -20.012 -8.976 228 HZ3 LYS 28 2HZ LYS 28 -10.494 -21.412 -8.653 229 H LYS 29 H LYS 29 -7.263 -13.552 -10.476 230 HA LYS 29 HA LYS 29 -5.148 -12.754 -8.617 231 HB2 LYS 29 2HB LYS 29 -4.595 -11.038 -10.260 232 HB3 LYS 29 3HB LYS 29 -4.663 -12.621 -11.022 233 HG2 LYS 29 2HG LYS 29 -7.238 -11.393 -11.173 234 HG3 LYS 29 3HG LYS 29 -6.013 -10.273 -11.773 235 HD2 LYS 29 2HD LYS 29 -5.478 -11.594 -13.546 236 HD3 LYS 29 3HD LYS 29 -5.816 -13.090 -12.672 237 HE2 LYS 29 2HE LYS 29 -7.903 -13.180 -13.453 238 HE3 LYS 29 3HE LYS 29 -8.203 -11.488 -13.059 239 HZ1 LYS 29 3HZ LYS 29 -7.696 -12.652 -15.579 240 HZ2 LYS 29 1HZ LYS 29 -6.492 -11.512 -15.241 241 HZ3 LYS 29 2HZ LYS 29 -8.121 -11.055 -15.214 242 H PHE 30 H PHE 30 -5.097 -10.485 -7.884 243 HA PHE 30 HA PHE 30 -7.642 -9.753 -6.765 244 HB2 PHE 30 2HB PHE 30 -4.847 -8.673 -6.516 245 HB3 PHE 30 3HB PHE 30 -6.218 -7.798 -5.842 246 HD1 PHE 30 HD2 PHE 30 -7.897 -9.632 -4.587 247 HD2 PHE 30 HD1 PHE 30 -3.659 -9.808 -4.931 248 HE1 PHE 30 HE2 PHE 30 -7.794 -11.030 -2.565 249 HE2 PHE 30 HE1 PHE 30 -3.549 -11.207 -2.910 250 HZ PHE 30 HZ PHE 30 -5.618 -11.819 -1.724 251 H GLY 31 H GLY 31 -7.882 -7.139 -6.685 252 HA2 GLY 31 2HA GLY 31 -7.494 -5.971 -9.321 253 HA3 GLY 31 3HA GLY 31 -9.163 -6.273 -8.861 254 H GLU 32 H GLU 32 -8.444 -3.732 -9.434 255 HA GLU 32 HA GLU 32 -7.446 -2.150 -7.378 256 HB2 GLU 32 2HB GLU 32 -8.767 -0.302 -8.430 257 HB3 GLU 32 3HB GLU 32 -7.761 -1.205 -9.555 258 HG2 GLU 32 2HG GLU 32 -9.781 -2.527 -10.182 259 HG3 GLU 32 3HG GLU 32 -10.737 -1.429 -9.188 260 H GLY 33 H GLY 33 -10.792 -3.152 -8.023 261 HA2 GLY 33 2HA GLY 33 -12.057 -1.714 -6.000 262 HA3 GLY 33 3HA GLY 33 -12.632 -3.240 -6.655 263 H ASN 34 H ASN 34 -10.532 -4.910 -5.859 264 HA ASN 34 HA ASN 34 -11.314 -5.549 -3.238 265 HB2 ASN 34 2HB ASN 34 -9.222 -6.502 -5.126 266 HB3 ASN 34 3HB ASN 34 -9.019 -6.914 -3.426 267 HD21 ASN 34 1HD2 ASN 34 -10.480 -7.751 -6.316 268 HD22 ASN 34 2HD2 ASN 34 -11.594 -8.926 -5.714 269 H PHE 35 H PHE 35 -8.288 -4.116 -4.449 270 HA PHE 35 HA PHE 35 -7.006 -3.805 -1.997 271 HB2 PHE 35 2HB PHE 35 -6.783 -1.923 -4.352 272 HB3 PHE 35 3HB PHE 35 -5.579 -2.198 -3.097 273 HD1 PHE 35 HD2 PHE 35 -5.528 -5.109 -2.902 274 HD2 PHE 35 HD1 PHE 35 -5.805 -2.601 -6.330 275 HE1 PHE 35 HE2 PHE 35 -4.503 -6.876 -4.273 276 HE2 PHE 35 HE1 PHE 35 -4.782 -4.365 -7.707 277 HZ PHE 35 HZ PHE 35 -4.128 -6.506 -6.679 278 H ARG 36 H ARG 36 -9.430 -1.817 -3.569 279 HA ARG 36 HA ARG 36 -9.193 0.465 -1.936 280 HB2 ARG 36 2HB ARG 36 -11.619 -0.608 -3.388 281 HB3 ARG 36 3HB ARG 36 -11.470 1.012 -2.720 282 HG2 ARG 36 2HG ARG 36 -9.315 0.257 -4.553 283 HG3 ARG 36 3HG ARG 36 -10.918 0.330 -5.286 284 HD2 ARG 36 2HD ARG 36 -10.513 2.582 -3.549 285 HD3 ARG 36 3HD ARG 36 -9.192 2.465 -4.711 286 HE ARG 36 HE ARG 36 -11.800 2.197 -5.890 287 HH11 ARG 36 1HH1 ARG 36 -9.332 4.431 -4.870 288 HH12 ARG 36 2HH1 ARG 36 -9.843 5.689 -5.946 289 HH21 ARG 36 1HH2 ARG 36 -12.482 3.845 -7.311 290 HH22 ARG 36 2HH2 ARG 36 -11.635 5.355 -7.334 291 H TRP 37 H TRP 37 -11.455 -2.282 -1.749 292 HA TRP 37 HA TRP 37 -12.814 -1.514 0.547 293 HB2 TRP 37 2HB TRP 37 -13.634 -3.345 -0.773 294 HB3 TRP 37 3HB TRP 37 -12.159 -4.270 -0.505 295 HD1 TRP 37 HD1 TRP 37 -15.514 -3.489 1.048 296 HE1 TRP 37 HE1 TRP 37 -15.817 -4.904 3.176 297 HE3 TRP 37 HE3 TRP 37 -10.767 -5.338 1.476 298 HZ2 TRP 37 HZ2 TRP 37 -14.251 -6.583 4.819 299 HZ3 TRP 37 HZ3 TRP 37 -10.252 -6.841 3.354 300 HH2 TRP 37 HH2 TRP 37 -11.959 -7.449 4.991 301 H ALA 38 H ALA 38 -9.767 -3.262 0.206 302 HA ALA 38 HA ALA 38 -9.465 -3.840 2.978 303 HB1 ALA 38 1HB ALA 38 -7.889 -4.179 0.537 304 HB2 ALA 38 2HB ALA 38 -6.923 -3.899 1.986 305 HB3 ALA 38 3HB ALA 38 -8.065 -5.242 1.933 306 H ILE 39 H ILE 39 -7.651 -1.575 0.894 307 HA ILE 39 HA ILE 39 -6.267 -0.241 2.871 308 HB ILE 39 HB ILE 39 -7.364 0.948 0.320 309 HG12 ILE 39 2HG1 ILE 39 -4.563 -0.053 0.765 310 HG13 ILE 39 3HG1 ILE 39 -5.842 -1.150 0.255 311 HG21 ILE 39 1HG2 ILE 39 -5.245 1.896 2.233 312 HG22 ILE 39 2HG2 ILE 39 -5.389 2.494 0.581 313 HG23 ILE 39 3HG2 ILE 39 -6.709 2.739 1.725 314 HD11 ILE 39 3HD1 ILE 39 -4.539 -0.342 -1.633 315 HD12 ILE 39 1HD1 ILE 39 -6.215 0.196 -1.734 316 HD13 ILE 39 2HD1 ILE 39 -4.957 1.320 -1.218 317 H ARG 40 H ARG 40 -9.341 0.815 1.394 318 HA ARG 40 HA ARG 40 -9.821 3.024 2.978 319 HB2 ARG 40 2HB ARG 40 -11.740 1.066 1.718 320 HB3 ARG 40 3HB ARG 40 -12.274 2.533 2.528 321 HG2 ARG 40 2HG ARG 40 -10.464 3.588 0.859 322 HG3 ARG 40 3HG ARG 40 -10.956 2.180 -0.085 323 HD2 ARG 40 2HD ARG 40 -13.278 3.418 1.017 324 HD3 ARG 40 3HD ARG 40 -12.301 4.648 0.217 325 HE ARG 40 HE ARG 40 -13.730 2.479 -1.029 326 HH11 ARG 40 1HH1 ARG 40 -11.144 4.788 -1.349 327 HH12 ARG 40 2HH1 ARG 40 -11.151 4.751 -3.081 328 HH21 ARG 40 1HH2 ARG 40 -13.749 2.422 -3.309 329 HH22 ARG 40 2HH2 ARG 40 -12.634 3.406 -4.195 330 H MET 41 H MET 41 -10.917 -0.318 3.553 331 HA MET 41 HA MET 41 -12.276 0.066 5.924 332 HB2 MET 41 2HB MET 41 -12.320 -2.063 4.782 333 HB3 MET 41 3HB MET 41 -10.597 -2.289 5.051 334 HG2 MET 41 2HG MET 41 -10.948 -3.203 7.035 335 HG3 MET 41 3HG MET 41 -11.973 -1.862 7.541 336 HE1 MET 41 3HE MET 41 -12.916 -3.555 9.012 337 HE2 MET 41 1HE MET 41 -14.499 -2.929 8.547 338 HE3 MET 41 2HE MET 41 -14.216 -4.670 8.588 339 H ALA 42 H ALA 42 -8.825 -0.115 5.358 340 HA ALA 42 HA ALA 42 -8.032 -0.413 8.064 341 HB1 ALA 42 1HB ALA 42 -6.253 1.002 6.156 342 HB2 ALA 42 2HB ALA 42 -5.891 -0.294 7.297 343 HB3 ALA 42 3HB ALA 42 -6.710 -0.660 5.778 344 H ASN 43 H ASN 43 -8.073 2.452 5.936 345 HA ASN 43 HA ASN 43 -7.277 4.341 7.798 346 HB2 ASN 43 2HB ASN 43 -8.970 4.478 5.327 347 HB3 ASN 43 3HB ASN 43 -8.782 5.910 6.336 348 HD21 ASN 43 1HD2 ASN 43 -7.923 6.079 3.825 349 HD22 ASN 43 2HD2 ASN 43 -6.197 6.059 3.750 350 H VAL 44 H VAL 44 -10.379 2.813 7.362 351 HA VAL 44 HA VAL 44 -11.773 4.654 9.098 352 HB VAL 44 HB VAL 44 -12.669 1.994 7.980 353 HG11 VAL 44 1HG1 VAL 44 -14.095 4.135 9.527 354 HG12 VAL 44 2HG1 VAL 44 -14.960 3.005 8.483 355 HG13 VAL 44 3HG1 VAL 44 -14.021 2.403 9.851 356 HG21 VAL 44 3HG2 VAL 44 -12.246 4.430 6.671 357 HG22 VAL 44 1HG2 VAL 44 -13.124 3.025 6.064 358 HG23 VAL 44 2HG2 VAL 44 -13.991 4.312 6.903 359 H SER 45 H SER 45 -11.105 1.150 9.257 360 HA SER 45 HA SER 45 -11.896 0.712 11.864 361 HB2 SER 45 2HB SER 45 -9.654 -0.617 10.326 362 HB3 SER 45 3HB SER 45 -10.330 -1.232 11.834 363 HG SER 45 HG SER 45 -11.615 -2.235 10.482 364 H THR 46 H THR 46 -8.800 1.898 10.662 365 HA THR 46 HA THR 46 -7.628 1.972 13.303 366 HB THR 46 HB THR 46 -5.658 2.872 12.252 367 HG1 THR 46 HG1 THR 46 -6.110 4.244 10.686 368 HG21 THR 46 3HG2 THR 46 -6.980 0.704 10.627 369 HG22 THR 46 1HG2 THR 46 -5.853 0.511 11.969 370 HG23 THR 46 2HG2 THR 46 -5.291 1.170 10.433 371 H GLY 47 H GLY 47 -9.384 4.108 11.218 372 HA2 GLY 47 2HA GLY 47 -9.218 6.186 13.282 373 HA3 GLY 47 3HA GLY 47 -8.810 6.621 11.629 374 H ARG 48 H ARG 48 -10.429 6.810 10.090 375 HA ARG 48 HA ARG 48 -13.088 6.009 10.391 376 HB2 ARG 48 2HB ARG 48 -12.472 8.188 12.047 377 HB3 ARG 48 3HB ARG 48 -13.343 8.873 10.682 378 HG2 ARG 48 2HG ARG 48 -14.988 6.875 11.159 379 HG3 ARG 48 3HG ARG 48 -14.271 6.975 12.768 380 HD2 ARG 48 2HD ARG 48 -14.837 9.615 11.972 381 HD3 ARG 48 3HD ARG 48 -16.254 8.652 11.557 382 HE ARG 48 HE ARG 48 -15.362 8.066 14.185 383 HH11 ARG 48 1HH1 ARG 48 -17.060 10.461 12.314 384 HH12 ARG 48 2HH1 ARG 48 -17.991 11.038 13.656 385 HH21 ARG 48 1HH2 ARG 48 -16.582 8.817 15.960 386 HH22 ARG 48 2HH2 ARG 48 -17.718 10.103 15.730 387 H GLU 49 H GLU 49 -14.005 6.092 8.437 388 HA GLU 49 HA GLU 49 -14.375 6.581 6.247 389 HB2 GLU 49 2HB GLU 49 -13.769 9.155 7.493 390 HB3 GLU 49 3HB GLU 49 -13.389 9.118 5.777 391 HG2 GLU 49 2HG GLU 49 -15.534 9.160 5.187 392 HG3 GLU 49 3HG GLU 49 -15.982 7.952 6.390 393 HA PRO 50 HA PRO 50 -10.708 5.723 3.999 394 HB2 PRO 50 2HB PRO 50 -11.259 6.767 1.555 395 HB3 PRO 50 3HB PRO 50 -12.037 5.306 2.172 396 HG2 PRO 50 2HG PRO 50 -13.063 8.117 2.113 397 HG3 PRO 50 3HG PRO 50 -13.912 6.608 1.731 398 HD2 PRO 50 2HD PRO 50 -14.193 7.877 4.107 399 HD3 PRO 50 3HD PRO 50 -14.288 6.111 3.950 400 H GLY 51 H GLY 51 -11.841 9.042 3.318 401 HA2 GLY 51 2HA GLY 51 -10.710 11.044 3.330 402 HA3 GLY 51 3HA GLY 51 -9.441 10.241 4.242 403 H ASP 52 H ASP 52 -7.726 9.232 3.123 404 HA ASP 52 HA ASP 52 -7.580 9.563 0.239 405 HB2 ASP 52 2HB ASP 52 -6.482 11.513 1.949 406 HB3 ASP 52 3HB ASP 52 -5.120 10.565 1.359 407 H ILE 53 H ILE 53 -4.983 9.026 -0.235 408 HA ILE 53 HA ILE 53 -4.581 6.417 1.076 409 HB ILE 53 HB ILE 53 -3.289 5.859 -1.061 410 HG12 ILE 53 2HG1 ILE 53 -4.993 7.704 -2.583 411 HG13 ILE 53 3HG1 ILE 53 -3.737 8.505 -1.646 412 HG21 ILE 53 1HG2 ILE 53 -6.216 6.033 -0.681 413 HG22 ILE 53 2HG2 ILE 53 -5.645 5.656 -2.305 414 HG23 ILE 53 3HG2 ILE 53 -5.187 4.626 -0.949 415 HD11 ILE 53 3HD1 ILE 53 -3.532 7.081 -4.117 416 HD12 ILE 53 1HD1 ILE 53 -2.323 8.055 -3.281 417 HD13 ILE 53 2HD1 ILE 53 -2.490 6.340 -2.903 418 HA PRO 54 HA PRO 54 -0.591 7.646 2.434 419 HB2 PRO 54 2HB PRO 54 0.791 5.319 2.222 420 HB3 PRO 54 3HB PRO 54 -0.436 5.598 3.463 421 HG2 PRO 54 2HG PRO 54 -0.669 4.128 0.866 422 HG3 PRO 54 3HG PRO 54 -1.299 3.684 2.463 423 HD2 PRO 54 2HD PRO 54 -2.850 4.797 0.542 424 HD3 PRO 54 3HD PRO 54 -3.119 5.085 2.273 425 H GLU 55 H GLU 55 1.283 8.480 1.645 426 HA GLU 55 HA GLU 55 1.938 7.865 -1.162 427 HB2 GLU 55 2HB GLU 55 2.800 10.154 -1.350 428 HB3 GLU 55 3HB GLU 55 1.101 10.142 -0.900 429 HG2 GLU 55 2HG GLU 55 2.410 10.175 1.527 430 HG3 GLU 55 3HG GLU 55 3.391 11.225 0.506 431 H THR 56 H THR 56 3.108 8.184 2.081 432 HA THR 56 HA THR 56 5.877 7.772 1.193 433 HB THR 56 HB THR 56 6.608 8.471 3.346 434 HG1 THR 56 HG1 THR 56 5.320 8.512 5.095 435 HG21 THR 56 3HG2 THR 56 5.799 10.262 1.811 436 HG22 THR 56 1HG2 THR 56 5.725 10.703 3.516 437 HG23 THR 56 2HG2 THR 56 4.255 10.234 2.662 438 H LEU 57 H LEU 57 7.067 6.005 1.821 439 HA LEU 57 HA LEU 57 5.670 3.600 2.316 440 HB2 LEU 57 2HB LEU 57 7.858 3.839 1.118 441 HB3 LEU 57 3HB LEU 57 8.618 4.092 2.687 442 HG LEU 57 HG LEU 57 8.038 1.845 3.371 443 HD11 LEU 57 1HD1 LEU 57 7.186 0.589 1.033 444 HD12 LEU 57 2HD1 LEU 57 6.191 2.038 1.170 445 HD13 LEU 57 3HD1 LEU 57 6.244 0.877 2.496 446 HD21 LEU 57 3HD2 LEU 57 9.693 0.798 2.207 447 HD22 LEU 57 1HD2 LEU 57 10.014 2.462 1.719 448 HD23 LEU 57 2HD2 LEU 57 9.122 1.385 0.644 449 H ASP 58 H ASP 58 7.448 5.812 4.391 450 HA ASP 58 HA ASP 58 7.582 4.196 6.686 451 HB2 ASP 58 2HB ASP 58 7.445 7.210 6.451 452 HB3 ASP 58 3HB ASP 58 7.878 6.334 7.917 453 H GLN 59 H GLN 59 5.151 6.561 5.640 454 HA GLN 59 HA GLN 59 3.502 6.391 7.904 455 HB2 GLN 59 2HB GLN 59 3.281 8.191 6.279 456 HB3 GLN 59 3HB GLN 59 2.787 7.043 5.041 457 HG2 GLN 59 2HG GLN 59 0.684 6.849 5.856 458 HG3 GLN 59 3HG GLN 59 1.186 7.111 7.525 459 HE21 GLN 59 1HE2 GLN 59 1.016 8.842 4.433 460 HE22 GLN 59 2HE2 GLN 59 0.486 10.342 5.106 461 H LEU 60 H LEU 60 3.214 4.746 4.755 462 HA LEU 60 HA LEU 60 0.971 3.213 5.316 463 HB2 LEU 60 2HB LEU 60 1.861 3.387 3.087 464 HB3 LEU 60 3HB LEU 60 3.351 2.584 3.579 465 HG LEU 60 HG LEU 60 1.536 0.671 4.185 466 HD11 LEU 60 1HD1 LEU 60 -0.428 1.539 3.370 467 HD12 LEU 60 2HD1 LEU 60 0.152 0.638 1.970 468 HD13 LEU 60 3HD1 LEU 60 0.368 2.387 2.044 469 HD21 LEU 60 3HD2 LEU 60 2.728 1.064 1.445 470 HD22 LEU 60 1HD2 LEU 60 2.295 -0.461 2.218 471 HD23 LEU 60 2HD2 LEU 60 3.633 0.498 2.850 472 H ARG 61 H ARG 61 4.346 2.649 6.120 473 HA ARG 61 HA ARG 61 4.114 -0.027 6.953 474 HB2 ARG 61 2HB ARG 61 6.271 1.084 6.521 475 HB3 ARG 61 3HB ARG 61 6.026 2.098 7.936 476 HG2 ARG 61 2HG ARG 61 6.258 0.273 9.410 477 HG3 ARG 61 3HG ARG 61 6.123 -0.898 8.096 478 HD2 ARG 61 2HD ARG 61 8.376 -0.919 8.283 479 HD3 ARG 61 3HD ARG 61 8.244 0.490 7.233 480 HE ARG 61 HE ARG 61 8.090 1.382 9.867 481 HH11 ARG 61 1HH1 ARG 61 10.390 -0.150 7.750 482 HH12 ARG 61 2HH1 ARG 61 11.771 0.530 8.545 483 HH21 ARG 61 1HH2 ARG 61 9.900 2.283 10.922 484 HH22 ARG 61 2HH2 ARG 61 11.491 1.914 10.349 485 H LEU 62 H LEU 62 3.948 3.007 8.802 486 HA LEU 62 HA LEU 62 3.467 1.783 11.304 487 HB2 LEU 62 2HB LEU 62 4.279 4.096 11.004 488 HB3 LEU 62 3HB LEU 62 2.693 4.548 10.381 489 HG LEU 62 HG LEU 62 1.736 3.905 12.609 490 HD11 LEU 62 1HD1 LEU 62 3.995 4.211 14.228 491 HD12 LEU 62 2HD1 LEU 62 4.439 3.017 13.008 492 HD13 LEU 62 3HD1 LEU 62 3.014 2.761 14.014 493 HD21 LEU 62 3HD2 LEU 62 2.127 5.996 13.514 494 HD22 LEU 62 1HD2 LEU 62 2.519 6.249 11.813 495 HD23 LEU 62 2HD2 LEU 62 3.812 6.024 12.991 496 H VAL 63 H VAL 63 1.439 2.462 8.603 497 HA VAL 63 HA VAL 63 -1.056 2.528 9.964 498 HB VAL 63 HB VAL 63 -0.461 1.820 7.087 499 HG11 VAL 63 1HG1 VAL 63 -2.900 1.748 8.615 500 HG12 VAL 63 2HG1 VAL 63 -3.014 2.931 7.311 501 HG13 VAL 63 3HG1 VAL 63 -2.606 1.254 6.948 502 HG21 VAL 63 3HG2 VAL 63 -0.076 4.227 8.355 503 HG22 VAL 63 1HG2 VAL 63 -0.320 4.003 6.623 504 HG23 VAL 63 2HG2 VAL 63 -1.688 4.402 7.662 505 H ILE 64 H ILE 64 0.343 -0.015 7.884 506 HA ILE 64 HA ILE 64 -1.492 -2.008 8.465 507 HB ILE 64 HB ILE 64 0.081 -2.280 6.658 508 HG12 ILE 64 2HG1 ILE 64 0.994 -4.460 8.460 509 HG13 ILE 64 3HG1 ILE 64 -0.744 -4.269 8.258 510 HG21 ILE 64 1HG2 ILE 64 2.439 -2.626 6.985 511 HG22 ILE 64 2HG2 ILE 64 1.969 -1.114 7.761 512 HG23 ILE 64 3HG2 ILE 64 2.246 -2.557 8.737 513 HD11 ILE 64 3HD1 ILE 64 0.836 -4.261 5.779 514 HD12 ILE 64 1HD1 ILE 64 0.794 -5.783 6.667 515 HD13 ILE 64 2HD1 ILE 64 -0.710 -5.026 6.144 516 H CYS 65 H CYS 65 1.457 -1.106 10.184 517 HA CYS 65 HA CYS 65 1.482 -3.268 11.994 518 HB2 CYS 65 2HB CYS 65 2.671 -0.503 12.065 519 HB3 CYS 65 3HB CYS 65 2.850 -1.612 13.420 520 HG CYS 65 HG CYS 65 4.725 -1.368 10.816 521 H ASP 66 H ASP 66 0.304 0.071 12.393 522 HA ASP 66 HA ASP 66 -0.680 -0.162 14.977 523 HB2 ASP 66 2HB ASP 66 -0.512 1.993 13.877 524 HB3 ASP 66 3HB ASP 66 -1.717 1.515 12.684 525 H LEU 67 H LEU 67 -2.291 -0.857 11.898 526 HA LEU 67 HA LEU 67 -4.796 -1.535 13.045 527 HB2 LEU 67 2HB LEU 67 -4.524 -0.881 10.699 528 HB3 LEU 67 3HB LEU 67 -3.603 -2.353 10.399 529 HG LEU 67 HG LEU 67 -6.223 -2.921 11.511 530 HD11 LEU 67 1HD1 LEU 67 -6.032 -0.934 9.372 531 HD12 LEU 67 2HD1 LEU 67 -7.382 -1.341 10.430 532 HD13 LEU 67 3HD1 LEU 67 -7.064 -2.314 8.994 533 HD21 LEU 67 3HD2 LEU 67 -6.303 -4.335 9.435 534 HD22 LEU 67 1HD2 LEU 67 -4.935 -4.644 10.505 535 HD23 LEU 67 2HD2 LEU 67 -4.705 -3.703 9.031 536 H GLN 68 H GLN 68 -2.252 -3.604 11.635 537 HA GLN 68 HA GLN 68 -3.326 -6.063 12.293 538 HB2 GLN 68 2HB GLN 68 -1.390 -5.852 10.845 539 HB3 GLN 68 3HB GLN 68 -0.420 -5.240 12.178 540 HG2 GLN 68 2HG GLN 68 -1.537 -7.755 12.923 541 HG3 GLN 68 3HG GLN 68 -0.763 -7.907 11.346 542 HE21 GLN 68 1HE2 GLN 68 1.456 -7.030 11.193 543 HE22 GLN 68 2HE2 GLN 68 2.500 -7.225 12.556 544 H GLU 69 H GLU 69 -1.690 -3.754 14.323 545 HA GLU 69 HA GLU 69 -1.125 -5.514 16.483 546 HB2 GLU 69 2HB GLU 69 -0.029 -3.291 16.101 547 HB3 GLU 69 3HB GLU 69 -1.528 -2.522 16.602 548 HG2 GLU 69 2HG GLU 69 -0.447 -2.477 18.583 549 HG3 GLU 69 3HG GLU 69 -1.173 -4.078 18.719 550 H ARG 70 H ARG 70 -3.569 -2.924 16.227 551 HA ARG 70 HA ARG 70 -5.004 -3.656 18.516 552 HB2 ARG 70 2HB ARG 70 -5.291 -1.779 16.344 553 HB3 ARG 70 3HB ARG 70 -6.844 -2.511 16.723 554 HG2 ARG 70 2HG ARG 70 -6.362 -1.921 19.145 555 HG3 ARG 70 3HG ARG 70 -5.049 -0.920 18.523 556 HD2 ARG 70 2HD ARG 70 -7.430 -0.402 17.025 557 HD3 ARG 70 3HD ARG 70 -7.785 -0.268 18.747 558 HE ARG 70 HE ARG 70 -6.191 1.512 17.172 559 HH11 ARG 70 1HH1 ARG 70 -6.688 0.239 20.374 560 HH12 ARG 70 2HH1 ARG 70 -5.999 1.615 21.169 561 HH21 ARG 70 1HH2 ARG 70 -5.282 3.330 18.208 562 HH22 ARG 70 2HH2 ARG 70 -5.201 3.373 19.936 563 H ARG 71 H ARG 71 -5.597 -4.443 15.098 564 HA ARG 71 HA ARG 71 -7.928 -5.912 15.398 565 HB2 ARG 71 2HB ARG 71 -5.676 -6.395 13.437 566 HB3 ARG 71 3HB ARG 71 -7.312 -7.023 13.286 567 HG2 ARG 71 2HG ARG 71 -6.817 -4.080 13.495 568 HG3 ARG 71 3HG ARG 71 -6.657 -4.925 11.954 569 HD2 ARG 71 2HD ARG 71 -8.853 -4.721 11.686 570 HD3 ARG 71 3HD ARG 71 -9.069 -5.816 13.051 571 HE ARG 71 HE ARG 71 -8.642 -3.152 13.934 572 HH11 ARG 71 1HH1 ARG 71 -11.042 -5.256 12.544 573 HH12 ARG 71 2HH1 ARG 71 -12.382 -4.375 13.199 574 HH21 ARG 71 1HH2 ARG 71 -10.398 -1.983 14.801 575 HH22 ARG 71 2HH2 ARG 71 -12.015 -2.513 14.481 576 H GLU 72 H GLU 72 -4.560 -6.983 15.659 577 HA GLU 72 HA GLU 72 -5.031 -9.719 15.960 578 HB2 GLU 72 2HB GLU 72 -2.821 -7.862 16.652 579 HB3 GLU 72 3HB GLU 72 -2.827 -9.422 17.463 580 HG2 GLU 72 2HG GLU 72 -3.216 -9.432 14.533 581 HG3 GLU 72 3HG GLU 72 -1.615 -9.003 15.133 582 H LYS 73 H LYS 73 -4.692 -7.199 18.448 583 HA LYS 73 HA LYS 73 -5.007 -8.789 20.700 584 HB2 LYS 73 2HB LYS 73 -4.497 -6.231 20.429 585 HB3 LYS 73 3HB LYS 73 -6.239 -6.061 20.597 586 HG2 LYS 73 2HG LYS 73 -5.376 -5.769 22.753 587 HG3 LYS 73 3HG LYS 73 -6.020 -7.413 22.732 588 HD2 LYS 73 2HD LYS 73 -3.721 -8.239 22.254 589 HD3 LYS 73 3HD LYS 73 -3.131 -6.588 22.455 590 HE2 LYS 73 2HE LYS 73 -2.776 -7.680 24.525 591 HE3 LYS 73 3HE LYS 73 -4.170 -6.624 24.753 592 HZ1 LYS 73 3HZ LYS 73 -4.700 -8.690 25.731 593 HZ2 LYS 73 1HZ LYS 73 -4.170 -9.565 24.383 594 HZ3 LYS 73 2HZ LYS 73 -5.574 -8.626 24.283 595 H PHE 74 H PHE 74 -7.446 -7.372 18.584 596 HA PHE 74 HA PHE 74 -9.652 -8.215 20.215 597 HB2 PHE 74 2HB PHE 74 -9.663 -6.237 18.628 598 HB3 PHE 74 3HB PHE 74 -9.752 -7.400 17.309 599 HD1 PHE 74 HD1 PHE 74 -11.459 -6.976 20.605 600 HD2 PHE 74 HD2 PHE 74 -11.844 -7.580 16.409 601 HE1 PHE 74 HE1 PHE 74 -13.907 -7.053 20.844 602 HE2 PHE 74 HE2 PHE 74 -14.292 -7.656 16.641 603 HZ PHE 74 HZ PHE 74 -15.327 -7.391 18.861 604 H GLY 75 H GLY 75 -7.768 -9.585 17.648 605 HA2 GLY 75 2HA GLY 75 -7.950 -12.112 17.718 606 HA3 GLY 75 3HA GLY 75 -9.667 -11.838 17.461 607 H SER 76 H SER 76 -8.364 -13.447 15.726 608 HA SER 76 HA SER 76 -7.547 -11.887 13.414 609 HB2 SER 76 2HB SER 76 -7.353 -14.710 14.256 610 HB3 SER 76 3HB SER 76 -7.599 -14.461 12.527 611 HG SER 76 HG SER 76 -5.532 -13.369 14.137 612 H SER 77 H SER 77 -8.555 -12.061 11.355 613 HA SER 77 HA SER 77 -11.117 -13.335 11.088 614 HB2 SER 77 2HB SER 77 -12.535 -11.563 11.244 615 HB3 SER 77 3HB SER 77 -11.264 -10.898 12.269 616 HG SER 77 HG SER 77 -12.171 -9.680 10.289 617 H LYS 78 H LYS 78 -11.761 -13.539 8.961 618 HA LYS 78 HA LYS 78 -9.842 -13.560 6.978 619 HB2 LYS 78 2HB LYS 78 -12.814 -13.664 7.006 620 HB3 LYS 78 3HB LYS 78 -12.035 -13.358 5.459 621 HG2 LYS 78 2HG LYS 78 -10.647 -15.499 6.638 622 HG3 LYS 78 3HG LYS 78 -12.368 -15.825 6.859 623 HD2 LYS 78 2HD LYS 78 -12.273 -16.645 4.772 624 HD3 LYS 78 3HD LYS 78 -12.291 -14.951 4.274 625 HE2 LYS 78 2HE LYS 78 -10.461 -15.755 3.126 626 HE3 LYS 78 3HE LYS 78 -9.710 -15.119 4.589 627 HZ1 LYS 78 3HZ LYS 78 -8.930 -17.123 5.054 628 HZ2 LYS 78 1HZ LYS 78 -9.555 -17.704 3.593 629 HZ3 LYS 78 2HZ LYS 78 -10.480 -17.799 5.006 630 H GLU 79 H GLU 79 -12.022 -10.975 7.920 631 HA GLU 79 HA GLU 79 -11.554 -9.297 5.685 632 HB2 GLU 79 2HB GLU 79 -12.438 -8.595 8.489 633 HB3 GLU 79 3HB GLU 79 -12.498 -7.506 7.111 634 HG2 GLU 79 2HG GLU 79 -14.204 -8.702 6.080 635 HG3 GLU 79 3HG GLU 79 -13.903 -10.145 7.046 636 H ILE 80 H ILE 80 -10.142 -9.399 8.943 637 HA ILE 80 HA ILE 80 -8.392 -7.216 8.587 638 HB ILE 80 HB ILE 80 -8.086 -9.581 10.441 639 HG12 ILE 80 2HG1 ILE 80 -9.165 -6.850 11.123 640 HG13 ILE 80 3HG1 ILE 80 -10.214 -8.160 10.592 641 HG21 ILE 80 1HG2 ILE 80 -6.817 -6.847 10.541 642 HG22 ILE 80 2HG2 ILE 80 -6.640 -8.116 11.752 643 HG23 ILE 80 3HG2 ILE 80 -5.999 -8.353 10.126 644 HD11 ILE 80 3HD1 ILE 80 -8.353 -8.674 12.845 645 HD12 ILE 80 1HD1 ILE 80 -9.782 -7.683 13.137 646 HD13 ILE 80 2HD1 ILE 80 -9.960 -9.329 12.528 647 H ASP 81 H ASP 81 -7.714 -10.718 8.522 648 HA ASP 81 HA ASP 81 -5.050 -10.563 7.746 649 HB2 ASP 81 2HB ASP 81 -7.174 -12.651 7.483 650 HB3 ASP 81 3HB ASP 81 -5.646 -12.883 6.638 651 H MET 82 H MET 82 -7.974 -10.301 5.848 652 HA MET 82 HA MET 82 -6.821 -10.650 3.295 653 HB2 MET 82 2HB MET 82 -9.205 -10.814 3.557 654 HB3 MET 82 3HB MET 82 -9.300 -9.173 4.182 655 HG2 MET 82 2HG MET 82 -9.542 -8.357 2.145 656 HG3 MET 82 3HG MET 82 -8.059 -9.143 1.609 657 HE1 MET 82 3HE MET 82 -11.702 -11.485 2.342 658 HE2 MET 82 1HE MET 82 -11.457 -9.809 2.835 659 HE3 MET 82 2HE MET 82 -12.335 -10.171 1.349 660 H ALA 83 H ALA 83 -7.604 -7.702 5.131 661 HA ALA 83 HA ALA 83 -6.699 -5.831 3.283 662 HB1 ALA 83 1HB ALA 83 -6.228 -5.247 6.147 663 HB2 ALA 83 2HB ALA 83 -7.030 -4.282 4.907 664 HB3 ALA 83 3HB ALA 83 -7.880 -5.629 5.664 665 H ILE 84 H ILE 84 -4.921 -7.448 5.898 666 HA ILE 84 HA ILE 84 -2.482 -6.129 5.596 667 HB ILE 84 HB ILE 84 -2.934 -8.995 6.439 668 HG12 ILE 84 2HG1 ILE 84 -2.725 -6.458 8.077 669 HG13 ILE 84 3HG1 ILE 84 -4.197 -7.381 7.796 670 HG21 ILE 84 1HG2 ILE 84 -0.701 -7.792 7.714 671 HG22 ILE 84 2HG2 ILE 84 -0.733 -9.180 6.628 672 HG23 ILE 84 3HG2 ILE 84 -0.536 -7.554 5.974 673 HD11 ILE 84 3HD1 ILE 84 -2.495 -9.265 8.821 674 HD12 ILE 84 1HD1 ILE 84 -2.056 -7.810 9.714 675 HD13 ILE 84 2HD1 ILE 84 -3.725 -8.381 9.724 676 H VAL 85 H VAL 85 -3.684 -9.077 4.029 677 HA VAL 85 HA VAL 85 -1.352 -9.695 2.592 678 HB VAL 85 HB VAL 85 -4.223 -10.286 1.857 679 HG11 VAL 85 1HG1 VAL 85 -2.883 -12.299 0.761 680 HG12 VAL 85 2HG1 VAL 85 -3.183 -10.790 -0.105 681 HG13 VAL 85 3HG1 VAL 85 -1.621 -11.071 0.667 682 HG21 VAL 85 3HG2 VAL 85 -2.599 -12.465 2.893 683 HG22 VAL 85 1HG2 VAL 85 -2.801 -11.153 4.054 684 HG23 VAL 85 2HG2 VAL 85 -4.217 -11.941 3.358 685 H THR 86 H THR 86 -4.294 -7.991 1.517 686 HA THR 86 HA THR 86 -3.402 -7.356 -1.054 687 HB THR 86 HB THR 86 -5.100 -5.522 -0.993 688 HG1 THR 86 HG1 THR 86 -5.427 -4.796 0.982 689 HG21 THR 86 3HG2 THR 86 -6.773 -7.001 -1.348 690 HG22 THR 86 1HG2 THR 86 -6.541 -7.798 0.208 691 HG23 THR 86 2HG2 THR 86 -5.490 -8.194 -1.152 692 H LEU 87 H LEU 87 -2.891 -5.752 2.025 693 HA LEU 87 HA LEU 87 -1.814 -3.348 0.944 694 HB2 LEU 87 2HB LEU 87 -1.791 -4.626 3.653 695 HB3 LEU 87 3HB LEU 87 -0.838 -3.179 3.329 696 HG LEU 87 HG LEU 87 -3.838 -3.413 3.091 697 HD11 LEU 87 1HD1 LEU 87 -2.147 -1.944 5.108 698 HD12 LEU 87 2HD1 LEU 87 -3.012 -3.451 5.406 699 HD13 LEU 87 3HD1 LEU 87 -3.909 -1.978 5.038 700 HD21 LEU 87 3HD2 LEU 87 -3.448 -0.812 3.034 701 HD22 LEU 87 1HD2 LEU 87 -3.370 -1.777 1.559 702 HD23 LEU 87 2HD2 LEU 87 -1.883 -1.285 2.371 703 H LYS 88 H LYS 88 -0.508 -6.474 1.736 704 HA LYS 88 HA LYS 88 2.236 -5.696 1.767 705 HB2 LYS 88 2HB LYS 88 0.721 -8.099 2.159 706 HB3 LYS 88 3HB LYS 88 2.024 -8.422 1.024 707 HG2 LYS 88 2HG LYS 88 3.158 -8.829 2.930 708 HG3 LYS 88 3HG LYS 88 3.406 -7.082 2.873 709 HD2 LYS 88 2HD LYS 88 1.363 -6.831 4.297 710 HD3 LYS 88 3HD LYS 88 1.337 -8.588 4.469 711 HE2 LYS 88 2HE LYS 88 3.965 -7.622 5.042 712 HE3 LYS 88 3HE LYS 88 2.793 -6.702 5.985 713 HZ1 LYS 88 3HZ LYS 88 3.226 -8.502 7.331 714 HZ2 LYS 88 1HZ LYS 88 3.358 -9.591 6.042 715 HZ3 LYS 88 2HZ LYS 88 1.837 -9.023 6.517 716 H VAL 89 H VAL 89 0.465 -7.699 -0.600 717 HA VAL 89 HA VAL 89 2.373 -7.667 -2.604 718 HB VAL 89 HB VAL 89 -0.613 -7.671 -3.057 719 HG11 VAL 89 1HG1 VAL 89 0.965 -7.397 -5.027 720 HG12 VAL 89 2HG1 VAL 89 1.513 -9.039 -4.685 721 HG13 VAL 89 3HG1 VAL 89 -0.173 -8.741 -5.110 722 HG21 VAL 89 3HG2 VAL 89 0.464 -10.288 -3.104 723 HG22 VAL 89 1HG2 VAL 89 1.004 -9.518 -1.612 724 HG23 VAL 89 2HG2 VAL 89 -0.718 -9.612 -1.983 725 H PHE 90 H PHE 90 -0.254 -5.370 -1.999 726 HA PHE 90 HA PHE 90 0.173 -3.789 -4.300 727 HB2 PHE 90 2HB PHE 90 -1.923 -3.601 -3.166 728 HB3 PHE 90 3HB PHE 90 -1.135 -3.185 -1.648 729 HD1 PHE 90 HD2 PHE 90 -0.580 -1.857 -5.078 730 HD2 PHE 90 HD1 PHE 90 -1.887 -1.069 -1.104 731 HE1 PHE 90 HE2 PHE 90 -0.794 0.532 -5.626 732 HE2 PHE 90 HE1 PHE 90 -2.105 1.321 -1.647 733 HZ PHE 90 HZ PHE 90 -1.556 2.125 -3.909 734 H ALA 91 H ALA 91 1.520 -3.714 -1.055 735 HA ALA 91 HA ALA 91 2.797 -1.203 -1.236 736 HB1 ALA 91 1HB ALA 91 3.184 -3.611 0.499 737 HB2 ALA 91 2HB ALA 91 4.301 -2.248 0.586 738 HB3 ALA 91 3HB ALA 91 2.588 -2.008 0.930 739 H VAL 92 H VAL 92 4.089 -4.499 -1.669 740 HA VAL 92 HA VAL 92 6.653 -3.618 -2.522 741 HB VAL 92 HB VAL 92 5.391 -6.300 -3.089 742 HG11 VAL 92 1HG1 VAL 92 8.193 -6.337 -2.490 743 HG12 VAL 92 2HG1 VAL 92 7.358 -6.867 -3.951 744 HG13 VAL 92 3HG1 VAL 92 7.875 -5.188 -3.789 745 HG21 VAL 92 3HG2 VAL 92 6.737 -5.257 -0.611 746 HG22 VAL 92 1HG2 VAL 92 5.155 -6.022 -0.761 747 HG23 VAL 92 2HG2 VAL 92 6.621 -6.979 -0.972 748 H ALA 93 H ALA 93 3.981 -5.140 -4.336 749 HA ALA 93 HA ALA 93 5.114 -4.770 -6.880 750 HB1 ALA 93 1HB ALA 93 2.157 -4.869 -6.366 751 HB2 ALA 93 2HB ALA 93 3.054 -5.467 -7.762 752 HB3 ALA 93 3HB ALA 93 3.185 -6.294 -6.211 753 H GLY 94 H GLY 94 3.670 -2.545 -4.737 754 HA2 GLY 94 2HA GLY 94 2.990 -0.663 -6.876 755 HA3 GLY 94 3HA GLY 94 2.612 -0.473 -5.170 756 H LEU 95 H LEU 95 4.560 -0.176 -3.723 757 HA LEU 95 HA LEU 95 5.985 2.098 -4.534 758 HB2 LEU 95 2HB LEU 95 6.332 0.175 -2.256 759 HB3 LEU 95 3HB LEU 95 7.417 1.544 -2.485 760 HG LEU 95 HG LEU 95 5.790 2.142 -0.843 761 HD11 LEU 95 1HD1 LEU 95 4.948 4.144 -1.759 762 HD12 LEU 95 2HD1 LEU 95 4.875 3.462 -3.384 763 HD13 LEU 95 3HD1 LEU 95 6.438 3.801 -2.640 764 HD21 LEU 95 3HD2 LEU 95 3.443 1.983 -1.134 765 HD22 LEU 95 1HD2 LEU 95 4.114 0.420 -1.601 766 HD23 LEU 95 2HD2 LEU 95 3.612 1.569 -2.841 767 H LEU 96 H LEU 96 7.030 -1.283 -4.204 768 HA LEU 96 HA LEU 96 9.645 -0.692 -5.279 769 HB2 LEU 96 2HB LEU 96 8.423 -2.818 -3.820 770 HB3 LEU 96 3HB LEU 96 9.159 -3.478 -5.280 771 HG LEU 96 HG LEU 96 10.666 -3.600 -3.356 772 HD11 LEU 96 1HD1 LEU 96 12.595 -2.367 -4.399 773 HD12 LEU 96 2HD1 LEU 96 11.449 -1.732 -5.580 774 HD13 LEU 96 3HD1 LEU 96 11.728 -3.470 -5.469 775 HD21 LEU 96 3HD2 LEU 96 11.647 -1.439 -2.522 776 HD22 LEU 96 1HD2 LEU 96 9.984 -1.756 -2.028 777 HD23 LEU 96 2HD2 LEU 96 10.314 -0.610 -3.328 778 H ASN 97 H ASN 97 6.718 -0.906 -6.674 779 HA ASN 97 HA ASN 97 5.923 -1.377 -8.756 780 HB2 ASN 97 2HB ASN 97 8.801 -1.019 -9.609 781 HB3 ASN 97 3HB ASN 97 7.362 -0.782 -10.596 782 HD21 ASN 97 1HD2 ASN 97 9.705 0.795 -9.010 783 HD22 ASN 97 2HD2 ASN 97 8.891 2.275 -8.645 784 H MET 98 H MET 98 6.890 -3.622 -7.128 785 HA MET 98 HA MET 98 8.106 -5.493 -8.946 786 HB2 MET 98 2HB MET 98 7.918 -5.318 -6.206 787 HB3 MET 98 3HB MET 98 6.788 -6.612 -6.581 788 HG2 MET 98 2HG MET 98 8.728 -7.783 -6.280 789 HG3 MET 98 3HG MET 98 8.748 -7.531 -8.024 790 HE1 MET 98 3HE MET 98 10.570 -5.379 -9.141 791 HE2 MET 98 1HE MET 98 12.030 -6.252 -8.675 792 HE3 MET 98 2HE MET 98 10.574 -7.143 -9.120 793 H THR 99 H THR 99 6.797 -7.834 -8.584 794 HA THR 99 HA THR 99 3.985 -7.656 -9.015 795 HB THR 99 HB THR 99 4.498 -6.856 -11.197 796 HG1 THR 99 HG1 THR 99 3.147 -8.253 -12.019 797 HG21 THR 99 3HG2 THR 99 6.723 -7.247 -11.643 798 HG22 THR 99 1HG2 THR 99 5.968 -8.462 -12.673 799 HG23 THR 99 2HG2 THR 99 6.645 -8.927 -11.112 800 H VAL 100 H VAL 100 4.634 -9.181 -7.206 801 HA VAL 100 HA VAL 100 5.853 -11.649 -7.651 802 HB VAL 100 HB VAL 100 4.554 -12.443 -5.665 803 HG11 VAL 100 1HG1 VAL 100 5.465 -9.922 -4.610 804 HG12 VAL 100 2HG1 VAL 100 6.168 -11.531 -4.437 805 HG13 VAL 100 3HG1 VAL 100 6.582 -10.532 -5.830 806 HG21 VAL 100 3HG2 VAL 100 2.552 -10.985 -6.233 807 HG22 VAL 100 1HG2 VAL 100 3.030 -11.045 -4.536 808 HG23 VAL 100 2HG2 VAL 100 3.456 -9.647 -5.524 809 H SER 101 H SER 101 4.373 -13.735 -7.110 810 HA SER 101 HA SER 101 2.378 -13.817 -9.275 811 HB2 SER 101 2HB SER 101 4.575 -15.571 -8.559 812 HB3 SER 101 3HB SER 101 3.049 -16.453 -8.613 813 HG SER 101 HG SER 101 4.535 -15.459 -10.649 814 H THR 102 H THR 102 2.938 -14.342 -5.909 815 HA THR 102 HA THR 102 0.096 -14.922 -5.542 816 HB THR 102 HB THR 102 0.420 -16.777 -4.099 817 HG1 THR 102 HG1 THR 102 2.302 -17.236 -3.163 818 HG21 THR 102 3HG2 THR 102 2.290 -17.124 -6.445 819 HG22 THR 102 1HG2 THR 102 0.540 -17.328 -6.487 820 HG23 THR 102 2HG2 THR 102 1.532 -18.422 -5.524 821 H ALA 103 H ALA 103 -0.682 -14.466 -3.406 822 HA ALA 103 HA ALA 103 0.225 -12.101 -2.299 823 HB1 ALA 103 1HB ALA 103 -1.920 -12.560 -1.666 824 HB2 ALA 103 2HB ALA 103 -1.584 -14.264 -1.358 825 HB3 ALA 103 3HB ALA 103 -1.067 -13.040 -0.199 826 H ALA 104 H ALA 104 1.027 -15.423 -1.412 827 HA ALA 104 HA ALA 104 2.468 -14.835 0.938 828 HB1 ALA 104 1HB ALA 104 2.608 -17.162 -0.966 829 HB2 ALA 104 2HB ALA 104 3.524 -17.083 0.539 830 HB3 ALA 104 3HB ALA 104 1.761 -17.073 0.579 831 H ALA 105 H ALA 105 3.508 -15.215 -2.434 832 HA ALA 105 HA ALA 105 6.257 -14.992 -2.056 833 HB1 ALA 105 1HB ALA 105 4.431 -14.415 -4.345 834 HB2 ALA 105 2HB ALA 105 6.133 -13.960 -4.451 835 HB3 ALA 105 3HB ALA 105 5.685 -15.645 -4.187 836 H ALA 106 H ALA 106 3.803 -12.475 -2.448 837 HA ALA 106 HA ALA 106 5.553 -10.278 -2.610 838 HB1 ALA 106 1HB ALA 106 3.546 -9.469 -3.167 839 HB2 ALA 106 2HB ALA 106 2.690 -10.698 -2.235 840 HB3 ALA 106 3HB ALA 106 3.303 -9.251 -1.434 841 H GLU 107 H GLU 107 3.726 -11.530 0.189 842 HA GLU 107 HA GLU 107 4.799 -9.786 2.090 843 HB2 GLU 107 2HB GLU 107 2.835 -11.078 2.602 844 HB3 GLU 107 3HB GLU 107 3.711 -12.587 2.385 845 HG2 GLU 107 2HG GLU 107 4.903 -10.842 4.389 846 HG3 GLU 107 3HG GLU 107 3.250 -11.324 4.768 847 H ASN 108 H ASN 108 6.021 -12.789 0.769 848 HA ASN 108 HA ASN 108 8.006 -13.335 2.673 849 HB2 ASN 108 2HB ASN 108 7.414 -14.162 -0.096 850 HB3 ASN 108 3HB ASN 108 9.108 -14.288 0.371 851 HD21 ASN 108 1HD2 ASN 108 9.421 -16.384 0.687 852 HD22 ASN 108 2HD2 ASN 108 8.486 -17.390 1.735 853 H MET 109 H MET 109 8.270 -11.630 -0.448 854 HA MET 109 HA MET 109 10.973 -10.859 -0.048 855 HB2 MET 109 2HB MET 109 9.681 -11.017 -2.255 856 HB3 MET 109 3HB MET 109 9.018 -9.440 -1.847 857 HG2 MET 109 2HG MET 109 11.676 -9.009 -1.499 858 HG3 MET 109 3HG MET 109 11.677 -10.175 -2.820 859 HE1 MET 109 3HE MET 109 11.297 -6.960 -1.478 860 HE2 MET 109 1HE MET 109 11.963 -6.190 -2.918 861 HE3 MET 109 2HE MET 109 10.261 -5.974 -2.510 862 H TYR 110 H TYR 110 7.902 -9.456 0.814 863 HA TYR 110 HA TYR 110 8.700 -6.808 1.261 864 HB2 TYR 110 2HB TYR 110 6.361 -7.361 1.212 865 HB3 TYR 110 3HB TYR 110 6.540 -8.469 2.568 866 HD1 TYR 110 HD2 TYR 110 6.865 -7.598 4.847 867 HD2 TYR 110 HD1 TYR 110 6.170 -4.991 1.558 868 HE1 TYR 110 HE2 TYR 110 6.318 -5.780 6.411 869 HE2 TYR 110 HE1 TYR 110 5.623 -3.166 3.112 870 HH TYR 110 HH TYR 110 4.682 -3.213 5.748 871 H SER 111 H SER 111 8.722 -9.633 3.394 872 HA SER 111 HA SER 111 9.923 -8.082 5.544 873 HB2 SER 111 2HB SER 111 8.181 -9.752 6.076 874 HB3 SER 111 3HB SER 111 9.217 -11.026 5.431 875 HG SER 111 HG SER 111 9.286 -10.693 7.774 876 H GLN 112 H GLN 112 10.817 -10.384 3.093 877 HA GLN 112 HA GLN 112 13.222 -11.344 4.104 878 HB2 GLN 112 2HB GLN 112 12.181 -12.237 2.080 879 HB3 GLN 112 3HB GLN 112 12.499 -10.728 1.234 880 HG2 GLN 112 2HG GLN 112 14.934 -11.129 1.589 881 HG3 GLN 112 3HG GLN 112 14.520 -12.716 2.235 882 HE21 GLN 112 1HE2 GLN 112 15.787 -13.617 0.542 883 HE22 GLN 112 2HE2 GLN 112 15.144 -13.764 -1.054 884 H MET 113 H MET 113 12.601 -8.423 2.181 885 HA MET 113 HA MET 113 15.345 -7.534 2.750 886 HB2 MET 113 2HB MET 113 13.382 -6.820 0.585 887 HB3 MET 113 3HB MET 113 14.766 -5.795 0.939 888 HG2 MET 113 2HG MET 113 15.910 -8.269 0.726 889 HG3 MET 113 3HG MET 113 14.624 -8.337 -0.476 890 HE1 MET 113 3HE MET 113 18.029 -8.141 -1.797 891 HE2 MET 113 1HE MET 113 16.462 -8.949 -1.854 892 HE3 MET 113 2HE MET 113 16.889 -7.765 -3.090 893 H GLY 114 H GLY 114 12.747 -7.383 4.407 894 HA2 GLY 114 2HA GLY 114 11.729 -5.886 5.823 895 HA3 GLY 114 3HA GLY 114 13.289 -5.078 5.829 896 H LEU 115 H LEU 115 11.426 -5.425 2.903 897 HA LEU 115 HA LEU 115 10.426 -3.916 1.528 898 HB2 LEU 115 2HB LEU 115 9.034 -3.644 3.644 899 HB3 LEU 115 3HB LEU 115 9.983 -2.190 3.948 900 HG LEU 115 HG LEU 115 9.159 -1.232 1.838 901 HD11 LEU 115 1HD1 LEU 115 8.372 -3.913 1.341 902 HD12 LEU 115 2HD1 LEU 115 8.261 -2.515 0.273 903 HD13 LEU 115 3HD1 LEU 115 6.925 -2.906 1.355 904 HD21 LEU 115 3HD2 LEU 115 7.379 -2.019 4.069 905 HD22 LEU 115 1HD2 LEU 115 6.616 -1.342 2.631 906 HD23 LEU 115 2HD2 LEU 115 7.843 -0.417 3.496 907 H ASP 116 H ASP 116 13.136 -3.773 1.575 908 HA ASP 116 HA ASP 116 13.644 -0.877 1.378 909 HB2 ASP 116 2HB ASP 116 14.924 -2.600 3.099 910 HB3 ASP 116 3HB ASP 116 16.020 -2.560 1.720 911 H THR 117 H THR 117 15.036 -0.190 -0.313 912 HA THR 117 HA THR 117 14.705 -1.691 -2.729 913 HB THR 117 HB THR 117 16.595 0.448 -3.051 914 HG1 THR 117 HG1 THR 117 14.197 1.134 -1.665 915 HG21 THR 117 3HG2 THR 117 14.346 1.366 -4.184 916 HG22 THR 117 1HG2 THR 117 13.907 -0.334 -4.021 917 HG23 THR 117 2HG2 THR 117 15.351 0.121 -4.926 918 H ARG 118 H ARG 118 16.453 -2.280 -4.181 919 HA ARG 118 HA ARG 118 18.327 -3.973 -3.072 920 HB2 ARG 118 2HB ARG 118 19.530 -3.706 -5.321 921 HB3 ARG 118 3HB ARG 118 17.868 -4.278 -5.353 922 HG2 ARG 118 2HG ARG 118 18.021 -1.391 -5.517 923 HG3 ARG 118 3HG ARG 118 18.922 -2.184 -6.811 924 HD2 ARG 118 2HD ARG 118 16.291 -3.355 -6.270 925 HD3 ARG 118 3HD ARG 118 16.239 -1.687 -6.837 926 HE ARG 118 HE ARG 118 16.892 -3.996 -8.373 927 HH11 ARG 118 1HH1 ARG 118 17.555 -0.598 -8.012 928 HH12 ARG 118 2HH1 ARG 118 18.001 -0.375 -9.672 929 HH21 ARG 118 1HH2 ARG 118 17.477 -3.716 -10.560 930 HH22 ARG 118 2HH2 ARG 118 17.956 -2.149 -11.120 931 HA PRO 119 HA PRO 119 21.685 -1.558 -1.609 932 HB2 PRO 119 2HB PRO 119 23.810 -3.123 -2.248 933 HB3 PRO 119 3HB PRO 119 22.673 -3.527 -0.956 934 HG2 PRO 119 2HG PRO 119 22.790 -4.553 -3.766 935 HG3 PRO 119 3HG PRO 119 22.504 -5.445 -2.260 936 HD2 PRO 119 2HD PRO 119 20.498 -4.721 -3.929 937 HD3 PRO 119 3HD PRO 119 20.284 -4.828 -2.170 938 H SER 120 H SER 120 21.286 0.125 -3.251 939 HA SER 120 HA SER 120 23.476 0.214 -5.218 940 HB2 SER 120 2HB SER 120 20.572 0.699 -5.589 941 HB3 SER 120 3HB SER 120 21.665 1.816 -6.405 942 HG SER 120 HG SER 120 21.040 -0.720 -7.050 943 H MET 121 H MET 121 23.770 2.580 -6.006 944 HA MET 121 HA MET 121 23.131 4.655 -4.143 945 HB2 MET 121 2HB MET 121 24.941 3.479 -2.924 946 HB3 MET 121 3HB MET 121 26.013 3.752 -4.291 947 HG2 MET 121 2HG MET 121 26.539 5.766 -3.549 948 HG3 MET 121 3HG MET 121 24.841 6.230 -3.467 949 HE1 MET 121 3HE MET 121 25.014 7.590 -0.474 950 HE2 MET 121 1HE MET 121 24.019 7.132 -1.857 951 HE3 MET 121 2HE MET 121 23.737 6.387 -0.284 952 H LYS 122 H LYS 122 23.354 6.646 -5.049 953 HA LYS 122 HA LYS 122 23.763 6.817 -7.844 954 HB2 LYS 122 2HB LYS 122 23.330 8.814 -5.652 955 HB3 LYS 122 3HB LYS 122 23.785 9.369 -7.258 956 HG2 LYS 122 2HG LYS 122 21.466 9.482 -7.262 957 HG3 LYS 122 3HG LYS 122 21.811 7.963 -8.091 958 HD2 LYS 122 2HD LYS 122 21.110 6.676 -6.298 959 HD3 LYS 122 3HD LYS 122 21.362 7.980 -5.134 960 HE2 LYS 122 2HE LYS 122 19.420 9.134 -5.895 961 HE3 LYS 122 3HE LYS 122 19.246 8.052 -7.276 962 HZ1 LYS 122 3HZ LYS 122 17.687 7.297 -5.746 963 HZ2 LYS 122 1HZ LYS 122 18.726 7.489 -4.424 964 HZ3 LYS 122 2HZ LYS 122 18.986 6.235 -5.529 965 H GLU 123 H GLU 123 25.536 8.643 -5.349 966 HA GLU 123 HA GLU 123 27.701 9.330 -5.219 967 HB2 GLU 123 2HB GLU 123 27.860 6.695 -5.435 968 HB3 GLU 123 3HB GLU 123 28.604 7.094 -6.977 969 HG2 GLU 123 2HG GLU 123 30.490 7.120 -5.776 970 HG3 GLU 123 3HG GLU 123 29.967 8.748 -5.347 971 H ALA 124 H ALA 124 26.444 10.827 -6.948 972 HA ALA 124 HA ALA 124 26.706 12.250 -8.704 973 HB1 ALA 124 1HB ALA 124 28.850 12.888 -9.289 974 HB2 ALA 124 2HB ALA 124 29.090 12.187 -7.688 975 HB3 ALA 124 3HB ALA 124 29.492 11.253 -9.129 976 H GLY 125 H GLY 125 25.193 10.996 -9.929 977 HA2 GLY 125 2HA GLY 125 26.374 9.964 -12.376 978 HA3 GLY 125 3HA GLY 125 25.453 8.799 -11.436 979 H GLY 126 H GLY 126 23.234 8.884 -11.430 980 HA2 GLY 126 2HA GLY 126 21.122 9.831 -11.864 981 HA3 GLY 126 3HA GLY 126 21.909 11.125 -12.754 982 H LYS 127 H LYS 127 20.002 8.457 -13.063 983 HA LYS 127 HA LYS 127 20.795 8.092 -15.878 984 HB2 LYS 127 2HB LYS 127 19.737 6.067 -13.907 985 HB3 LYS 127 3HB LYS 127 19.756 5.787 -15.643 986 HG2 LYS 127 2HG LYS 127 22.058 5.654 -15.732 987 HG3 LYS 127 3HG LYS 127 22.271 6.563 -14.235 988 HD2 LYS 127 2HD LYS 127 20.799 4.027 -13.972 989 HD3 LYS 127 3HD LYS 127 22.497 3.872 -14.430 990 HE2 LYS 127 2HE LYS 127 22.243 5.815 -12.345 991 HE3 LYS 127 3HE LYS 127 21.417 4.333 -11.866 992 HZ1 LYS 127 3HZ LYS 127 23.850 4.489 -11.295 993 HZ2 LYS 127 1HZ LYS 127 24.173 4.334 -12.948 994 HZ3 LYS 127 2HZ LYS 127 23.378 3.091 -12.121 995 H GLU 128 H GLU 128 18.011 7.547 -13.708 996 HA GLU 128 HA GLU 128 16.313 9.030 -15.554 997 HB2 GLU 128 2HB GLU 128 16.067 6.110 -14.969 998 HB3 GLU 128 3HB GLU 128 14.600 7.054 -15.191 999 HG2 GLU 128 2HG GLU 128 15.331 7.730 -17.397 1000 HG3 GLU 128 3HG GLU 128 16.853 6.869 -17.177 1001 H GLU 129 H GLU 129 14.455 9.887 -14.611 1002 HA GLU 129 HA GLU 129 14.558 10.038 -11.708 1003 HB2 GLU 129 2HB GLU 129 12.867 11.840 -11.993 1004 HB3 GLU 129 3HB GLU 129 14.359 12.135 -12.875 1005 HG2 GLU 129 2HG GLU 129 12.629 10.750 -14.618 1006 HG3 GLU 129 3HG GLU 129 11.688 12.028 -13.851 1007 H GLY 130 H GLY 130 12.523 8.768 -14.251 1008 HA2 GLY 130 2HA GLY 130 10.438 8.051 -12.323 1009 HA3 GLY 130 3HA GLY 130 10.318 7.923 -14.071 1010 HA PRO 131 HA PRO 131 11.313 3.768 -12.033 1011 HB2 PRO 131 2HB PRO 131 8.945 2.550 -12.559 1012 HB3 PRO 131 3HB PRO 131 9.249 3.455 -11.072 1013 HG2 PRO 131 2HG PRO 131 7.817 4.317 -13.555 1014 HG3 PRO 131 3HG PRO 131 7.376 4.586 -11.859 1015 HD2 PRO 131 2HD PRO 131 8.560 6.491 -13.375 1016 HD3 PRO 131 3HD PRO 131 8.838 6.353 -11.627 1017 HA PRO 132 HA PRO 132 12.227 1.840 -15.877 1018 HB2 PRO 132 2HB PRO 132 11.922 -0.798 -15.315 1019 HB3 PRO 132 3HB PRO 132 13.266 0.167 -14.694 1020 HG2 PRO 132 2HG PRO 132 10.721 -0.631 -13.335 1021 HG3 PRO 132 3HG PRO 132 12.375 -0.620 -12.696 1022 HD2 PRO 132 2HD PRO 132 10.589 1.343 -12.154 1023 HD3 PRO 132 3HD PRO 132 12.333 1.648 -12.283 1024 H GLN 133 H GLN 133 11.359 -0.141 -17.306 1025 HA GLN 133 HA GLN 133 9.737 -0.827 -18.745 1026 HB2 GLN 133 2HB GLN 133 8.072 -0.547 -16.241 1027 HB3 GLN 133 3HB GLN 133 7.472 -1.256 -17.734 1028 HG2 GLN 133 2HG GLN 133 9.947 -2.494 -17.025 1029 HG3 GLN 133 3HG GLN 133 8.854 -2.522 -15.642 1030 HE21 GLN 133 1HE2 GLN 133 9.871 -4.444 -17.892 1031 HE22 GLN 133 2HE2 GLN 133 8.435 -5.307 -18.314 1032 H ALA 134 H ALA 134 10.314 1.590 -19.396 1033 HA ALA 134 HA ALA 134 9.578 3.462 -20.462 1034 HB1 ALA 134 1HB ALA 134 7.941 2.851 -21.827 1035 HB2 ALA 134 2HB ALA 134 7.463 1.558 -20.727 1036 HB3 ALA 134 3HB ALA 134 6.778 3.172 -20.540 1037 H TYR 135 H TYR 135 7.630 5.208 -20.234 1038 HA TYR 135 HA TYR 135 6.598 5.614 -17.625 1039 HB2 TYR 135 2HB TYR 135 7.989 7.558 -16.990 1040 HB3 TYR 135 3HB TYR 135 8.919 6.066 -17.054 1041 HD1 TYR 135 HD1 TYR 135 8.291 9.289 -18.709 1042 HD2 TYR 135 HD2 TYR 135 10.673 5.764 -18.672 1043 HE1 TYR 135 HE1 TYR 135 9.892 10.362 -20.237 1044 HE2 TYR 135 HE2 TYR 135 12.281 6.828 -20.199 1045 HH TYR 135 HH TYR 135 11.831 10.174 -21.302
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