NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
570292 | 2mcd | 19436 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 32.770 -22.299 -92.354 2 H2 MET 1 H2 MET 1 33.831 -22.450 -93.586 3 H3 MET 1 H3 MET 1 32.326 -23.057 -93.738 4 HA MET 1 HA MET 1 32.503 -21.007 -95.007 5 HB2 MET 1 HB2 MET 1 30.745 -20.758 -92.519 6 HB3 MET 1 HB3 MET 1 30.682 -19.657 -93.894 7 HG2 MET 1 HG2 MET 1 30.026 -21.482 -95.396 8 HG3 MET 1 HG3 MET 1 30.164 -22.647 -94.079 9 HE1 MET 1 HE1 MET 1 28.067 -19.773 -95.689 10 HE2 MET 1 HE2 MET 1 26.783 -19.497 -94.493 11 HE3 MET 1 HE3 MET 1 28.442 -18.981 -94.138 12 H ARG 2 H ARG 2 33.153 -18.842 -95.182 13 HA ARG 2 HA ARG 2 34.145 -17.361 -92.872 14 HB2 ARG 2 HB2 ARG 2 36.403 -17.190 -93.366 15 HB3 ARG 2 HB3 ARG 2 36.083 -18.898 -93.529 16 HG2 ARG 2 HG2 ARG 2 36.431 -16.901 -95.818 17 HG3 ARG 2 HG3 ARG 2 37.631 -18.035 -95.226 18 HD2 ARG 2 HD2 ARG 2 36.163 -19.944 -95.917 19 HD3 ARG 2 HD3 ARG 2 34.999 -18.781 -96.552 20 HE ARG 2 HE ARG 2 36.337 -18.339 -98.376 21 HH11 ARG 2 HH11 ARG 2 38.268 -20.303 -96.190 22 HH12 ARG 2 HH12 ARG 2 39.508 -20.557 -97.386 23 HH21 ARG 2 HH21 ARG 2 37.954 -18.706 -99.834 24 HH22 ARG 2 HH22 ARG 2 39.329 -19.674 -99.394 25 H GLY 3 H GLY 3 35.041 -15.225 -93.479 26 HA2 GLY 3 HA2 GLY 3 35.466 -13.593 -95.237 27 HA3 GLY 3 HA3 GLY 3 34.009 -14.105 -96.068 28 H SER 4 H SER 4 35.327 -11.805 -94.062 29 HA SER 4 HA SER 4 32.831 -10.323 -93.888 30 HB2 SER 4 HB2 SER 4 32.968 -9.871 -91.468 31 HB3 SER 4 HB3 SER 4 32.635 -11.574 -91.804 32 HG SER 4 HG SER 4 34.244 -11.325 -90.178 33 H HIS 5 H HIS 5 33.169 -8.066 -93.442 34 HA HIS 5 HA HIS 5 35.885 -7.039 -93.000 35 HB2 HIS 5 HB2 HIS 5 35.881 -7.402 -95.444 36 HB3 HIS 5 HB3 HIS 5 34.394 -6.468 -95.597 37 HD2 HIS 5 HD2 HIS 5 38.159 -6.036 -94.787 38 HE1 HIS 5 HE1 HIS 5 36.628 -2.136 -95.606 39 HE2 HIS 5 HE2 HIS 5 38.737 -3.486 -95.138 40 H HIS 6 H HIS 6 35.859 -5.147 -91.934 41 HA HIS 6 HA HIS 6 33.940 -3.090 -92.514 42 HB2 HIS 6 HB2 HIS 6 33.058 -2.703 -90.292 43 HB3 HIS 6 HB3 HIS 6 32.592 -4.303 -90.834 44 HD2 HIS 6 HD2 HIS 6 34.005 -6.433 -89.689 45 HE1 HIS 6 HE1 HIS 6 35.164 -4.247 -86.213 46 HE2 HIS 6 HE2 HIS 6 34.976 -6.570 -87.240 47 H HIS 7 H HIS 7 34.745 -1.077 -92.100 48 HA HIS 7 HA HIS 7 36.552 -0.515 -89.939 49 HB2 HIS 7 HB2 HIS 7 38.270 -1.283 -91.562 50 HB3 HIS 7 HB3 HIS 7 37.663 -0.134 -92.757 51 HD2 HIS 7 HD2 HIS 7 38.601 2.314 -92.635 52 HE1 HIS 7 HE1 HIS 7 40.351 2.230 -88.745 53 HE2 HIS 7 HE2 HIS 7 39.970 3.654 -90.817 54 H HIS 8 H HIS 8 36.433 1.633 -89.345 55 HA HIS 8 HA HIS 8 35.885 3.731 -91.257 56 HB2 HIS 8 HB2 HIS 8 33.547 3.060 -90.823 57 HB3 HIS 8 HB3 HIS 8 33.812 3.214 -89.083 58 HD2 HIS 8 HD2 HIS 8 33.432 5.569 -88.038 59 HE1 HIS 8 HE1 HIS 8 33.441 7.957 -91.574 60 HE2 HIS 8 HE2 HIS 8 33.164 7.989 -89.036 61 H HIS 9 H HIS 9 36.677 5.678 -90.587 62 HA HIS 9 HA HIS 9 36.724 6.432 -87.805 63 HB2 HIS 9 HB2 HIS 9 39.032 6.955 -87.539 64 HB3 HIS 9 HB3 HIS 9 38.941 5.266 -88.003 65 HD2 HIS 9 HD2 HIS 9 40.408 8.596 -89.042 66 HE1 HIS 9 HE1 HIS 9 41.537 5.870 -92.121 67 HE2 HIS 9 HE2 HIS 9 41.901 8.206 -91.177 68 H HIS 10 H HIS 10 36.817 8.710 -87.513 69 HA HIS 10 HA HIS 10 37.350 10.497 -89.761 70 HB2 HIS 10 HB2 HIS 10 35.188 11.468 -89.968 71 HB3 HIS 10 HB3 HIS 10 34.962 9.743 -90.141 72 HD2 HIS 10 HD2 HIS 10 33.883 12.716 -88.074 73 HE1 HIS 10 HE1 HIS 10 32.094 9.343 -86.170 74 HE2 HIS 10 HE2 HIS 10 32.150 11.888 -86.268 75 H GLY 11 H GLY 11 37.199 12.766 -89.214 76 HA2 GLY 11 HA2 GLY 11 37.003 14.639 -87.925 77 HA3 GLY 11 HA3 GLY 11 36.482 13.666 -86.564 78 H SER 28 H SER 28 38.110 15.971 -86.520 79 HA SER 28 HA SER 28 40.135 15.067 -84.652 80 HB2 SER 28 HB2 SER 28 41.388 15.002 -86.831 81 HB3 SER 28 HB3 SER 28 41.039 16.729 -87.043 82 HG SER 28 HG SER 28 43.110 16.312 -86.053 83 H VAL 29 H VAL 29 40.705 16.751 -83.190 84 HA VAL 29 HA VAL 29 39.431 19.413 -83.496 85 HB VAL 29 HB VAL 29 38.483 19.315 -81.212 86 HG11 VAL 29 HG11 VAL 29 37.272 17.220 -83.052 87 HG12 VAL 29 HG12 VAL 29 36.452 18.138 -81.776 88 HG13 VAL 29 HG13 VAL 29 37.059 18.978 -83.212 89 HG21 VAL 29 HG21 VAL 29 39.759 17.412 -80.267 90 HG22 VAL 29 HG22 VAL 29 38.013 17.180 -80.121 91 HG23 VAL 29 HG23 VAL 29 38.915 16.300 -81.369 92 H SER 30 H SER 30 40.175 21.037 -82.144 93 HA SER 30 HA SER 30 42.599 20.580 -80.482 94 HB2 SER 30 HB2 SER 30 42.404 22.618 -82.741 95 HB3 SER 30 HB3 SER 30 43.713 22.522 -81.551 96 HG SER 30 HG SER 30 44.243 21.458 -83.529 97 H PHE 31 H PHE 31 43.044 22.301 -78.991 98 HA PHE 31 HA PHE 31 40.951 24.391 -78.631 99 HB2 PHE 31 HB2 PHE 31 40.343 22.382 -77.293 100 HB3 PHE 31 HB3 PHE 31 41.865 22.506 -76.428 101 HD1 PHE 31 HD1 PHE 31 38.716 24.389 -77.246 102 HD2 PHE 31 HD2 PHE 31 41.999 23.920 -74.487 103 HE1 PHE 31 HE1 PHE 31 37.620 25.966 -75.669 104 HE2 PHE 31 HE2 PHE 31 40.901 25.498 -72.915 105 HZ PHE 31 HZ PHE 31 38.709 26.519 -73.502 106 H GLY 32 H GLY 32 42.646 25.668 -79.592 107 HA2 GLY 32 HA2 GLY 32 45.168 26.152 -78.217 108 HA3 GLY 32 HA3 GLY 32 44.538 26.997 -79.628 109 H ALA 33 H ALA 33 43.193 26.661 -76.311 110 HA ALA 33 HA ALA 33 43.190 29.640 -76.000 111 HB1 ALA 33 HB1 ALA 33 40.850 27.745 -75.594 112 HB2 ALA 33 HB2 ALA 33 40.856 29.489 -75.249 113 HB3 ALA 33 HB3 ALA 33 41.046 28.915 -76.916 114 HA PRO 34 HA PRO 34 44.716 27.735 -72.005 115 HB2 PRO 34 HB2 PRO 34 47.143 28.941 -71.836 116 HB3 PRO 34 HB3 PRO 34 46.882 27.475 -72.829 117 HG2 PRO 34 HG2 PRO 34 46.865 30.369 -73.762 118 HG3 PRO 34 HG3 PRO 34 47.794 28.996 -74.448 119 HD2 PRO 34 HD2 PRO 34 45.396 29.779 -75.485 120 HD3 PRO 34 HD3 PRO 34 45.866 28.053 -75.420 121 H SER 35 H SER 35 45.188 28.930 -70.002 122 HA SER 35 HA SER 35 44.276 31.788 -69.972 123 HB2 SER 35 HB2 SER 35 43.382 29.567 -68.110 124 HB3 SER 35 HB3 SER 35 42.988 31.290 -67.942 125 HG SER 35 HG SER 35 41.320 30.104 -69.011 126 HA PRO 36 HA PRO 36 48.236 31.310 -67.512 127 HB2 PRO 36 HB2 PRO 36 49.788 33.150 -68.783 128 HB3 PRO 36 HB3 PRO 36 49.569 31.484 -69.405 129 HG2 PRO 36 HG2 PRO 36 48.066 33.992 -70.244 130 HG3 PRO 36 HG3 PRO 36 48.885 32.792 -71.297 131 HD2 PRO 36 HD2 PRO 36 46.212 32.673 -70.794 132 HD3 PRO 36 HD3 PRO 36 47.199 31.189 -70.944 133 H LEU 37 H LEU 37 49.164 32.836 -66.026 134 HA LEU 37 HA LEU 37 47.998 35.535 -65.805 135 HB2 LEU 37 HB2 LEU 37 46.452 34.061 -64.550 136 HB3 LEU 37 HB3 LEU 37 47.800 33.431 -63.611 137 HG LEU 37 HG LEU 37 48.165 35.702 -62.630 138 HD11 LEU 37 HD11 LEU 37 45.598 36.421 -64.114 139 HD12 LEU 37 HD12 LEU 37 46.384 37.412 -62.867 140 HD13 LEU 37 HD13 LEU 37 47.197 37.132 -64.411 141 HD21 LEU 37 HD21 LEU 37 46.759 34.032 -61.484 142 HD22 LEU 37 HD22 LEU 37 46.180 35.679 -61.187 143 HD23 LEU 37 HD23 LEU 37 45.327 34.636 -62.349 144 H SER 38 H SER 38 49.538 36.954 -65.317 145 HA SER 38 HA SER 38 51.912 36.206 -63.673 146 HB2 SER 38 HB2 SER 38 53.363 37.291 -65.358 147 HB3 SER 38 HB3 SER 38 52.514 35.880 -65.999 148 HG SER 38 HG SER 38 52.429 37.685 -67.444 149 H SER 39 H SER 39 49.449 37.982 -63.241 150 HA SER 39 HA SER 39 50.510 40.710 -63.379 151 HB2 SER 39 HB2 SER 39 48.181 39.848 -64.099 152 HB3 SER 39 HB3 SER 39 47.768 39.941 -62.378 153 HG SER 39 HG SER 39 47.269 41.883 -63.549 154 H GLU 40 H GLU 40 50.981 38.486 -61.026 155 HA GLU 40 HA GLU 40 51.030 40.503 -58.832 156 HB2 GLU 40 HB2 GLU 40 48.953 39.314 -58.606 157 HB3 GLU 40 HB3 GLU 40 49.748 37.750 -58.712 158 HG2 GLU 40 HG2 GLU 40 50.586 39.660 -56.520 159 HG3 GLU 40 HG3 GLU 40 49.017 38.880 -56.395 160 H SER 41 H SER 41 52.878 40.620 -57.887 161 HA SER 41 HA SER 41 54.693 38.281 -57.549 162 HB2 SER 41 HB2 SER 41 55.487 41.046 -58.551 163 HB3 SER 41 HB3 SER 41 56.613 39.761 -58.070 164 HG SER 41 HG SER 41 56.263 39.818 -60.353 165 H GLU 42 H GLU 42 53.265 38.605 -55.524 166 HA GLU 42 HA GLU 42 53.036 39.064 -53.364 167 HB2 GLU 42 HB2 GLU 42 55.984 39.761 -53.356 168 HB3 GLU 42 HB3 GLU 42 54.988 39.419 -51.943 169 HG2 GLU 42 HG2 GLU 42 54.517 37.143 -52.801 170 HG3 GLU 42 HG3 GLU 42 55.568 37.448 -54.188 171 H ASP 43 H ASP 43 52.618 41.325 -55.286 172 HA ASP 43 HA ASP 43 53.380 43.769 -54.182 173 HB2 ASP 43 HB2 ASP 43 50.895 43.155 -55.828 174 HB3 ASP 43 HB3 ASP 43 51.614 44.748 -55.619 175 H GLU 44 H GLU 44 50.712 41.832 -53.236 176 HA GLU 44 HA GLU 44 49.863 43.858 -51.194 177 HB2 GLU 44 HB2 GLU 44 48.355 43.438 -53.267 178 HB3 GLU 44 HB3 GLU 44 47.940 41.909 -52.491 179 HG2 GLU 44 HG2 GLU 44 47.050 43.160 -50.534 180 HG3 GLU 44 HG3 GLU 44 47.628 44.675 -51.228 181 H ILE 45 H ILE 45 51.515 41.093 -51.326 182 HA ILE 45 HA ILE 45 50.140 39.484 -49.295 183 HB ILE 45 HB ILE 45 52.919 39.307 -50.501 184 HG12 ILE 45 HG12 ILE 45 51.165 38.888 -52.163 185 HG13 ILE 45 HG13 ILE 45 52.063 37.427 -51.797 186 HG21 ILE 45 HG21 ILE 45 51.514 37.366 -48.629 187 HG22 ILE 45 HG22 ILE 45 52.946 36.965 -49.605 188 HG23 ILE 45 HG23 ILE 45 53.050 38.215 -48.367 189 HD11 ILE 45 HD11 ILE 45 49.261 38.101 -50.790 190 HD12 ILE 45 HD12 ILE 45 49.688 36.950 -52.063 191 HD13 ILE 45 HD13 ILE 45 50.166 36.618 -50.391 192 H ASN 46 H ASN 46 52.628 41.960 -49.299 193 HA ASN 46 HA ASN 46 53.685 43.147 -47.690 194 HB2 ASN 46 HB2 ASN 46 51.182 42.487 -46.090 195 HB3 ASN 46 HB3 ASN 46 52.281 43.821 -45.769 196 HD21 ASN 46 HD22 ASN 46 49.607 44.335 -46.097 197 HD22 ASN 46 HD21 ASN 46 49.396 45.207 -47.608 198 H TYR 47 H TYR 47 53.961 43.095 -44.971 199 HA TYR 47 HA TYR 47 55.333 42.307 -43.376 200 HB2 TYR 47 HB2 TYR 47 53.166 40.999 -43.194 201 HB3 TYR 47 HB3 TYR 47 54.021 39.629 -43.875 202 HD1 TYR 47 HD1 TYR 47 54.133 42.125 -41.062 203 HD2 TYR 47 HD2 TYR 47 55.181 38.157 -42.398 204 HE1 TYR 47 HE1 TYR 47 54.837 41.534 -38.750 205 HE2 TYR 47 HE2 TYR 47 55.884 37.566 -40.080 206 HH TYR 47 HH TYR 47 55.670 39.894 -37.358 207 H MET 48 H MET 48 56.606 42.357 -45.936 208 HA MET 48 HA MET 48 58.286 39.992 -46.207 209 HB2 MET 48 HB2 MET 48 57.531 41.456 -48.091 210 HB3 MET 48 HB3 MET 48 58.578 42.742 -47.471 211 HG2 MET 48 HG2 MET 48 60.549 41.210 -47.769 212 HG3 MET 48 HG3 MET 48 59.457 39.977 -48.397 213 HE1 MET 48 HE1 MET 48 61.362 43.313 -49.020 214 HE2 MET 48 HE2 MET 48 60.695 43.893 -50.560 215 HE3 MET 48 HE3 MET 48 59.701 43.949 -49.092 216 H THR 49 H THR 49 58.778 43.276 -44.902 217 HA THR 49 HA THR 49 61.284 42.430 -43.519 218 HB THR 49 HB THR 49 62.250 44.686 -44.167 219 HG1 THR 49 HG1 THR 49 61.396 45.664 -45.993 220 HG21 THR 49 HG21 THR 49 61.762 42.789 -46.493 221 HG22 THR 49 HG22 THR 49 63.097 43.943 -46.303 222 HG23 THR 49 HG23 THR 49 62.976 42.549 -45.218 223 HA PRO 50 HA PRO 50 58.249 44.845 -40.854 224 HB2 PRO 50 HB2 PRO 50 57.912 43.052 -38.803 225 HB3 PRO 50 HB3 PRO 50 56.945 43.030 -40.309 226 HG2 PRO 50 HG2 PRO 50 59.428 41.395 -39.671 227 HG3 PRO 50 HG3 PRO 50 57.857 40.810 -40.309 228 HD2 PRO 50 HD2 PRO 50 59.935 41.311 -41.966 229 HD3 PRO 50 HD3 PRO 50 58.265 41.742 -42.438 230 HA PRO 51 HA PRO 51 61.739 46.148 -38.393 231 HB2 PRO 51 HB2 PRO 51 60.620 48.011 -36.756 232 HB3 PRO 51 HB3 PRO 51 60.761 48.228 -38.525 233 HG2 PRO 51 HG2 PRO 51 58.335 47.290 -36.960 234 HG3 PRO 51 HG3 PRO 51 58.415 48.536 -38.243 235 HD2 PRO 51 HD2 PRO 51 57.675 45.939 -38.740 236 HD3 PRO 51 HD3 PRO 51 58.572 46.925 -39.935 237 H GLU 52 H GLU 52 62.537 44.492 -37.208 238 HA GLU 52 HA GLU 52 61.599 44.124 -34.406 239 HB2 GLU 52 HB2 GLU 52 62.174 41.846 -36.351 240 HB3 GLU 52 HB3 GLU 52 61.890 41.681 -34.617 241 HG2 GLU 52 HG2 GLU 52 59.606 42.688 -34.945 242 HG3 GLU 52 HG3 GLU 52 59.873 42.628 -36.692 243 H GLN 53 H GLN 53 63.200 43.510 -32.935 244 HA GLN 53 HA GLN 53 65.998 43.224 -33.924 245 HB2 GLN 53 HB2 GLN 53 66.822 44.811 -32.304 246 HB3 GLN 53 HB3 GLN 53 65.647 45.570 -33.370 247 HG2 GLN 53 HG2 GLN 53 63.912 45.421 -31.601 248 HG3 GLN 53 HG3 GLN 53 65.057 44.602 -30.532 249 HE21 GLN 53 HE22 GLN 53 64.472 47.721 -32.267 250 HE22 GLN 53 HE21 GLN 53 65.436 48.666 -31.142 251 H GLU 54 H GLU 54 63.788 41.482 -32.475 252 HA GLU 54 HA GLU 54 65.693 39.906 -30.932 253 HB2 GLU 54 HB2 GLU 54 63.688 41.604 -29.605 254 HB3 GLU 54 HB3 GLU 54 63.378 39.916 -29.269 255 HG2 GLU 54 HG2 GLU 54 66.022 41.357 -28.814 256 HG3 GLU 54 HG3 GLU 54 64.824 40.986 -27.579 257 H ALA 55 H ALA 55 64.807 37.814 -30.379 258 HA ALA 55 HA ALA 55 62.489 36.877 -31.952 259 HB1 ALA 55 HB1 ALA 55 65.291 35.702 -32.259 260 HB2 ALA 55 HB2 ALA 55 63.815 35.104 -33.049 261 HB3 ALA 55 HB3 ALA 55 64.455 36.702 -33.469 262 H GLN 56 H GLN 56 63.823 36.965 -29.026 263 HA GLN 56 HA GLN 56 62.206 34.699 -28.116 264 HB2 GLN 56 HB2 GLN 56 64.591 33.843 -28.530 265 HB3 GLN 56 HB3 GLN 56 65.093 34.804 -27.151 266 HG2 GLN 56 HG2 GLN 56 62.940 32.622 -27.130 267 HG3 GLN 56 HG3 GLN 56 64.618 32.378 -26.676 268 HE21 GLN 56 HE22 GLN 56 61.494 33.575 -25.529 269 HE22 GLN 56 HE21 GLN 56 62.083 34.079 -23.952 270 HA PRO 57 HA PRO 57 62.124 38.611 -25.652 271 HB2 PRO 57 HB2 PRO 57 59.599 39.439 -26.024 272 HB3 PRO 57 HB3 PRO 57 60.847 39.559 -27.323 273 HG2 PRO 57 HG2 PRO 57 58.755 37.376 -26.994 274 HG3 PRO 57 HG3 PRO 57 59.099 38.366 -28.448 275 HD2 PRO 57 HD2 PRO 57 60.231 35.894 -28.036 276 HD3 PRO 57 HD3 PRO 57 61.082 37.217 -28.890 277 H GLY 58 H GLY 58 61.686 38.728 -23.513 278 HA2 GLY 58 HA2 GLY 58 60.902 38.161 -21.392 279 HA3 GLY 58 HA3 GLY 58 59.733 37.051 -22.093 280 H ALA 59 H ALA 59 62.470 37.206 -20.222 281 HA ALA 59 HA ALA 59 63.054 34.345 -20.424 282 HB1 ALA 59 HB1 ALA 59 65.197 36.452 -20.987 283 HB2 ALA 59 HB2 ALA 59 65.444 34.692 -20.890 284 HB3 ALA 59 HB3 ALA 59 64.477 35.376 -22.203 285 H LEU 60 H LEU 60 64.523 33.627 -18.762 286 HA LEU 60 HA LEU 60 65.006 35.416 -16.449 287 HB2 LEU 60 HB2 LEU 60 64.295 33.689 -14.920 288 HB3 LEU 60 HB3 LEU 60 62.997 34.189 -15.977 289 HG LEU 60 HG LEU 60 63.441 32.047 -17.342 290 HD11 LEU 60 HD11 LEU 60 65.033 31.346 -14.827 291 HD12 LEU 60 HD12 LEU 60 64.417 30.159 -15.994 292 HD13 LEU 60 HD13 LEU 60 65.626 31.320 -16.507 293 HD21 LEU 60 HD21 LEU 60 61.537 32.349 -15.808 294 HD22 LEU 60 HD22 LEU 60 62.135 30.685 -15.767 295 HD23 LEU 60 HD23 LEU 60 62.538 31.804 -14.443 296 H ALA 61 H ALA 61 66.630 34.418 -14.898 297 HA ALA 61 HA ALA 61 68.561 32.640 -16.245 298 HB1 ALA 61 HB1 ALA 61 69.279 35.207 -14.783 299 HB2 ALA 61 HB2 ALA 61 70.434 34.004 -15.398 300 HB3 ALA 61 HB3 ALA 61 69.413 34.909 -16.531 301 H ALA 62 H ALA 62 69.077 30.926 -15.069 302 HA ALA 62 HA ALA 62 68.520 30.816 -12.164 303 HB1 ALA 62 HB1 ALA 62 69.559 28.700 -14.087 304 HB2 ALA 62 HB2 ALA 62 69.124 28.447 -12.385 305 HB3 ALA 62 HB3 ALA 62 67.874 28.902 -13.560 306 H LEU 63 H LEU 63 70.110 30.523 -10.593 307 HA LEU 63 HA LEU 63 72.864 31.394 -11.368 308 HB2 LEU 63 HB2 LEU 63 71.259 32.362 -8.980 309 HB3 LEU 63 HB3 LEU 63 72.860 32.909 -9.465 310 HG LEU 63 HG LEU 63 70.268 33.394 -11.002 311 HD11 LEU 63 HD11 LEU 63 72.048 35.285 -9.414 312 HD12 LEU 63 HD12 LEU 63 70.580 35.725 -10.315 313 HD13 LEU 63 HD13 LEU 63 70.462 34.672 -8.896 314 HD21 LEU 63 HD21 LEU 63 72.222 33.293 -12.540 315 HD22 LEU 63 HD22 LEU 63 71.575 34.922 -12.389 316 HD23 LEU 63 HD23 LEU 63 73.069 34.477 -11.527 317 H HIS 64 H HIS 64 74.541 30.992 -9.865 318 HA HIS 64 HA HIS 64 74.295 28.549 -8.208 319 HB2 HIS 64 HB2 HIS 64 76.541 30.458 -8.873 320 HB3 HIS 64 HB3 HIS 64 76.733 29.143 -7.723 321 HD2 HIS 64 HD2 HIS 64 76.964 29.927 -11.387 322 HE1 HIS 64 HE1 HIS 64 77.197 25.674 -11.107 323 HE2 HIS 64 HE2 HIS 64 77.579 27.689 -12.617 324 H ALA 65 H ALA 65 74.168 28.536 -5.975 325 HA ALA 65 HA ALA 65 73.422 31.099 -4.717 326 HB1 ALA 65 HB1 ALA 65 73.153 28.222 -3.763 327 HB2 ALA 65 HB2 ALA 65 72.406 29.655 -3.026 328 HB3 ALA 65 HB3 ALA 65 71.920 29.148 -4.654 329 H GLU 66 H GLU 66 76.255 29.130 -4.712 330 HA GLU 66 HA GLU 66 77.386 30.528 -2.364 331 HB2 GLU 66 HB2 GLU 66 77.969 28.471 -1.216 332 HB3 GLU 66 HB3 GLU 66 76.226 28.593 -1.404 333 HG2 GLU 66 HG2 GLU 66 76.318 27.001 -3.322 334 HG3 GLU 66 HG3 GLU 66 78.069 26.876 -3.127 335 H GLY 67 H GLY 67 79.705 29.854 -1.963 336 HA2 GLY 67 HA2 GLY 67 81.883 29.498 -2.664 337 HA3 GLY 67 HA3 GLY 67 81.253 28.666 -4.080 338 HA PRO 68 HA PRO 68 83.337 32.647 -5.344 339 HB2 PRO 68 HB2 PRO 68 84.765 31.689 -7.486 340 HB3 PRO 68 HB3 PRO 68 85.306 31.542 -5.787 341 HG2 PRO 68 HG2 PRO 68 83.830 29.472 -7.449 342 HG3 PRO 68 HG3 PRO 68 85.325 29.252 -6.482 343 HD2 PRO 68 HD2 PRO 68 82.904 28.585 -5.487 344 HD3 PRO 68 HD3 PRO 68 84.125 29.367 -4.438 345 H LEU 69 H LEU 69 81.211 30.446 -7.012 346 HA LEU 69 HA LEU 69 80.590 32.413 -9.140 347 HB2 LEU 69 HB2 LEU 69 79.611 29.576 -8.706 348 HB3 LEU 69 HB3 LEU 69 79.166 30.602 -10.062 349 HG LEU 69 HG LEU 69 81.984 29.613 -9.486 350 HD11 LEU 69 HD11 LEU 69 79.998 28.826 -11.651 351 HD12 LEU 69 HD12 LEU 69 81.634 28.168 -11.410 352 HD13 LEU 69 HD13 LEU 69 80.373 27.860 -10.208 353 HD21 LEU 69 HD21 LEU 69 82.108 31.739 -10.683 354 HD22 LEU 69 HD22 LEU 69 82.467 30.421 -11.799 355 HD23 LEU 69 HD23 LEU 69 80.870 31.194 -11.848 356 H ALA 70 H ALA 70 79.610 32.336 -5.989 357 HA ALA 70 HA ALA 70 76.835 32.155 -6.088 358 HB1 ALA 70 HB1 ALA 70 78.540 33.999 -4.353 359 HB2 ALA 70 HB2 ALA 70 76.862 33.516 -4.024 360 HB3 ALA 70 HB3 ALA 70 78.152 32.301 -4.007 361 H GLY 71 H GLY 71 75.298 33.205 -7.009 362 HA2 GLY 71 HA2 GLY 71 73.981 34.943 -7.844 363 HA3 GLY 71 HA3 GLY 71 75.283 36.099 -7.564 364 H LEU 72 H LEU 72 76.576 33.485 -9.290 365 HA LEU 72 HA LEU 72 76.370 34.929 -11.885 366 HB2 LEU 72 HB2 LEU 72 78.411 32.845 -11.041 367 HB3 LEU 72 HB3 LEU 72 78.483 33.874 -12.432 368 HG LEU 72 HG LEU 72 78.903 34.689 -9.554 369 HD11 LEU 72 HD11 LEU 72 80.618 35.039 -12.050 370 HD12 LEU 72 HD12 LEU 72 81.082 35.366 -10.367 371 HD13 LEU 72 HD13 LEU 72 80.787 33.705 -10.900 372 HD21 LEU 72 HD21 LEU 72 77.593 36.529 -10.544 373 HD22 LEU 72 HD22 LEU 72 79.276 36.999 -10.332 374 HD23 LEU 72 HD23 LEU 72 78.679 36.568 -11.945 375 HA PRO 73 HA PRO 73 73.809 32.117 -13.738 376 HB2 PRO 73 HB2 PRO 73 74.669 31.767 -16.322 377 HB3 PRO 73 HB3 PRO 73 74.121 33.345 -15.679 378 HG2 PRO 73 HG2 PRO 73 76.925 32.264 -16.042 379 HG3 PRO 73 HG3 PRO 73 76.314 33.900 -16.425 380 HD2 PRO 73 HD2 PRO 73 77.677 33.232 -14.162 381 HD3 PRO 73 HD3 PRO 73 76.502 34.587 -14.205 382 H VAL 74 H VAL 74 73.207 29.991 -14.506 383 HA VAL 74 HA VAL 74 75.310 27.935 -14.082 384 HB VAL 74 HB VAL 74 72.316 27.593 -14.312 385 HG11 VAL 74 HG11 VAL 74 74.509 25.651 -13.470 386 HG12 VAL 74 HG12 VAL 74 72.762 25.366 -13.314 387 HG13 VAL 74 HG13 VAL 74 73.480 25.520 -14.916 388 HG21 VAL 74 HG21 VAL 74 72.927 28.846 -12.273 389 HG22 VAL 74 HG22 VAL 74 72.424 27.208 -11.866 390 HG23 VAL 74 HG23 VAL 74 74.152 27.626 -11.873 391 H THR 75 H THR 75 73.107 29.023 -16.713 392 HA THR 75 HA THR 75 74.646 27.290 -18.617 393 HB THR 75 HB THR 75 72.718 27.012 -19.929 394 HG1 THR 75 HG1 THR 75 70.712 28.047 -19.102 395 HG21 THR 75 HG21 THR 75 71.754 26.757 -17.068 396 HG22 THR 75 HG22 THR 75 71.251 25.812 -18.490 397 HG23 THR 75 HG23 THR 75 72.902 25.647 -17.851 398 H ARG 76 H ARG 76 74.484 27.950 -20.964 399 HA ARG 76 HA ARG 76 75.600 30.575 -21.365 400 HB2 ARG 76 HB2 ARG 76 75.586 30.062 -23.711 401 HB3 ARG 76 HB3 ARG 76 76.080 28.635 -22.815 402 HG2 ARG 76 HG2 ARG 76 73.693 27.741 -23.090 403 HG3 ARG 76 HG3 ARG 76 73.358 29.152 -24.098 404 HD2 ARG 76 HD2 ARG 76 73.808 27.384 -25.573 405 HD3 ARG 76 HD3 ARG 76 75.237 28.431 -25.624 406 HE ARG 76 HE ARG 76 75.806 26.479 -23.688 407 HH11 ARG 76 HH11 ARG 76 75.084 26.377 -27.116 408 HH12 ARG 76 HH12 ARG 76 75.939 24.877 -27.345 409 HH21 ARG 76 HH21 ARG 76 76.893 24.568 -24.054 410 HH22 ARG 76 HH22 ARG 76 76.941 23.892 -25.652 411 H SER 77 H SER 77 72.285 29.394 -21.614 412 HA SER 77 HA SER 77 71.116 31.845 -22.615 413 HB2 SER 77 HB2 SER 77 69.982 29.627 -22.639 414 HB3 SER 77 HB3 SER 77 69.849 29.697 -20.869 415 HG SER 77 HG SER 77 67.953 30.484 -21.982 416 H ASP 78 H ASP 78 71.623 30.541 -19.249 417 HA ASP 78 HA ASP 78 70.546 32.809 -17.905 418 HB2 ASP 78 HB2 ASP 78 72.819 31.002 -17.046 419 HB3 ASP 78 HB3 ASP 78 71.927 32.094 -15.991 420 H ALA 79 H ALA 79 73.943 32.210 -18.999 421 HA ALA 79 HA ALA 79 75.008 34.666 -18.040 422 HB1 ALA 79 HB1 ALA 79 75.892 32.864 -20.345 423 HB2 ALA 79 HB2 ALA 79 76.873 34.138 -19.608 424 HB3 ALA 79 HB3 ALA 79 76.401 32.724 -18.643 425 H ARG 80 H ARG 80 73.606 33.958 -21.309 426 HA ARG 80 HA ARG 80 74.070 36.613 -22.326 427 HB2 ARG 80 HB2 ARG 80 73.583 34.558 -23.663 428 HB3 ARG 80 HB3 ARG 80 71.898 34.621 -23.162 429 HG2 ARG 80 HG2 ARG 80 73.243 36.982 -24.549 430 HG3 ARG 80 HG3 ARG 80 72.664 35.597 -25.469 431 HD2 ARG 80 HD2 ARG 80 70.376 35.939 -24.657 432 HD3 ARG 80 HD3 ARG 80 70.893 37.362 -23.728 433 HE ARG 80 HE ARG 80 71.768 37.888 -26.303 434 HH11 ARG 80 HH11 ARG 80 68.510 37.258 -25.009 435 HH12 ARG 80 HH12 ARG 80 67.821 38.241 -26.311 436 HH21 ARG 80 HH21 ARG 80 70.618 39.112 -27.850 437 HH22 ARG 80 HH22 ARG 80 68.857 39.154 -27.691 438 H VAL 81 H VAL 81 71.231 35.235 -20.639 439 HA VAL 81 HA VAL 81 69.622 37.625 -20.727 440 HB VAL 81 HB VAL 81 69.646 35.305 -18.759 441 HG11 VAL 81 HG11 VAL 81 67.617 37.571 -19.088 442 HG12 VAL 81 HG12 VAL 81 67.304 36.071 -18.198 443 HG13 VAL 81 HG13 VAL 81 68.545 37.183 -17.621 444 HG21 VAL 81 HG21 VAL 81 69.057 34.798 -21.138 445 HG22 VAL 81 HG22 VAL 81 67.730 34.534 -20.006 446 HG23 VAL 81 HG23 VAL 81 67.752 35.990 -21.042 447 H LEU 82 H LEU 82 71.923 36.440 -18.218 448 HA LEU 82 HA LEU 82 71.686 38.720 -16.518 449 HB2 LEU 82 HB2 LEU 82 73.988 36.817 -17.065 450 HB3 LEU 82 HB3 LEU 82 74.179 38.186 -15.981 451 HG LEU 82 HG LEU 82 72.194 35.915 -15.579 452 HD11 LEU 82 HD11 LEU 82 74.670 36.733 -14.000 453 HD12 LEU 82 HD12 LEU 82 73.697 35.256 -13.812 454 HD13 LEU 82 HD13 LEU 82 74.671 35.501 -15.275 455 HD21 LEU 82 HD21 LEU 82 71.212 37.896 -14.574 456 HD22 LEU 82 HD22 LEU 82 71.961 36.967 -13.281 457 HD23 LEU 82 HD23 LEU 82 72.786 38.401 -13.910 458 H ILE 83 H ILE 83 74.068 38.286 -19.223 459 HA ILE 83 HA ILE 83 75.233 40.863 -19.021 460 HB ILE 83 HB ILE 83 74.778 39.043 -21.405 461 HG12 ILE 83 HG12 ILE 83 77.349 39.831 -19.954 462 HG13 ILE 83 HG13 ILE 83 76.373 38.452 -19.464 463 HG21 ILE 83 HG21 ILE 83 76.332 41.681 -21.372 464 HG22 ILE 83 HG22 ILE 83 76.398 40.482 -22.674 465 HG23 ILE 83 HG23 ILE 83 74.900 41.332 -22.356 466 HD11 ILE 83 HD11 ILE 83 77.761 38.765 -22.151 467 HD12 ILE 83 HD12 ILE 83 78.177 37.658 -20.835 468 HD13 ILE 83 HD13 ILE 83 76.655 37.437 -21.719 469 H PHE 84 H PHE 84 72.371 39.902 -20.999 470 HA PHE 84 HA PHE 84 71.883 42.506 -21.965 471 HB2 PHE 84 HB2 PHE 84 70.983 40.278 -22.829 472 HB3 PHE 84 HB3 PHE 84 69.802 40.328 -21.535 473 HD1 PHE 84 HD1 PHE 84 71.171 42.838 -24.032 474 HD2 PHE 84 HD2 PHE 84 67.664 40.980 -22.329 475 HE1 PHE 84 HE1 PHE 84 69.772 44.098 -25.586 476 HE2 PHE 84 HE2 PHE 84 66.237 42.315 -23.864 477 HZ PHE 84 HZ PHE 84 67.276 43.869 -25.506 478 H ASN 85 H ASN 85 70.356 40.908 -19.100 479 HA ASN 85 HA ASN 85 68.634 43.147 -18.545 480 HB2 ASN 85 HB2 ASN 85 68.153 40.824 -17.850 481 HB3 ASN 85 HB3 ASN 85 69.569 40.828 -16.794 482 HD21 ASN 85 HD22 ASN 85 66.364 42.385 -17.305 483 HD22 ASN 85 HD21 ASN 85 66.188 42.851 -15.622 484 H GLU 86 H GLU 86 71.808 42.165 -17.190 485 HA GLU 86 HA GLU 86 72.154 44.232 -15.254 486 HB2 GLU 86 HB2 GLU 86 73.609 42.237 -15.467 487 HB3 GLU 86 HB3 GLU 86 74.168 42.808 -17.045 488 HG2 GLU 86 HG2 GLU 86 75.079 44.874 -15.851 489 HG3 GLU 86 HG3 GLU 86 74.735 44.037 -14.331 490 H TRP 87 H TRP 87 73.247 44.098 -18.724 491 HA TRP 87 HA TRP 87 74.143 46.797 -18.797 492 HB2 TRP 87 HB2 TRP 87 74.861 45.216 -20.452 493 HB3 TRP 87 HB3 TRP 87 73.202 44.875 -20.928 494 HD1 TRP 87 HD1 TRP 87 75.797 47.717 -21.236 495 HE1 TRP 87 HE1 TRP 87 75.271 49.026 -23.375 496 HE3 TRP 87 HE3 TRP 87 71.457 45.366 -22.560 497 HZ2 TRP 87 HZ2 TRP 87 73.295 48.970 -25.458 498 HZ3 TRP 87 HZ3 TRP 87 70.390 45.900 -24.689 499 HH2 TRP 87 HH2 TRP 87 71.249 47.721 -26.157 500 H GLU 88 H GLU 88 70.881 45.444 -19.733 501 HA GLU 88 HA GLU 88 69.781 47.857 -20.639 502 HB2 GLU 88 HB2 GLU 88 68.623 45.380 -19.356 503 HB3 GLU 88 HB3 GLU 88 67.589 46.764 -19.629 504 HG2 GLU 88 HG2 GLU 88 69.236 45.662 -21.916 505 HG3 GLU 88 HG3 GLU 88 67.713 44.920 -21.443 506 H GLU 89 H GLU 89 69.755 46.674 -17.192 507 HA GLU 89 HA GLU 89 68.413 49.088 -16.275 508 HB2 GLU 89 HB2 GLU 89 70.001 46.938 -14.821 509 HB3 GLU 89 HB3 GLU 89 69.200 48.276 -13.997 510 HG2 GLU 89 HG2 GLU 89 67.760 46.272 -15.786 511 HG3 GLU 89 HG3 GLU 89 67.887 46.142 -14.036 512 H ARG 90 H ARG 90 71.845 48.071 -16.173 513 HA ARG 90 HA ARG 90 72.913 50.414 -14.912 514 HB2 ARG 90 HB2 ARG 90 74.118 48.566 -17.021 515 HB3 ARG 90 HB3 ARG 90 75.036 49.807 -16.165 516 HG2 ARG 90 HG2 ARG 90 73.513 47.903 -14.453 517 HG3 ARG 90 HG3 ARG 90 74.833 47.222 -15.396 518 HD2 ARG 90 HD2 ARG 90 75.523 47.935 -13.076 519 HD3 ARG 90 HD3 ARG 90 76.472 48.612 -14.392 520 HE ARG 90 HE ARG 90 75.711 50.758 -13.942 521 HH11 ARG 90 HH11 ARG 90 73.821 48.634 -11.851 522 HH12 ARG 90 HH12 ARG 90 73.218 49.995 -10.947 523 HH21 ARG 90 HH21 ARG 90 74.985 52.284 -12.873 524 HH22 ARG 90 HH22 ARG 90 73.886 52.098 -11.496 525 H LYS 91 H LYS 91 72.532 49.698 -18.334 526 HA LYS 91 HA LYS 91 73.349 52.296 -19.247 527 HB2 LYS 91 HB2 LYS 91 73.443 50.139 -20.549 528 HB3 LYS 91 HB3 LYS 91 71.704 50.208 -20.766 529 HG2 LYS 91 HG2 LYS 91 73.351 52.560 -21.699 530 HG3 LYS 91 HG3 LYS 91 73.473 51.046 -22.585 531 HD2 LYS 91 HD2 LYS 91 71.008 50.991 -22.894 532 HD3 LYS 91 HD3 LYS 91 70.884 52.580 -22.110 533 HE2 LYS 91 HE2 LYS 91 72.379 53.549 -23.849 534 HE3 LYS 91 HE3 LYS 91 72.533 51.962 -24.607 535 HZ1 LYS 91 HZ1 LYS 91 69.975 53.481 -24.356 536 HZ2 LYS 91 HZ2 LYS 91 70.846 53.314 -25.726 537 HZ3 LYS 91 HZ3 LYS 91 70.127 52.010 -25.061 538 H LYS 92 H LYS 92 70.063 51.097 -18.432 539 HA LYS 92 HA LYS 92 68.647 53.444 -19.257 540 HB2 LYS 92 HB2 LYS 92 67.622 51.320 -18.465 541 HB3 LYS 92 HB3 LYS 92 68.175 51.675 -16.823 542 HG2 LYS 92 HG2 LYS 92 66.753 53.743 -16.846 543 HG3 LYS 92 HG3 LYS 92 66.231 53.314 -18.485 544 HD2 LYS 92 HD2 LYS 92 64.499 52.539 -17.043 545 HD3 LYS 92 HD3 LYS 92 65.398 51.097 -17.530 546 HE2 LYS 92 HE2 LYS 92 66.736 51.398 -15.316 547 HE3 LYS 92 HE3 LYS 92 65.522 52.604 -14.877 548 HZ1 LYS 92 HZ1 LYS 92 65.074 49.706 -15.401 549 HZ2 LYS 92 HZ2 LYS 92 64.880 50.476 -13.984 550 HZ3 LYS 92 HZ3 LYS 92 63.829 50.780 -15.203 551 H SER 93 H SER 93 70.581 52.796 -16.279 552 HA SER 93 HA SER 93 70.363 55.615 -15.448 553 HB2 SER 93 HB2 SER 93 72.174 53.391 -14.465 554 HB3 SER 93 HB3 SER 93 72.045 55.009 -13.754 555 HG SER 93 HG SER 93 70.665 53.494 -12.689 556 H GLU 94 H GLU 94 72.560 53.892 -17.530 557 HA GLU 94 HA GLU 94 74.499 56.166 -17.697 558 HB2 GLU 94 HB2 GLU 94 75.099 53.178 -17.558 559 HB3 GLU 94 HB3 GLU 94 76.267 54.476 -17.721 560 HG2 GLU 94 HG2 GLU 94 75.584 55.365 -15.498 561 HG3 GLU 94 HG3 GLU 94 74.406 54.055 -15.361 562 HA PRO 95 HA PRO 95 72.655 54.798 -21.738 563 HB2 PRO 95 HB2 PRO 95 72.637 57.250 -23.073 564 HB3 PRO 95 HB3 PRO 95 71.368 56.638 -21.973 565 HG2 PRO 95 HG2 PRO 95 73.693 58.471 -21.303 566 HG3 PRO 95 HG3 PRO 95 71.959 58.677 -20.885 567 HD2 PRO 95 HD2 PRO 95 73.656 57.661 -19.078 568 HD3 PRO 95 HD3 PRO 95 72.051 56.904 -19.287 569 H TRP 96 H TRP 96 75.796 55.854 -21.161 570 HA TRP 96 HA TRP 96 76.845 55.651 -23.904 571 HB2 TRP 96 HB2 TRP 96 79.007 56.048 -22.692 572 HB3 TRP 96 HB3 TRP 96 77.799 57.300 -22.485 573 HD1 TRP 96 HD1 TRP 96 79.521 54.487 -20.527 574 HE1 TRP 96 HE1 TRP 96 79.242 54.893 -18.007 575 HE3 TRP 96 HE3 TRP 96 76.290 58.464 -20.695 576 HZ2 TRP 96 HZ2 TRP 96 77.805 56.704 -16.285 577 HZ3 TRP 96 HZ3 TRP 96 75.461 59.493 -18.590 578 HH2 TRP 96 HH2 TRP 96 76.207 58.624 -16.386 579 H LEU 97 H LEU 97 76.072 53.315 -21.445 580 HA LEU 97 HA LEU 97 78.380 51.803 -21.423 581 HB2 LEU 97 HB2 LEU 97 76.310 51.823 -19.866 582 HB3 LEU 97 HB3 LEU 97 75.571 50.737 -21.020 583 HG LEU 97 HG LEU 97 77.415 49.136 -20.645 584 HD11 LEU 97 HD11 LEU 97 78.287 51.086 -18.469 585 HD12 LEU 97 HD12 LEU 97 78.851 49.407 -18.605 586 HD13 LEU 97 HD13 LEU 97 79.255 50.566 -19.867 587 HD21 LEU 97 HD21 LEU 97 75.284 49.036 -19.341 588 HD22 LEU 97 HD22 LEU 97 76.657 48.441 -18.387 589 HD23 LEU 97 HD23 LEU 97 76.024 50.085 -18.118 590 H ARG 98 H ARG 98 79.218 50.081 -22.475 591 HA ARG 98 HA ARG 98 78.175 49.383 -25.141 592 HB2 ARG 98 HB2 ARG 98 80.651 48.354 -23.712 593 HB3 ARG 98 HB3 ARG 98 80.294 48.240 -25.430 594 HG2 ARG 98 HG2 ARG 98 80.990 50.745 -23.842 595 HG3 ARG 98 HG3 ARG 98 81.967 49.959 -25.070 596 HD2 ARG 98 HD2 ARG 98 79.309 51.371 -25.554 597 HD3 ARG 98 HD3 ARG 98 80.915 52.037 -25.872 598 HE ARG 98 HE ARG 98 80.854 49.637 -27.295 599 HH11 ARG 98 HH11 ARG 98 79.090 52.659 -27.434 600 HH12 ARG 98 HH12 ARG 98 78.775 52.508 -29.142 601 HH21 ARG 98 HH21 ARG 98 80.397 49.488 -29.469 602 HH22 ARG 98 HH22 ARG 98 79.507 50.753 -30.261 603 H LEU 99 H LEU 99 77.965 47.237 -25.912 604 HA LEU 99 HA LEU 99 77.161 45.146 -23.951 605 HB2 LEU 99 HB2 LEU 99 75.286 46.563 -24.588 606 HB3 LEU 99 HB3 LEU 99 75.535 46.269 -26.277 607 HG LEU 99 HG LEU 99 73.594 45.112 -25.214 608 HD11 LEU 99 HD11 LEU 99 75.471 43.002 -26.274 609 HD12 LEU 99 HD12 LEU 99 73.730 43.235 -26.567 610 HD13 LEU 99 HD13 LEU 99 74.884 44.317 -27.308 611 HD21 LEU 99 HD21 LEU 99 74.887 44.604 -23.068 612 HD22 LEU 99 HD22 LEU 99 73.624 43.539 -23.648 613 HD23 LEU 99 HD23 LEU 99 75.357 43.109 -23.900 614 H ASP 100 H ASP 100 78.058 43.217 -24.519 615 HA ASP 100 HA ASP 100 78.297 42.412 -27.329 616 HB2 ASP 100 HB2 ASP 100 80.634 41.827 -27.208 617 HB3 ASP 100 HB3 ASP 100 80.417 43.551 -26.983 618 H MET 101 H MET 101 78.161 40.255 -27.661 619 HA MET 101 HA MET 101 77.701 38.486 -25.284 620 HB2 MET 101 HB2 MET 101 75.882 38.942 -27.682 621 HB3 MET 101 HB3 MET 101 75.623 37.714 -26.439 622 HG2 MET 101 HG2 MET 101 75.395 39.428 -24.715 623 HG3 MET 101 HG3 MET 101 75.679 40.702 -25.912 624 HE1 MET 101 HE1 MET 101 73.289 41.892 -25.060 625 HE2 MET 101 HE2 MET 101 71.815 40.912 -24.975 626 HE3 MET 101 HE3 MET 101 73.188 40.530 -23.912 627 H SER 102 H SER 102 79.760 38.656 -27.734 628 HA SER 102 HA SER 102 79.521 36.173 -29.147 629 HB2 SER 102 HB2 SER 102 82.031 37.757 -28.467 630 HB3 SER 102 HB3 SER 102 81.871 36.525 -29.734 631 HG SER 102 HG SER 102 81.644 38.659 -30.579 632 H ASP 103 H ASP 103 80.768 34.190 -28.863 633 HA ASP 103 HA ASP 103 80.433 33.045 -26.367 634 HB2 ASP 103 HB2 ASP 103 82.404 32.225 -28.538 635 HB3 ASP 103 HB3 ASP 103 81.887 31.205 -27.197 636 H LYS 104 H LYS 104 83.426 34.578 -27.529 637 HA LYS 104 HA LYS 104 85.135 33.847 -25.334 638 HB2 LYS 104 HB2 LYS 104 85.174 36.113 -27.362 639 HB3 LYS 104 HB3 LYS 104 86.313 36.074 -26.026 640 HG2 LYS 104 HG2 LYS 104 87.397 35.131 -27.900 641 HG3 LYS 104 HG3 LYS 104 87.136 33.857 -26.710 642 HD2 LYS 104 HD2 LYS 104 85.288 32.936 -28.052 643 HD3 LYS 104 HD3 LYS 104 85.416 34.300 -29.195 644 HE2 LYS 104 HE2 LYS 104 87.772 33.613 -29.691 645 HE3 LYS 104 HE3 LYS 104 87.591 32.233 -28.606 646 HZ1 LYS 104 HZ1 LYS 104 85.995 32.681 -31.086 647 HZ2 LYS 104 HZ2 LYS 104 87.202 31.599 -30.924 648 HZ3 LYS 104 HZ3 LYS 104 85.818 31.395 -30.086 649 H ALA 105 H ALA 105 82.711 36.439 -25.556 650 HA ALA 105 HA ALA 105 83.501 37.845 -23.159 651 HB1 ALA 105 HB1 ALA 105 80.735 37.632 -24.405 652 HB2 ALA 105 HB2 ALA 105 81.329 38.877 -23.298 653 HB3 ALA 105 HB3 ALA 105 82.003 38.759 -24.934 654 H ILE 106 H ILE 106 81.325 35.113 -23.779 655 HA ILE 106 HA ILE 106 80.444 34.873 -21.023 656 HB ILE 106 HB ILE 106 80.162 33.144 -23.499 657 HG12 ILE 106 HG12 ILE 106 77.782 33.612 -23.193 658 HG13 ILE 106 HG13 ILE 106 78.105 34.503 -21.705 659 HG21 ILE 106 HG21 ILE 106 79.192 32.457 -20.685 660 HG22 ILE 106 HG22 ILE 106 78.641 31.665 -22.178 661 HG23 ILE 106 HG23 ILE 106 80.325 31.517 -21.686 662 HD11 ILE 106 HD11 ILE 106 79.066 35.370 -24.460 663 HD12 ILE 106 HD12 ILE 106 77.582 35.945 -23.673 664 HD13 ILE 106 HD13 ILE 106 79.157 36.320 -22.958 665 H PHE 107 H PHE 107 82.857 33.057 -22.997 666 HA PHE 107 HA PHE 107 83.847 31.372 -20.951 667 HB2 PHE 107 HB2 PHE 107 85.520 32.819 -23.039 668 HB3 PHE 107 HB3 PHE 107 85.968 31.364 -22.178 669 HD1 PHE 107 HD1 PHE 107 82.921 30.177 -22.705 670 HD2 PHE 107 HD2 PHE 107 86.174 31.739 -25.064 671 HE1 PHE 107 HE1 PHE 107 82.185 28.797 -24.627 672 HE2 PHE 107 HE2 PHE 107 85.436 30.340 -26.996 673 HZ PHE 107 HZ PHE 107 83.441 28.870 -26.772 674 H ARG 108 H ARG 108 84.970 34.707 -21.741 675 HA ARG 108 HA ARG 108 87.007 34.708 -19.744 676 HB2 ARG 108 HB2 ARG 108 86.916 35.815 -21.981 677 HB3 ARG 108 HB3 ARG 108 85.799 37.019 -21.338 678 HG2 ARG 108 HG2 ARG 108 88.544 36.489 -20.137 679 HG3 ARG 108 HG3 ARG 108 88.316 37.533 -21.541 680 HD2 ARG 108 HD2 ARG 108 86.812 39.004 -20.241 681 HD3 ARG 108 HD3 ARG 108 87.095 38.011 -18.796 682 HE ARG 108 HE ARG 108 89.618 38.792 -19.837 683 HH11 ARG 108 HH11 ARG 108 86.907 40.341 -18.233 684 HH12 ARG 108 HH12 ARG 108 87.911 41.587 -17.547 685 HH21 ARG 108 HH21 ARG 108 90.835 40.409 -18.932 686 HH22 ARG 108 HH22 ARG 108 90.081 41.621 -17.938 687 H ARG 109 H ARG 109 83.706 36.106 -19.738 688 HA ARG 109 HA ARG 109 84.000 37.242 -17.054 689 HB2 ARG 109 HB2 ARG 109 82.417 38.100 -18.813 690 HB3 ARG 109 HB3 ARG 109 81.469 36.614 -18.628 691 HG2 ARG 109 HG2 ARG 109 81.186 37.175 -16.190 692 HG3 ARG 109 HG3 ARG 109 82.013 38.708 -16.458 693 HD2 ARG 109 HD2 ARG 109 79.615 38.014 -18.175 694 HD3 ARG 109 HD3 ARG 109 79.391 38.388 -16.463 695 HE ARG 109 HE ARG 109 80.884 40.355 -18.100 696 HH11 ARG 109 HH11 ARG 109 77.886 39.562 -16.412 697 HH12 ARG 109 HH12 ARG 109 77.515 41.258 -16.141 698 HH21 ARG 109 HH21 ARG 109 80.142 42.521 -17.848 699 HH22 ARG 109 HH22 ARG 109 78.581 42.770 -17.060 700 H TYR 110 H TYR 110 82.641 34.212 -18.343 701 HA TYR 110 HA TYR 110 82.239 33.159 -15.574 702 HB2 TYR 110 HB2 TYR 110 80.587 32.589 -18.048 703 HB3 TYR 110 HB3 TYR 110 80.309 32.003 -16.425 704 HD1 TYR 110 HD1 TYR 110 80.266 34.093 -14.585 705 HD2 TYR 110 HD2 TYR 110 79.135 34.250 -18.747 706 HE1 TYR 110 HE1 TYR 110 78.780 36.036 -14.121 707 HE2 TYR 110 HE2 TYR 110 77.592 36.159 -18.254 708 HH TYR 110 HH TYR 110 77.177 37.479 -14.947 709 HA PRO 111 HA PRO 111 85.392 30.653 -17.844 710 HB2 PRO 111 HB2 PRO 111 86.956 29.895 -15.710 711 HB3 PRO 111 HB3 PRO 111 87.066 31.484 -16.525 712 HG2 PRO 111 HG2 PRO 111 85.512 30.790 -14.010 713 HG3 PRO 111 HG3 PRO 111 86.653 32.152 -14.265 714 HD2 PRO 111 HD2 PRO 111 83.993 32.515 -14.497 715 HD3 PRO 111 HD3 PRO 111 85.109 33.300 -15.658 716 H HIS 112 H HIS 112 83.184 29.662 -15.320 717 HA HIS 112 HA HIS 112 83.694 26.801 -15.543 718 HB2 HIS 112 HB2 HIS 112 81.868 26.567 -14.085 719 HB3 HIS 112 HB3 HIS 112 82.676 28.040 -13.559 720 HD2 HIS 112 HD2 HIS 112 79.345 26.741 -14.139 721 HE1 HIS 112 HE1 HIS 112 78.806 30.801 -15.273 722 HE2 HIS 112 HE2 HIS 112 77.629 28.719 -14.623 723 H LEU 113 H LEU 113 81.814 29.132 -17.389 724 HA LEU 113 HA LEU 113 80.018 27.210 -18.552 725 HB2 LEU 113 HB2 LEU 113 80.057 29.949 -17.999 726 HB3 LEU 113 HB3 LEU 113 80.319 29.929 -19.725 727 HG LEU 113 HG LEU 113 78.009 30.240 -19.215 728 HD11 LEU 113 HD11 LEU 113 78.327 27.362 -20.163 729 HD12 LEU 113 HD12 LEU 113 76.982 28.451 -20.510 730 HD13 LEU 113 HD13 LEU 113 78.577 28.803 -21.182 731 HD21 LEU 113 HD21 LEU 113 77.724 29.374 -17.062 732 HD22 LEU 113 HD22 LEU 113 76.636 28.478 -18.101 733 HD23 LEU 113 HD23 LEU 113 78.132 27.710 -17.551 734 H ARG 114 H ARG 114 83.230 28.120 -19.324 735 HA ARG 114 HA ARG 114 83.154 27.684 -22.206 736 HB2 ARG 114 HB2 ARG 114 84.906 29.055 -21.098 737 HB3 ARG 114 HB3 ARG 114 85.502 27.605 -20.276 738 HG2 ARG 114 HG2 ARG 114 86.006 26.567 -22.501 739 HG3 ARG 114 HG3 ARG 114 85.367 28.003 -23.306 740 HD2 ARG 114 HD2 ARG 114 87.756 28.130 -23.310 741 HD3 ARG 114 HD3 ARG 114 87.145 29.372 -22.204 742 HE ARG 114 HE ARG 114 87.691 27.001 -20.713 743 HH11 ARG 114 HH11 ARG 114 89.538 29.441 -22.421 744 HH12 ARG 114 HH12 ARG 114 90.942 29.211 -21.414 745 HH21 ARG 114 HH21 ARG 114 89.507 26.767 -19.464 746 HH22 ARG 114 HH22 ARG 114 90.919 27.729 -19.787 Start of MODEL 2 1 H1 MET 1 H1 MET 1 0.356 38.193 -16.937 2 H2 MET 1 H2 MET 1 1.463 37.875 -18.092 3 H3 MET 1 H3 MET 1 0.632 39.289 -18.116 4 HA MET 1 HA MET 1 2.583 38.483 -16.038 5 HB2 MET 1 HB2 MET 1 2.822 40.606 -18.228 6 HB3 MET 1 HB3 MET 1 3.902 40.480 -16.841 7 HG2 MET 1 HG2 MET 1 4.580 38.203 -17.544 8 HG3 MET 1 HG3 MET 1 3.514 38.322 -18.945 9 HE1 MET 1 HE1 MET 1 6.879 39.393 -17.296 10 HE2 MET 1 HE2 MET 1 7.501 40.632 -18.406 11 HE3 MET 1 HE3 MET 1 6.115 41.002 -17.361 12 H ARG 2 H ARG 2 2.994 40.031 -14.359 13 HA ARG 2 HA ARG 2 1.142 42.312 -14.038 14 HB2 ARG 2 HB2 ARG 2 0.129 40.073 -13.094 15 HB3 ARG 2 HB3 ARG 2 1.366 40.191 -11.857 16 HG2 ARG 2 HG2 ARG 2 -0.660 41.062 -10.961 17 HG3 ARG 2 HG3 ARG 2 0.395 42.454 -11.212 18 HD2 ARG 2 HD2 ARG 2 -0.824 42.991 -13.315 19 HD3 ARG 2 HD3 ARG 2 -1.814 41.531 -13.106 20 HE ARG 2 HE ARG 2 -2.010 43.193 -10.772 21 HH11 ARG 2 HH11 ARG 2 -3.181 43.121 -14.079 22 HH12 ARG 2 HH12 ARG 2 -4.608 44.043 -13.691 23 HH21 ARG 2 HH21 ARG 2 -3.850 44.368 -10.348 24 HH22 ARG 2 HH22 ARG 2 -4.969 44.730 -11.628 25 H GLY 3 H GLY 3 1.852 43.871 -12.555 26 HA2 GLY 3 HA2 GLY 3 3.272 45.005 -11.118 27 HA3 GLY 3 HA3 GLY 3 4.200 43.535 -10.863 28 H SER 4 H SER 4 5.728 45.581 -10.875 29 HA SER 4 HA SER 4 6.653 46.462 -13.506 30 HB2 SER 4 HB2 SER 4 8.273 47.796 -12.202 31 HB3 SER 4 HB3 SER 4 6.589 48.069 -11.728 32 HG SER 4 HG SER 4 7.946 47.823 -9.891 33 H HIS 5 H HIS 5 8.779 46.253 -14.303 34 HA HIS 5 HA HIS 5 10.340 43.864 -13.401 35 HB2 HIS 5 HB2 HIS 5 10.384 43.073 -15.731 36 HB3 HIS 5 HB3 HIS 5 8.756 43.134 -15.077 37 HD2 HIS 5 HD2 HIS 5 6.973 44.565 -16.344 38 HE1 HIS 5 HE1 HIS 5 9.513 46.455 -19.206 39 HE2 HIS 5 HE2 HIS 5 7.095 46.088 -18.495 40 H HIS 6 H HIS 6 10.737 47.045 -13.736 41 HA HIS 6 HA HIS 6 13.530 46.816 -14.772 42 HB2 HIS 6 HB2 HIS 6 12.122 47.770 -16.540 43 HB3 HIS 6 HB3 HIS 6 11.529 49.006 -15.428 44 HD2 HIS 6 HD2 HIS 6 14.768 47.929 -17.277 45 HE1 HIS 6 HE1 HIS 6 15.357 51.959 -16.001 46 HE2 HIS 6 HE2 HIS 6 16.347 50.040 -17.353 47 H HIS 7 H HIS 7 15.064 47.844 -13.671 48 HA HIS 7 HA HIS 7 14.461 49.787 -11.520 49 HB2 HIS 7 HB2 HIS 7 15.996 47.190 -11.060 50 HB3 HIS 7 HB3 HIS 7 15.770 48.480 -9.885 51 HD2 HIS 7 HD2 HIS 7 13.196 48.843 -8.927 52 HE1 HIS 7 HE1 HIS 7 11.806 44.957 -10.017 53 HE2 HIS 7 HE2 HIS 7 11.295 47.036 -8.639 54 H HIS 8 H HIS 8 16.336 50.965 -10.801 55 HA HIS 8 HA HIS 8 18.911 50.577 -12.198 56 HB2 HIS 8 HB2 HIS 8 17.571 52.016 -13.720 57 HB3 HIS 8 HB3 HIS 8 17.316 53.166 -12.408 58 HD2 HIS 8 HD2 HIS 8 20.105 51.780 -14.713 59 HE1 HIS 8 HE1 HIS 8 21.635 55.358 -12.958 60 HE2 HIS 8 HE2 HIS 8 22.080 53.524 -14.671 61 H HIS 9 H HIS 9 20.673 51.357 -11.075 62 HA HIS 9 HA HIS 9 20.426 53.218 -8.838 63 HB2 HIS 9 HB2 HIS 9 19.742 51.101 -7.756 64 HB3 HIS 9 HB3 HIS 9 21.207 50.314 -8.339 65 HD2 HIS 9 HD2 HIS 9 23.021 50.144 -6.519 66 HE1 HIS 9 HE1 HIS 9 22.176 53.663 -4.258 67 HE2 HIS 9 HE2 HIS 9 23.674 51.609 -4.427 68 H HIS 10 H HIS 10 22.356 54.119 -8.222 69 HA HIS 10 HA HIS 10 24.930 52.889 -8.935 70 HB2 HIS 10 HB2 HIS 10 24.197 55.746 -9.694 71 HB3 HIS 10 HB3 HIS 10 25.857 55.206 -9.488 72 HD2 HIS 10 HD2 HIS 10 26.194 52.636 -11.050 73 HE1 HIS 10 HE1 HIS 10 24.486 54.637 -14.404 74 HE2 HIS 10 HE2 HIS 10 25.898 52.650 -13.666 75 H GLY 11 H GLY 11 26.289 52.952 -7.237 76 HA2 GLY 11 HA2 GLY 11 25.375 54.396 -4.782 77 HA3 GLY 11 HA3 GLY 11 26.221 52.859 -4.846 78 H SER 28 H SER 28 27.922 54.805 -6.978 79 HA SER 28 HA SER 28 29.686 56.004 -4.909 80 HB2 SER 28 HB2 SER 28 31.655 54.820 -5.790 81 HB3 SER 28 HB3 SER 28 30.466 53.718 -5.082 82 HG SER 28 HG SER 28 31.263 52.939 -7.098 83 H VAL 29 H VAL 29 31.254 57.435 -5.613 84 HA VAL 29 HA VAL 29 31.606 58.172 -8.398 85 HB VAL 29 HB VAL 29 29.517 59.373 -7.874 86 HG11 VAL 29 HG11 VAL 29 31.089 60.949 -5.796 87 HG12 VAL 29 HG12 VAL 29 29.422 61.240 -6.326 88 HG13 VAL 29 HG13 VAL 29 29.815 59.758 -5.446 89 HG21 VAL 29 HG21 VAL 29 31.143 60.332 -9.488 90 HG22 VAL 29 HG22 VAL 29 30.126 61.541 -8.691 91 HG23 VAL 29 HG23 VAL 29 31.810 61.343 -8.180 92 H SER 30 H SER 30 33.511 59.400 -8.724 93 HA SER 30 HA SER 30 34.957 60.549 -6.447 94 HB2 SER 30 HB2 SER 30 37.046 59.331 -6.893 95 HB3 SER 30 HB3 SER 30 35.756 58.257 -6.337 96 HG SER 30 HG SER 30 36.903 57.372 -8.131 97 H PHE 31 H PHE 31 36.617 61.998 -7.019 98 HA PHE 31 HA PHE 31 37.285 62.517 -9.812 99 HB2 PHE 31 HB2 PHE 31 35.076 63.712 -9.414 100 HB3 PHE 31 HB3 PHE 31 35.883 64.687 -8.197 101 HD1 PHE 31 HD2 PHE 31 36.225 63.628 -11.805 102 HD2 PHE 31 HD1 PHE 31 36.800 66.765 -8.898 103 HE1 PHE 31 HE2 PHE 31 36.958 65.169 -13.611 104 HE2 PHE 31 HE1 PHE 31 37.527 68.302 -10.707 105 HZ PHE 31 HZ PHE 31 37.612 67.508 -13.064 106 H GLY 32 H GLY 32 39.033 64.076 -10.045 107 HA2 GLY 32 HA2 GLY 32 41.009 63.899 -7.904 108 HA3 GLY 32 HA3 GLY 32 41.224 64.618 -9.493 109 H ALA 33 H ALA 33 42.436 65.847 -7.495 110 HA ALA 33 HA ALA 33 41.129 68.474 -7.453 111 HB1 ALA 33 HB1 ALA 33 42.068 67.095 -4.896 112 HB2 ALA 33 HB2 ALA 33 41.530 68.783 -5.021 113 HB3 ALA 33 HB3 ALA 33 40.384 67.466 -5.329 114 HA PRO 34 HA PRO 34 45.392 69.609 -8.173 115 HB2 PRO 34 HB2 PRO 34 45.367 72.302 -7.752 116 HB3 PRO 34 HB3 PRO 34 44.547 71.518 -9.136 117 HG2 PRO 34 HG2 PRO 34 43.315 72.414 -6.511 118 HG3 PRO 34 HG3 PRO 34 42.717 72.700 -8.174 119 HD2 PRO 34 HD2 PRO 34 41.778 70.666 -6.595 120 HD3 PRO 34 HD3 PRO 34 41.918 70.505 -8.371 121 H SER 35 H SER 35 46.961 68.971 -6.865 122 HA SER 35 HA SER 35 47.406 70.270 -4.211 123 HB2 SER 35 HB2 SER 35 47.401 67.271 -4.713 124 HB3 SER 35 HB3 SER 35 47.939 68.069 -3.223 125 HG SER 35 HG SER 35 45.764 67.335 -3.076 126 HA PRO 36 HA PRO 36 51.234 69.874 -6.930 127 HB2 PRO 36 HB2 PRO 36 51.995 72.505 -7.020 128 HB3 PRO 36 HB3 PRO 36 50.810 71.777 -8.146 129 HG2 PRO 36 HG2 PRO 36 50.240 73.357 -5.615 130 HG3 PRO 36 HG3 PRO 36 49.519 73.571 -7.242 131 HD2 PRO 36 HD2 PRO 36 48.258 72.145 -5.302 132 HD3 PRO 36 HD3 PRO 36 48.193 71.636 -7.016 133 H LEU 37 H LEU 37 52.946 69.173 -5.858 134 HA LEU 37 HA LEU 37 53.938 70.553 -3.406 135 HB2 LEU 37 HB2 LEU 37 52.280 68.708 -2.939 136 HB3 LEU 37 HB3 LEU 37 53.388 67.569 -3.689 137 HG LEU 37 HG LEU 37 55.026 67.927 -1.881 138 HD11 LEU 37 HD11 LEU 37 52.987 69.909 -0.767 139 HD12 LEU 37 HD12 LEU 37 54.393 69.279 0.120 140 HD13 LEU 37 HD13 LEU 37 54.641 70.285 -1.306 141 HD21 LEU 37 HD21 LEU 37 53.244 66.254 -1.592 142 HD22 LEU 37 HD22 LEU 37 53.735 66.965 -0.047 143 HD23 LEU 37 HD23 LEU 37 52.216 67.478 -0.813 144 H SER 38 H SER 38 54.824 69.412 -6.425 145 HA SER 38 HA SER 38 57.189 67.946 -5.954 146 HB2 SER 38 HB2 SER 38 56.519 69.685 -8.356 147 HB3 SER 38 HB3 SER 38 57.705 68.365 -8.297 148 HG SER 38 HG SER 38 55.680 67.670 -9.165 149 H SER 39 H SER 39 59.307 68.423 -5.682 150 HA SER 39 HA SER 39 60.058 71.175 -4.983 151 HB2 SER 39 HB2 SER 39 62.106 70.083 -4.124 152 HB3 SER 39 HB3 SER 39 60.613 69.410 -3.451 153 HG SER 39 HG SER 39 62.105 67.763 -4.108 154 H GLU 40 H GLU 40 60.447 69.169 -7.769 155 HA GLU 40 HA GLU 40 62.924 70.383 -8.696 156 HB2 GLU 40 HB2 GLU 40 62.620 69.041 -10.703 157 HB3 GLU 40 HB3 GLU 40 62.515 68.114 -9.222 158 HG2 GLU 40 HG2 GLU 40 60.885 67.245 -10.704 159 HG3 GLU 40 HG3 GLU 40 60.036 68.057 -9.399 160 H SER 41 H SER 41 63.177 71.446 -10.773 161 HA SER 41 HA SER 41 61.143 73.597 -11.159 162 HB2 SER 41 HB2 SER 41 63.065 75.110 -11.422 163 HB3 SER 41 HB3 SER 41 63.065 74.301 -9.848 164 HG SER 41 HG SER 41 65.152 74.247 -10.816 165 H GLU 42 H GLU 42 61.522 71.105 -12.821 166 HA GLU 42 HA GLU 42 61.763 70.325 -14.879 167 HB2 GLU 42 HB2 GLU 42 61.121 73.132 -15.818 168 HB3 GLU 42 HB3 GLU 42 61.082 71.670 -16.797 169 HG2 GLU 42 HG2 GLU 42 59.353 70.697 -15.301 170 HG3 GLU 42 HG3 GLU 42 59.328 72.198 -14.364 171 H ASP 43 H ASP 43 64.162 72.516 -13.924 172 HA ASP 43 HA ASP 43 65.736 72.704 -16.235 173 HB2 ASP 43 HB2 ASP 43 65.985 74.022 -14.136 174 HB3 ASP 43 HB3 ASP 43 66.613 72.586 -13.324 175 H GLU 44 H GLU 44 65.378 70.024 -14.137 176 HA GLU 44 HA GLU 44 67.641 68.520 -15.323 177 HB2 GLU 44 HB2 GLU 44 67.260 66.858 -13.610 178 HB3 GLU 44 HB3 GLU 44 67.383 68.460 -12.890 179 HG2 GLU 44 HG2 GLU 44 64.896 68.562 -12.696 180 HG3 GLU 44 HG3 GLU 44 64.776 66.962 -13.428 181 H ILE 45 H ILE 45 64.437 68.951 -16.127 182 HA ILE 45 HA ILE 45 63.854 66.155 -16.867 183 HB ILE 45 HB ILE 45 62.177 68.652 -17.249 184 HG12 ILE 45 HG12 ILE 45 62.536 68.230 -14.863 185 HG13 ILE 45 HG13 ILE 45 60.877 67.919 -15.333 186 HG21 ILE 45 HG21 ILE 45 61.496 65.693 -17.577 187 HG22 ILE 45 HG22 ILE 45 60.301 67.006 -17.514 188 HG23 ILE 45 HG23 ILE 45 61.474 66.950 -18.829 189 HD11 ILE 45 HD11 ILE 45 62.992 65.781 -14.812 190 HD12 ILE 45 HD12 ILE 45 61.687 66.263 -13.720 191 HD13 ILE 45 HD13 ILE 45 61.294 65.474 -15.255 192 H ASN 46 H ASN 46 65.201 65.538 -18.420 193 HA ASN 46 HA ASN 46 65.377 67.092 -20.970 194 HB2 ASN 46 HB2 ASN 46 67.172 65.016 -19.653 195 HB3 ASN 46 HB3 ASN 46 67.370 65.537 -21.321 196 HD21 ASN 46 HD22 ASN 46 67.456 66.748 -17.931 197 HD22 ASN 46 HD21 ASN 46 68.442 68.141 -18.358 198 H TYR 47 H TYR 47 63.924 64.207 -19.734 199 HA TYR 47 HA TYR 47 63.138 63.328 -22.457 200 HB2 TYR 47 HB2 TYR 47 64.261 61.481 -20.310 201 HB3 TYR 47 HB3 TYR 47 63.615 60.981 -21.864 202 HD1 TYR 47 HD1 TYR 47 64.811 61.641 -24.005 203 HD2 TYR 47 HD2 TYR 47 66.545 62.207 -20.091 204 HE1 TYR 47 HE1 TYR 47 67.060 61.895 -25.038 205 HE2 TYR 47 HE2 TYR 47 68.797 62.467 -21.132 206 HH TYR 47 HH TYR 47 69.303 62.275 -24.679 207 H MET 48 H MET 48 61.256 61.956 -22.474 208 HA MET 48 HA MET 48 59.686 61.721 -19.966 209 HB2 MET 48 HB2 MET 48 59.154 63.949 -21.060 210 HB3 MET 48 HB3 MET 48 58.532 63.064 -22.446 211 HG2 MET 48 HG2 MET 48 56.727 63.759 -20.958 212 HG3 MET 48 HG3 MET 48 56.818 62.008 -21.051 213 HE1 MET 48 HE1 MET 48 57.539 65.204 -18.873 214 HE2 MET 48 HE2 MET 48 58.110 64.511 -17.340 215 HE3 MET 48 HE3 MET 48 59.136 64.423 -18.783 216 H THR 49 H THR 49 59.705 61.033 -23.502 217 HA THR 49 HA THR 49 58.535 58.333 -22.960 218 HB THR 49 HB THR 49 57.374 58.609 -25.187 219 HG1 THR 49 HG1 THR 49 57.062 60.722 -25.900 220 HG21 THR 49 HG21 THR 49 56.519 60.569 -23.019 221 HG22 THR 49 HG22 THR 49 55.496 59.840 -24.274 222 HG23 THR 49 HG23 THR 49 56.196 58.822 -23.006 223 HA PRO 50 HA PRO 50 62.515 57.878 -25.411 224 HB2 PRO 50 HB2 PRO 50 63.866 56.202 -23.721 225 HB3 PRO 50 HB3 PRO 50 63.903 57.986 -23.561 226 HG2 PRO 50 HG2 PRO 50 62.115 56.021 -22.082 227 HG3 PRO 50 HG3 PRO 50 63.127 57.330 -21.389 228 HD2 PRO 50 HD2 PRO 50 60.482 57.690 -21.877 229 HD3 PRO 50 HD3 PRO 50 61.660 59.007 -22.169 230 HA PRO 51 HA PRO 51 60.933 54.117 -27.096 231 HB2 PRO 51 HB2 PRO 51 63.070 52.997 -28.398 232 HB3 PRO 51 HB3 PRO 51 62.277 54.515 -28.923 233 HG2 PRO 51 HG2 PRO 51 64.770 54.216 -27.212 234 HG3 PRO 51 HG3 PRO 51 64.542 55.246 -28.662 235 HD2 PRO 51 HD2 PRO 51 64.279 56.252 -26.154 236 HD3 PRO 51 HD3 PRO 51 63.192 56.782 -27.472 237 H GLU 52 H GLU 52 60.636 51.948 -26.742 238 HA GLU 52 HA GLU 52 62.392 50.505 -24.802 239 HB2 GLU 52 HB2 GLU 52 60.485 49.923 -23.427 240 HB3 GLU 52 HB3 GLU 52 60.654 51.668 -23.539 241 HG2 GLU 52 HG2 GLU 52 58.820 51.773 -25.199 242 HG3 GLU 52 HG3 GLU 52 58.665 50.018 -25.165 243 H GLN 53 H GLN 53 61.574 50.196 -27.821 244 HA GLN 53 HA GLN 53 59.847 47.979 -28.034 245 HB2 GLN 53 HB2 GLN 53 60.425 49.661 -29.786 246 HB3 GLN 53 HB3 GLN 53 61.999 48.875 -29.994 247 HG2 GLN 53 HG2 GLN 53 60.868 46.798 -30.731 248 HG3 GLN 53 HG3 GLN 53 59.290 47.528 -30.416 249 HE21 GLN 53 HE22 GLN 53 59.287 46.638 -32.845 250 HE22 GLN 53 HE21 GLN 53 59.675 47.871 -34.037 251 H GLU 54 H GLU 54 63.327 47.981 -27.531 252 HA GLU 54 HA GLU 54 63.594 45.095 -28.051 253 HB2 GLU 54 HB2 GLU 54 65.291 47.036 -28.545 254 HB3 GLU 54 HB3 GLU 54 65.717 46.875 -26.844 255 HG2 GLU 54 HG2 GLU 54 67.273 45.593 -28.129 256 HG3 GLU 54 HG3 GLU 54 66.254 44.434 -27.296 257 H ALA 55 H ALA 55 62.551 46.876 -25.355 258 HA ALA 55 HA ALA 55 63.936 45.367 -23.288 259 HB1 ALA 55 HB1 ALA 55 61.743 47.461 -23.058 260 HB2 ALA 55 HB2 ALA 55 62.813 46.887 -21.766 261 HB3 ALA 55 HB3 ALA 55 63.491 47.797 -23.127 262 H GLN 56 H GLN 56 62.578 43.530 -24.803 263 HA GLN 56 HA GLN 56 60.693 42.319 -22.894 264 HB2 GLN 56 HB2 GLN 56 59.324 43.845 -24.364 265 HB3 GLN 56 HB3 GLN 56 59.785 42.867 -25.755 266 HG2 GLN 56 HG2 GLN 56 58.714 40.872 -24.655 267 HG3 GLN 56 HG3 GLN 56 58.287 41.884 -23.273 268 HE21 GLN 56 HE22 GLN 56 56.722 43.721 -23.684 269 HE22 GLN 56 HE21 GLN 56 55.588 43.536 -25.014 270 HA PRO 57 HA PRO 57 63.640 39.661 -25.297 271 HB2 PRO 57 HB2 PRO 57 65.267 38.706 -23.368 272 HB3 PRO 57 HB3 PRO 57 65.337 40.411 -23.931 273 HG2 PRO 57 HG2 PRO 57 63.851 39.342 -21.497 274 HG3 PRO 57 HG3 PRO 57 65.050 40.676 -21.552 275 HD2 PRO 57 HD2 PRO 57 62.367 41.152 -21.705 276 HD3 PRO 57 HD3 PRO 57 63.550 42.118 -22.635 277 H GLY 58 H GLY 58 61.430 38.802 -22.727 278 HA2 GLY 58 HA2 GLY 58 60.070 36.973 -22.480 279 HA3 GLY 58 HA3 GLY 58 60.604 36.429 -24.070 280 H ALA 59 H ALA 59 62.972 36.811 -21.478 281 HA ALA 59 HA ALA 59 63.039 33.917 -20.895 282 HB1 ALA 59 HB1 ALA 59 65.370 35.484 -22.086 283 HB2 ALA 59 HB2 ALA 59 65.436 33.804 -21.505 284 HB3 ALA 59 HB3 ALA 59 64.434 34.218 -22.907 285 H LEU 60 H LEU 60 64.261 33.354 -19.112 286 HA LEU 60 HA LEU 60 65.011 35.478 -17.168 287 HB2 LEU 60 HB2 LEU 60 63.946 34.383 -15.451 288 HB3 LEU 60 HB3 LEU 60 62.783 34.328 -16.755 289 HG LEU 60 HG LEU 60 64.538 32.017 -15.784 290 HD11 LEU 60 HD11 LEU 60 61.544 32.507 -15.545 291 HD12 LEU 60 HD12 LEU 60 62.430 31.082 -14.955 292 HD13 LEU 60 HD13 LEU 60 62.733 32.670 -14.234 293 HD21 LEU 60 HD21 LEU 60 64.099 31.634 -18.149 294 HD22 LEU 60 HD22 LEU 60 63.059 30.579 -17.200 295 HD23 LEU 60 HD23 LEU 60 62.375 32.044 -17.934 296 H ALA 61 H ALA 61 66.385 34.521 -15.309 297 HA ALA 61 HA ALA 61 68.316 32.521 -16.317 298 HB1 ALA 61 HB1 ALA 61 69.007 35.202 -15.060 299 HB2 ALA 61 HB2 ALA 61 70.165 33.920 -15.471 300 HB3 ALA 61 HB3 ALA 61 69.256 34.735 -16.757 301 H ALA 62 H ALA 62 69.099 31.104 -14.911 302 HA ALA 62 HA ALA 62 68.384 31.230 -12.026 303 HB1 ALA 62 HB1 ALA 62 69.604 28.999 -13.703 304 HB2 ALA 62 HB2 ALA 62 69.144 28.890 -11.992 305 HB3 ALA 62 HB3 ALA 62 67.897 29.133 -13.228 306 H LEU 63 H LEU 63 70.141 30.626 -10.498 307 HA LEU 63 HA LEU 63 72.837 31.671 -11.226 308 HB2 LEU 63 HB2 LEU 63 71.116 32.539 -8.864 309 HB3 LEU 63 HB3 LEU 63 72.809 32.967 -9.075 310 HG LEU 63 HG LEU 63 70.562 33.829 -10.954 311 HD11 LEU 63 HD11 LEU 63 72.104 35.365 -8.823 312 HD12 LEU 63 HD12 LEU 63 70.897 36.044 -9.939 313 HD13 LEU 63 HD13 LEU 63 70.404 34.859 -8.718 314 HD21 LEU 63 HD21 LEU 63 72.740 33.731 -12.109 315 HD22 LEU 63 HD22 LEU 63 72.277 35.414 -11.812 316 HD23 LEU 63 HD23 LEU 63 73.498 34.635 -10.791 317 H HIS 64 H HIS 64 74.515 31.115 -9.788 318 HA HIS 64 HA HIS 64 74.145 28.701 -8.090 319 HB2 HIS 64 HB2 HIS 64 76.502 30.387 -8.928 320 HB3 HIS 64 HB3 HIS 64 76.642 29.180 -7.659 321 HD2 HIS 64 HD2 HIS 64 76.984 29.617 -11.308 322 HE1 HIS 64 HE1 HIS 64 76.706 25.400 -10.767 323 HE2 HIS 64 HE2 HIS 64 77.334 27.236 -12.396 324 H ALA 65 H ALA 65 74.241 28.764 -5.848 325 HA ALA 65 HA ALA 65 73.767 31.438 -4.622 326 HB1 ALA 65 HB1 ALA 65 72.914 28.655 -3.742 327 HB2 ALA 65 HB2 ALA 65 72.422 30.197 -3.008 328 HB3 ALA 65 HB3 ALA 65 71.919 29.809 -4.663 329 H GLU 66 H GLU 66 76.311 29.223 -4.709 330 HA GLU 66 HA GLU 66 77.489 30.253 -2.203 331 HB2 GLU 66 HB2 GLU 66 77.982 28.047 -1.328 332 HB3 GLU 66 HB3 GLU 66 76.246 28.270 -1.488 333 HG2 GLU 66 HG2 GLU 66 76.267 26.926 -3.591 334 HG3 GLU 66 HG3 GLU 66 78.010 26.697 -3.419 335 H GLY 67 H GLY 67 79.776 29.588 -1.915 336 HA2 GLY 67 HA2 GLY 67 81.953 29.349 -2.656 337 HA3 GLY 67 HA3 GLY 67 81.323 28.524 -4.078 338 HA PRO 68 HA PRO 68 83.265 32.566 -5.352 339 HB2 PRO 68 HB2 PRO 68 84.639 31.674 -7.553 340 HB3 PRO 68 HB3 PRO 68 85.239 31.503 -5.876 341 HG2 PRO 68 HG2 PRO 68 83.741 29.441 -7.530 342 HG3 PRO 68 HG3 PRO 68 85.273 29.226 -6.620 343 HD2 PRO 68 HD2 PRO 68 82.898 28.500 -5.556 344 HD3 PRO 68 HD3 PRO 68 84.146 29.276 -4.534 345 H LEU 69 H LEU 69 81.105 30.358 -6.952 346 HA LEU 69 HA LEU 69 80.389 32.310 -9.060 347 HB2 LEU 69 HB2 LEU 69 79.579 29.442 -8.549 348 HB3 LEU 69 HB3 LEU 69 78.834 30.438 -9.792 349 HG LEU 69 HG LEU 69 81.820 29.885 -9.715 350 HD11 LEU 69 HD11 LEU 69 79.652 28.539 -11.362 351 HD12 LEU 69 HD12 LEU 69 81.402 28.237 -11.460 352 HD13 LEU 69 HD13 LEU 69 80.513 27.802 -9.995 353 HD21 LEU 69 HD21 LEU 69 81.260 31.889 -11.022 354 HD22 LEU 69 HD22 LEU 69 81.706 30.571 -12.104 355 HD23 LEU 69 HD23 LEU 69 79.996 30.990 -11.899 356 H ALA 70 H ALA 70 79.535 32.228 -5.850 357 HA ALA 70 HA ALA 70 76.719 32.215 -5.931 358 HB1 ALA 70 HB1 ALA 70 78.576 33.807 -4.107 359 HB2 ALA 70 HB2 ALA 70 76.862 33.451 -3.796 360 HB3 ALA 70 HB3 ALA 70 78.046 32.132 -3.855 361 H GLY 71 H GLY 71 75.398 33.376 -7.105 362 HA2 GLY 71 HA2 GLY 71 74.287 35.335 -7.839 363 HA3 GLY 71 HA3 GLY 71 75.705 36.313 -7.484 364 H LEU 72 H LEU 72 76.609 33.523 -9.260 365 HA LEU 72 HA LEU 72 76.567 34.963 -11.861 366 HB2 LEU 72 HB2 LEU 72 78.570 32.967 -10.694 367 HB3 LEU 72 HB3 LEU 72 78.587 33.470 -12.335 368 HG LEU 72 HG LEU 72 78.540 35.933 -11.282 369 HD11 LEU 72 HD11 LEU 72 80.144 34.435 -9.184 370 HD12 LEU 72 HD12 LEU 72 79.921 36.181 -9.328 371 HD13 LEU 72 HD13 LEU 72 78.557 35.159 -8.893 372 HD21 LEU 72 HD21 LEU 72 80.277 35.097 -12.801 373 HD22 LEU 72 HD22 LEU 72 81.006 35.987 -11.467 374 HD23 LEU 72 HD23 LEU 72 81.047 34.211 -11.469 375 HA PRO 73 HA PRO 73 73.876 32.202 -13.806 376 HB2 PRO 73 HB2 PRO 73 75.079 31.604 -16.261 377 HB3 PRO 73 HB3 PRO 73 74.295 33.152 -15.856 378 HG2 PRO 73 HG2 PRO 73 77.226 32.423 -15.730 379 HG3 PRO 73 HG3 PRO 73 76.487 33.900 -16.420 380 HD2 PRO 73 HD2 PRO 73 77.551 33.929 -13.988 381 HD3 PRO 73 HD3 PRO 73 76.024 34.787 -14.279 382 H VAL 74 H VAL 74 73.366 30.017 -14.584 383 HA VAL 74 HA VAL 74 75.454 27.977 -13.921 384 HB VAL 74 HB VAL 74 72.486 27.488 -14.200 385 HG11 VAL 74 HG11 VAL 74 74.725 25.913 -12.870 386 HG12 VAL 74 HG12 VAL 74 73.002 25.486 -12.856 387 HG13 VAL 74 HG13 VAL 74 73.888 25.483 -14.379 388 HG21 VAL 74 HG21 VAL 74 72.721 29.066 -12.343 389 HG22 VAL 74 HG22 VAL 74 72.407 27.454 -11.710 390 HG23 VAL 74 HG23 VAL 74 74.056 28.109 -11.660 391 H THR 75 H THR 75 73.245 29.081 -16.497 392 HA THR 75 HA THR 75 74.616 27.238 -18.429 393 HB THR 75 HB THR 75 72.588 27.043 -19.651 394 HG1 THR 75 HG1 THR 75 70.677 28.099 -18.666 395 HG21 THR 75 HG21 THR 75 71.821 26.766 -16.728 396 HG22 THR 75 HG22 THR 75 71.209 25.841 -18.121 397 HG23 THR 75 HG23 THR 75 72.894 25.638 -17.591 398 H ARG 76 H ARG 76 74.403 27.872 -20.762 399 HA ARG 76 HA ARG 76 75.531 30.457 -21.328 400 HB2 ARG 76 HB2 ARG 76 75.849 28.543 -22.801 401 HB3 ARG 76 HB3 ARG 76 74.109 28.372 -23.055 402 HG2 ARG 76 HG2 ARG 76 74.042 30.533 -24.253 403 HG3 ARG 76 HG3 ARG 76 75.781 30.750 -23.997 404 HD2 ARG 76 HD2 ARG 76 74.599 28.320 -25.414 405 HD3 ARG 76 HD3 ARG 76 74.949 29.807 -26.272 406 HE ARG 76 HE ARG 76 76.913 27.914 -25.101 407 HH11 ARG 76 HH11 ARG 76 76.510 30.974 -26.854 408 HH12 ARG 76 HH12 ARG 76 78.202 30.907 -27.366 409 HH21 ARG 76 HH21 ARG 76 79.065 28.071 -25.867 410 HH22 ARG 76 HH22 ARG 76 79.466 29.477 -26.863 411 H SER 77 H SER 77 72.171 29.258 -21.512 412 HA SER 77 HA SER 77 70.927 31.657 -22.396 413 HB2 SER 77 HB2 SER 77 69.798 29.549 -20.512 414 HB3 SER 77 HB3 SER 77 68.875 30.729 -21.465 415 HG SER 77 HG SER 77 68.991 28.670 -22.514 416 H ASP 78 H ASP 78 71.626 30.512 -19.007 417 HA ASP 78 HA ASP 78 70.561 32.822 -17.715 418 HB2 ASP 78 HB2 ASP 78 72.958 31.157 -16.880 419 HB3 ASP 78 HB3 ASP 78 72.084 32.294 -15.861 420 H ALA 79 H ALA 79 73.941 32.174 -18.826 421 HA ALA 79 HA ALA 79 75.019 34.644 -17.976 422 HB1 ALA 79 HB1 ALA 79 75.875 32.758 -20.225 423 HB2 ALA 79 HB2 ALA 79 76.875 34.041 -19.524 424 HB3 ALA 79 HB3 ALA 79 76.380 32.666 -18.520 425 H ARG 80 H ARG 80 73.611 33.853 -21.215 426 HA ARG 80 HA ARG 80 74.129 36.496 -22.274 427 HB2 ARG 80 HB2 ARG 80 73.771 34.402 -23.610 428 HB3 ARG 80 HB3 ARG 80 72.047 34.472 -23.212 429 HG2 ARG 80 HG2 ARG 80 71.864 36.675 -24.336 430 HG3 ARG 80 HG3 ARG 80 73.616 36.686 -24.626 431 HD2 ARG 80 HD2 ARG 80 73.396 34.672 -26.044 432 HD3 ARG 80 HD3 ARG 80 71.639 34.670 -25.769 433 HE ARG 80 HE ARG 80 72.269 37.232 -26.739 434 HH11 ARG 80 HH11 ARG 80 72.401 33.974 -28.033 435 HH12 ARG 80 HH12 ARG 80 72.247 34.522 -29.678 436 HH21 ARG 80 HH21 ARG 80 72.084 37.865 -28.870 437 HH22 ARG 80 HH22 ARG 80 72.062 36.669 -30.129 438 H VAL 81 H VAL 81 71.222 35.130 -20.673 439 HA VAL 81 HA VAL 81 69.612 37.524 -20.945 440 HB VAL 81 HB VAL 81 69.528 35.242 -18.940 441 HG11 VAL 81 HG11 VAL 81 67.535 37.526 -19.338 442 HG12 VAL 81 HG12 VAL 81 67.184 36.028 -18.456 443 HG13 VAL 81 HG13 VAL 81 68.414 37.131 -17.842 444 HG21 VAL 81 HG21 VAL 81 69.020 34.744 -21.340 445 HG22 VAL 81 HG22 VAL 81 67.643 34.492 -20.260 446 HG23 VAL 81 HG23 VAL 81 67.724 35.950 -21.289 447 H LEU 82 H LEU 82 71.819 36.431 -18.356 448 HA LEU 82 HA LEU 82 71.446 38.773 -16.716 449 HB2 LEU 82 HB2 LEU 82 73.754 36.816 -16.920 450 HB3 LEU 82 HB3 LEU 82 73.698 38.109 -15.725 451 HG LEU 82 HG LEU 82 71.568 35.945 -15.944 452 HD11 LEU 82 HD11 LEU 82 73.766 36.189 -13.860 453 HD12 LEU 82 HD12 LEU 82 72.641 34.830 -14.155 454 HD13 LEU 82 HD13 LEU 82 73.919 35.199 -15.321 455 HD21 LEU 82 HD21 LEU 82 70.679 37.934 -14.839 456 HD22 LEU 82 HD22 LEU 82 70.967 36.661 -13.651 457 HD23 LEU 82 HD23 LEU 82 72.110 38.017 -13.784 458 H ILE 83 H ILE 83 73.923 38.167 -19.286 459 HA ILE 83 HA ILE 83 75.194 40.714 -19.167 460 HB ILE 83 HB ILE 83 74.615 38.833 -21.471 461 HG12 ILE 83 HG12 ILE 83 77.266 39.705 -20.252 462 HG13 ILE 83 HG13 ILE 83 76.339 38.357 -19.606 463 HG21 ILE 83 HG21 ILE 83 76.142 41.477 -21.649 464 HG22 ILE 83 HG22 ILE 83 76.138 40.218 -22.897 465 HG23 ILE 83 HG23 ILE 83 74.655 41.073 -22.528 466 HD11 ILE 83 HD11 ILE 83 77.528 38.514 -22.405 467 HD12 ILE 83 HD12 ILE 83 78.042 37.478 -21.068 468 HD13 ILE 83 HD13 ILE 83 76.463 37.211 -21.826 469 H PHE 84 H PHE 84 72.235 39.781 -21.018 470 HA PHE 84 HA PHE 84 71.752 42.389 -22.005 471 HB2 PHE 84 HB2 PHE 84 70.769 40.195 -22.823 472 HB3 PHE 84 HB3 PHE 84 69.663 40.244 -21.461 473 HD1 PHE 84 HD1 PHE 84 70.912 42.497 -24.228 474 HD2 PHE 84 HD2 PHE 84 67.537 41.261 -21.836 475 HE1 PHE 84 HE1 PHE 84 69.451 43.871 -25.616 476 HE2 PHE 84 HE2 PHE 84 66.061 42.735 -23.196 477 HZ PHE 84 HZ PHE 84 66.999 44.026 -25.097 478 H ASN 85 H ASN 85 70.347 40.833 -19.076 479 HA ASN 85 HA ASN 85 68.638 43.042 -18.439 480 HB2 ASN 85 HB2 ASN 85 68.241 40.711 -17.718 481 HB3 ASN 85 HB3 ASN 85 69.699 40.754 -16.722 482 HD21 ASN 85 HD22 ASN 85 66.448 42.255 -17.114 483 HD22 ASN 85 HD21 ASN 85 66.329 42.719 -15.427 484 H GLU 86 H GLU 86 71.912 42.146 -17.155 485 HA GLU 86 HA GLU 86 72.091 44.414 -15.375 486 HB2 GLU 86 HB2 GLU 86 74.195 42.676 -16.720 487 HB3 GLU 86 HB3 GLU 86 74.628 44.081 -15.764 488 HG2 GLU 86 HG2 GLU 86 72.976 41.754 -14.705 489 HG3 GLU 86 HG3 GLU 86 74.712 41.952 -14.477 490 H TRP 87 H TRP 87 73.280 43.995 -18.826 491 HA TRP 87 HA TRP 87 74.185 46.670 -19.060 492 HB2 TRP 87 HB2 TRP 87 74.745 45.036 -20.722 493 HB3 TRP 87 HB3 TRP 87 73.048 44.710 -21.054 494 HD1 TRP 87 HD1 TRP 87 75.585 47.586 -21.527 495 HE1 TRP 87 HE1 TRP 87 75.000 48.724 -23.782 496 HE3 TRP 87 HE3 TRP 87 71.180 45.187 -22.586 497 HZ2 TRP 87 HZ2 TRP 87 72.945 48.604 -25.751 498 HZ3 TRP 87 HZ3 TRP 87 70.012 45.662 -24.673 499 HH2 TRP 87 HH2 TRP 87 70.837 47.372 -26.280 500 H GLU 88 H GLU 88 70.865 45.377 -19.767 501 HA GLU 88 HA GLU 88 69.653 47.753 -20.620 502 HB2 GLU 88 HB2 GLU 88 68.724 45.261 -19.208 503 HB3 GLU 88 HB3 GLU 88 67.637 46.623 -19.232 504 HG2 GLU 88 HG2 GLU 88 68.870 45.706 -21.832 505 HG3 GLU 88 HG3 GLU 88 67.510 44.833 -21.124 506 H GLU 89 H GLU 89 69.781 46.627 -17.143 507 HA GLU 89 HA GLU 89 68.530 49.127 -16.325 508 HB2 GLU 89 HB2 GLU 89 69.914 47.027 -14.625 509 HB3 GLU 89 HB3 GLU 89 68.887 48.336 -14.038 510 HG2 GLU 89 HG2 GLU 89 68.048 45.980 -15.771 511 HG3 GLU 89 HG3 GLU 89 67.599 46.284 -14.100 512 H ARG 90 H ARG 90 71.908 47.982 -16.195 513 HA ARG 90 HA ARG 90 73.043 50.281 -14.871 514 HB2 ARG 90 HB2 ARG 90 74.279 48.528 -17.042 515 HB3 ARG 90 HB3 ARG 90 75.169 49.626 -15.988 516 HG2 ARG 90 HG2 ARG 90 73.502 47.368 -14.865 517 HG3 ARG 90 HG3 ARG 90 75.135 47.095 -15.471 518 HD2 ARG 90 HD2 ARG 90 76.015 48.658 -13.779 519 HD3 ARG 90 HD3 ARG 90 74.358 48.990 -13.216 520 HE ARG 90 HE ARG 90 74.762 46.161 -13.184 521 HH11 ARG 90 HH11 ARG 90 75.923 48.888 -11.288 522 HH12 ARG 90 HH12 ARG 90 76.147 47.879 -9.882 523 HH21 ARG 90 HH21 ARG 90 75.030 45.029 -11.534 524 HH22 ARG 90 HH22 ARG 90 75.647 45.663 -10.001 525 H LYS 91 H LYS 91 72.488 49.596 -18.323 526 HA LYS 91 HA LYS 91 73.432 52.175 -19.179 527 HB2 LYS 91 HB2 LYS 91 73.305 50.101 -20.602 528 HB3 LYS 91 HB3 LYS 91 71.561 50.270 -20.690 529 HG2 LYS 91 HG2 LYS 91 73.313 52.551 -21.634 530 HG3 LYS 91 HG3 LYS 91 73.212 51.085 -22.602 531 HD2 LYS 91 HD2 LYS 91 70.735 51.284 -22.695 532 HD3 LYS 91 HD3 LYS 91 70.836 52.833 -21.833 533 HE2 LYS 91 HE2 LYS 91 72.290 53.737 -23.648 534 HE3 LYS 91 HE3 LYS 91 72.205 52.188 -24.490 535 HZ1 LYS 91 HZ1 LYS 91 69.856 53.952 -23.947 536 HZ2 LYS 91 HZ2 LYS 91 70.591 53.772 -25.393 537 HZ3 LYS 91 HZ3 LYS 91 69.790 52.516 -24.734 538 H LYS 92 H LYS 92 70.114 51.142 -18.304 539 HA LYS 92 HA LYS 92 68.883 53.679 -18.961 540 HB2 LYS 92 HB2 LYS 92 68.231 51.570 -16.879 541 HB3 LYS 92 HB3 LYS 92 67.242 53.014 -17.115 542 HG2 LYS 92 HG2 LYS 92 66.617 52.414 -19.325 543 HG3 LYS 92 HG3 LYS 92 67.918 51.244 -19.479 544 HD2 LYS 92 HD2 LYS 92 66.747 49.953 -17.541 545 HD3 LYS 92 HD3 LYS 92 65.333 50.965 -17.911 546 HE2 LYS 92 HE2 LYS 92 65.399 50.168 -20.268 547 HE3 LYS 92 HE3 LYS 92 66.898 49.294 -19.931 548 HZ1 LYS 92 HZ1 LYS 92 64.217 48.632 -18.864 549 HZ2 LYS 92 HZ2 LYS 92 65.204 47.719 -19.833 550 HZ3 LYS 92 HZ3 LYS 92 65.596 47.985 -18.246 551 H SER 93 H SER 93 70.822 52.702 -16.099 552 HA SER 93 HA SER 93 70.729 55.450 -15.039 553 HB2 SER 93 HB2 SER 93 72.532 53.114 -14.341 554 HB3 SER 93 HB3 SER 93 72.501 54.677 -13.508 555 HG SER 93 HG SER 93 71.149 53.115 -12.471 556 H GLU 94 H GLU 94 72.794 53.820 -17.344 557 HA GLU 94 HA GLU 94 74.714 56.109 -17.523 558 HB2 GLU 94 HB2 GLU 94 75.379 53.139 -17.505 559 HB3 GLU 94 HB3 GLU 94 76.505 54.476 -17.637 560 HG2 GLU 94 HG2 GLU 94 75.747 55.211 -15.331 561 HG3 GLU 94 HG3 GLU 94 74.788 53.720 -15.267 562 HA PRO 95 HA PRO 95 72.784 54.861 -21.544 563 HB2 PRO 95 HB2 PRO 95 72.892 57.326 -22.861 564 HB3 PRO 95 HB3 PRO 95 71.595 56.764 -21.767 565 HG2 PRO 95 HG2 PRO 95 74.002 58.479 -21.085 566 HG3 PRO 95 HG3 PRO 95 72.282 58.753 -20.649 567 HD2 PRO 95 HD2 PRO 95 73.956 57.641 -18.872 568 HD3 PRO 95 HD3 PRO 95 72.315 56.963 -19.068 569 H TRP 96 H TRP 96 75.982 55.675 -20.984 570 HA TRP 96 HA TRP 96 76.972 55.408 -23.753 571 HB2 TRP 96 HB2 TRP 96 79.172 55.797 -22.622 572 HB3 TRP 96 HB3 TRP 96 77.999 57.082 -22.428 573 HD1 TRP 96 HD1 TRP 96 79.727 54.318 -20.421 574 HE1 TRP 96 HE1 TRP 96 79.519 54.820 -17.903 575 HE3 TRP 96 HE3 TRP 96 76.556 58.339 -20.651 576 HZ2 TRP 96 HZ2 TRP 96 78.139 56.707 -16.216 577 HZ3 TRP 96 HZ3 TRP 96 75.793 59.457 -18.567 578 HH2 TRP 96 HH2 TRP 96 76.570 58.648 -16.350 579 H LEU 97 H LEU 97 76.029 53.121 -21.400 580 HA LEU 97 HA LEU 97 78.097 51.294 -21.299 581 HB2 LEU 97 HB2 LEU 97 75.406 51.467 -20.502 582 HB3 LEU 97 HB3 LEU 97 75.388 50.125 -21.593 583 HG LEU 97 HG LEU 97 75.610 49.114 -19.597 584 HD11 LEU 97 HD11 LEU 97 78.597 49.484 -20.084 585 HD12 LEU 97 HD12 LEU 97 77.792 48.163 -19.230 586 HD13 LEU 97 HD13 LEU 97 77.571 48.325 -20.966 587 HD21 LEU 97 HD21 LEU 97 75.802 51.042 -18.222 588 HD22 LEU 97 HD22 LEU 97 77.005 49.846 -17.725 589 HD23 LEU 97 HD23 LEU 97 77.510 51.269 -18.673 590 H ARG 98 H ARG 98 78.812 49.521 -22.508 591 HA ARG 98 HA ARG 98 77.751 49.151 -25.287 592 HB2 ARG 98 HB2 ARG 98 80.473 48.418 -24.126 593 HB3 ARG 98 HB3 ARG 98 79.902 48.020 -25.738 594 HG2 ARG 98 HG2 ARG 98 81.124 49.881 -26.222 595 HG3 ARG 98 HG3 ARG 98 79.521 50.578 -26.053 596 HD2 ARG 98 HD2 ARG 98 81.087 52.037 -24.956 597 HD3 ARG 98 HD3 ARG 98 80.136 51.274 -23.703 598 HE ARG 98 HE ARG 98 82.008 50.112 -22.932 599 HH11 ARG 98 HH11 ARG 98 82.918 51.695 -25.931 600 HH12 ARG 98 HH12 ARG 98 84.613 51.388 -25.679 601 HH21 ARG 98 HH21 ARG 98 84.180 49.745 -22.687 602 HH22 ARG 98 HH22 ARG 98 85.302 50.313 -23.887 603 H LEU 99 H LEU 99 77.550 47.047 -26.150 604 HA LEU 99 HA LEU 99 76.841 44.924 -24.162 605 HB2 LEU 99 HB2 LEU 99 74.968 46.301 -24.984 606 HB3 LEU 99 HB3 LEU 99 75.299 45.857 -26.621 607 HG LEU 99 HG LEU 99 73.322 44.757 -25.506 608 HD11 LEU 99 HD11 LEU 99 75.310 42.650 -26.380 609 HD12 LEU 99 HD12 LEU 99 73.563 42.767 -26.707 610 HD13 LEU 99 HD13 LEU 99 74.667 43.852 -27.514 611 HD21 LEU 99 HD21 LEU 99 74.588 44.413 -23.297 612 HD22 LEU 99 HD22 LEU 99 73.330 43.326 -23.833 613 HD23 LEU 99 HD23 LEU 99 75.063 42.866 -24.023 614 H ASP 100 H ASP 100 77.760 42.981 -24.588 615 HA ASP 100 HA ASP 100 78.445 42.195 -27.365 616 HB2 ASP 100 HB2 ASP 100 80.445 43.300 -26.381 617 HB3 ASP 100 HB3 ASP 100 80.421 42.138 -25.053 618 H MET 101 H MET 101 77.906 40.159 -27.764 619 HA MET 101 HA MET 101 77.457 38.221 -25.533 620 HB2 MET 101 HB2 MET 101 75.613 38.768 -27.892 621 HB3 MET 101 HB3 MET 101 75.420 37.441 -26.738 622 HG2 MET 101 HG2 MET 101 75.141 39.019 -24.890 623 HG3 MET 101 HG3 MET 101 75.385 40.386 -25.984 624 HE1 MET 101 HE1 MET 101 73.020 41.550 -25.140 625 HE2 MET 101 HE2 MET 101 71.558 40.554 -25.027 626 HE3 MET 101 HE3 MET 101 72.961 40.168 -24.010 627 H SER 102 H SER 102 79.538 38.709 -27.930 628 HA SER 102 HA SER 102 79.506 36.156 -29.334 629 HB2 SER 102 HB2 SER 102 81.703 38.212 -28.894 630 HB3 SER 102 HB3 SER 102 81.867 36.763 -29.902 631 HG SER 102 HG SER 102 81.229 38.652 -31.110 632 H ASP 103 H ASP 103 80.949 34.378 -29.007 633 HA ASP 103 HA ASP 103 80.647 33.341 -26.483 634 HB2 ASP 103 HB2 ASP 103 82.627 32.530 -28.660 635 HB3 ASP 103 HB3 ASP 103 82.271 31.548 -27.242 636 H LYS 104 H LYS 104 83.592 34.974 -27.632 637 HA LYS 104 HA LYS 104 85.340 34.292 -25.478 638 HB2 LYS 104 HB2 LYS 104 85.246 36.880 -27.099 639 HB3 LYS 104 HB3 LYS 104 86.611 36.295 -26.158 640 HG2 LYS 104 HG2 LYS 104 85.478 35.014 -28.679 641 HG3 LYS 104 HG3 LYS 104 86.973 35.931 -28.522 642 HD2 LYS 104 HD2 LYS 104 87.860 34.156 -26.959 643 HD3 LYS 104 HD3 LYS 104 86.366 33.245 -27.215 644 HE2 LYS 104 HE2 LYS 104 87.978 32.261 -28.638 645 HE3 LYS 104 HE3 LYS 104 86.851 33.144 -29.667 646 HZ1 LYS 104 HZ1 LYS 104 89.545 34.134 -28.841 647 HZ2 LYS 104 HZ2 LYS 104 89.185 33.513 -30.304 648 HZ3 LYS 104 HZ3 LYS 104 88.523 34.929 -29.847 649 H ALA 105 H ALA 105 82.851 36.834 -25.645 650 HA ALA 105 HA ALA 105 83.482 38.096 -23.124 651 HB1 ALA 105 HB1 ALA 105 80.822 37.920 -24.580 652 HB2 ALA 105 HB2 ALA 105 81.263 39.060 -23.299 653 HB3 ALA 105 HB3 ALA 105 82.081 39.139 -24.870 654 H ILE 106 H ILE 106 81.584 35.243 -23.987 655 HA ILE 106 HA ILE 106 80.392 35.003 -21.358 656 HB ILE 106 HB ILE 106 80.557 32.707 -23.311 657 HG12 ILE 106 HG12 ILE 106 79.956 34.371 -24.841 658 HG13 ILE 106 HG13 ILE 106 78.472 33.546 -24.417 659 HG21 ILE 106 HG21 ILE 106 78.356 33.691 -21.445 660 HG22 ILE 106 HG22 ILE 106 78.324 32.210 -22.425 661 HG23 ILE 106 HG23 ILE 106 79.492 32.364 -21.105 662 HD11 ILE 106 HD11 ILE 106 79.367 36.330 -23.535 663 HD12 ILE 106 HD12 ILE 106 78.121 35.896 -24.702 664 HD13 ILE 106 HD13 ILE 106 77.873 35.513 -22.979 665 H PHE 107 H PHE 107 83.081 33.312 -23.059 666 HA PHE 107 HA PHE 107 83.888 31.634 -20.899 667 HB2 PHE 107 HB2 PHE 107 85.710 33.036 -22.886 668 HB3 PHE 107 HB3 PHE 107 86.049 31.558 -22.009 669 HD1 PHE 107 HD1 PHE 107 83.058 30.410 -22.720 670 HD2 PHE 107 HD2 PHE 107 86.384 32.052 -24.917 671 HE1 PHE 107 HE1 PHE 107 82.390 29.090 -24.707 672 HE2 PHE 107 HE2 PHE 107 85.719 30.702 -26.916 673 HZ PHE 107 HZ PHE 107 83.724 29.221 -26.802 674 H ARG 108 H ARG 108 84.965 34.975 -21.726 675 HA ARG 108 HA ARG 108 86.867 35.110 -19.611 676 HB2 ARG 108 HB2 ARG 108 86.848 36.195 -21.860 677 HB3 ARG 108 HB3 ARG 108 85.637 37.345 -21.292 678 HG2 ARG 108 HG2 ARG 108 88.302 36.943 -19.882 679 HG3 ARG 108 HG3 ARG 108 88.193 37.933 -21.331 680 HD2 ARG 108 HD2 ARG 108 86.626 38.482 -18.779 681 HD3 ARG 108 HD3 ARG 108 88.149 39.254 -19.230 682 HE ARG 108 HE ARG 108 86.479 39.666 -21.423 683 HH11 ARG 108 HH11 ARG 108 86.447 40.644 -18.058 684 HH12 ARG 108 HH12 ARG 108 85.575 42.114 -18.394 685 HH21 ARG 108 HH21 ARG 108 85.358 41.556 -21.787 686 HH22 ARG 108 HH22 ARG 108 84.982 42.613 -20.462 687 H ARG 109 H ARG 109 83.486 36.255 -19.771 688 HA ARG 109 HA ARG 109 83.525 37.386 -17.053 689 HB2 ARG 109 HB2 ARG 109 81.258 36.550 -18.910 690 HB3 ARG 109 HB3 ARG 109 81.023 37.294 -17.325 691 HG2 ARG 109 HG2 ARG 109 82.133 39.340 -18.009 692 HG3 ARG 109 HG3 ARG 109 82.630 38.628 -19.546 693 HD2 ARG 109 HD2 ARG 109 80.727 40.027 -19.992 694 HD3 ARG 109 HD3 ARG 109 80.235 38.354 -20.184 695 HE ARG 109 HE ARG 109 78.960 38.451 -18.170 696 HH11 ARG 109 HH11 ARG 109 80.446 41.581 -18.728 697 HH12 ARG 109 HH12 ARG 109 79.354 42.391 -17.643 698 HH21 ARG 109 HH21 ARG 109 77.618 39.524 -16.812 699 HH22 ARG 109 HH22 ARG 109 77.793 41.242 -16.566 700 H TYR 110 H TYR 110 82.576 34.255 -18.449 701 HA TYR 110 HA TYR 110 82.128 33.126 -15.719 702 HB2 TYR 110 HB2 TYR 110 80.541 32.527 -18.229 703 HB3 TYR 110 HB3 TYR 110 80.216 31.987 -16.596 704 HD1 TYR 110 HD1 TYR 110 80.061 34.035 -14.806 705 HD2 TYR 110 HD2 TYR 110 79.250 34.275 -19.030 706 HE1 TYR 110 HE1 TYR 110 78.761 36.144 -14.445 707 HE2 TYR 110 HE2 TYR 110 77.864 36.324 -18.655 708 HH TYR 110 HH TYR 110 77.419 37.735 -15.386 709 HA PRO 111 HA PRO 111 85.362 30.708 -18.006 710 HB2 PRO 111 HB2 PRO 111 87.016 30.122 -15.886 711 HB3 PRO 111 HB3 PRO 111 87.047 31.669 -16.784 712 HG2 PRO 111 HG2 PRO 111 85.593 31.055 -14.188 713 HG3 PRO 111 HG3 PRO 111 86.678 32.439 -14.547 714 HD2 PRO 111 HD2 PRO 111 83.998 32.696 -14.714 715 HD3 PRO 111 HD3 PRO 111 85.052 33.465 -15.941 716 H HIS 112 H HIS 112 83.264 29.832 -15.358 717 HA HIS 112 HA HIS 112 83.795 26.969 -15.411 718 HB2 HIS 112 HB2 HIS 112 81.990 26.823 -13.914 719 HB3 HIS 112 HB3 HIS 112 82.808 28.321 -13.492 720 HD2 HIS 112 HD2 HIS 112 79.479 27.015 -13.820 721 HE1 HIS 112 HE1 HIS 112 78.864 31.035 -15.044 722 HE2 HIS 112 HE2 HIS 112 77.752 29.003 -14.159 723 H LEU 113 H LEU 113 81.891 29.154 -17.372 724 HA LEU 113 HA LEU 113 80.011 27.178 -18.299 725 HB2 LEU 113 HB2 LEU 113 80.034 29.888 -17.814 726 HB3 LEU 113 HB3 LEU 113 80.308 29.896 -19.537 727 HG LEU 113 HG LEU 113 77.995 30.231 -18.945 728 HD11 LEU 113 HD11 LEU 113 78.245 27.439 -20.129 729 HD12 LEU 113 HD12 LEU 113 76.970 28.623 -20.425 730 HD13 LEU 113 HD13 LEU 113 78.601 28.936 -21.027 731 HD21 LEU 113 HD21 LEU 113 77.928 29.012 -16.821 732 HD22 LEU 113 HD22 LEU 113 76.597 28.590 -17.882 733 HD23 LEU 113 HD23 LEU 113 77.946 27.461 -17.684 734 H ARG 114 H ARG 114 83.133 28.217 -19.370 735 HA ARG 114 HA ARG 114 82.911 27.625 -22.192 736 HB2 ARG 114 HB2 ARG 114 84.698 29.051 -21.206 737 HB3 ARG 114 HB3 ARG 114 85.380 27.624 -20.409 738 HG2 ARG 114 HG2 ARG 114 85.790 26.565 -22.608 739 HG3 ARG 114 HG3 ARG 114 85.023 27.935 -23.427 740 HD2 ARG 114 HD2 ARG 114 86.792 29.433 -22.482 741 HD3 ARG 114 HD3 ARG 114 87.568 28.004 -21.766 742 HE ARG 114 HE ARG 114 87.123 27.656 -24.598 743 HH11 ARG 114 HH11 ARG 114 89.331 29.295 -22.424 744 HH12 ARG 114 HH12 ARG 114 90.621 29.300 -23.596 745 HH21 ARG 114 HH21 ARG 114 88.808 27.684 -26.031 746 HH22 ARG 114 HH22 ARG 114 90.324 28.410 -25.588 Start of MODEL 3 1 H1 MET 1 H1 MET 1 -0.099 0.731 -53.792 2 H2 MET 1 H2 MET 1 -0.517 2.293 -54.036 3 H3 MET 1 H3 MET 1 -0.476 1.689 -52.518 4 HA MET 1 HA MET 1 1.449 3.086 -52.903 5 HB2 MET 1 HB2 MET 1 1.606 1.119 -51.362 6 HB3 MET 1 HB3 MET 1 2.213 0.133 -52.692 7 HG2 MET 1 HG2 MET 1 4.186 1.614 -52.890 8 HG3 MET 1 HG3 MET 1 3.571 2.631 -51.584 9 HE1 MET 1 HE1 MET 1 2.597 0.674 -49.284 10 HE2 MET 1 HE2 MET 1 4.122 0.478 -48.398 11 HE3 MET 1 HE3 MET 1 3.685 2.067 -49.061 12 H ARG 2 H ARG 2 3.231 3.694 -54.177 13 HA ARG 2 HA ARG 2 3.816 2.166 -56.665 14 HB2 ARG 2 HB2 ARG 2 3.892 4.249 -57.992 15 HB3 ARG 2 HB3 ARG 2 2.275 3.833 -57.436 16 HG2 ARG 2 HG2 ARG 2 2.367 5.541 -55.689 17 HG3 ARG 2 HG3 ARG 2 4.043 5.945 -56.104 18 HD2 ARG 2 HD2 ARG 2 3.401 6.845 -58.238 19 HD3 ARG 2 HD3 ARG 2 1.798 6.122 -58.134 20 HE ARG 2 HE ARG 2 1.046 7.789 -56.726 21 HH11 ARG 2 HH11 ARG 2 4.503 8.382 -57.208 22 HH12 ARG 2 HH12 ARG 2 4.381 9.955 -56.464 23 HH21 ARG 2 HH21 ARG 2 1.018 9.783 -55.816 24 HH22 ARG 2 HH22 ARG 2 2.474 10.725 -55.708 25 H GLY 3 H GLY 3 5.869 2.247 -57.410 26 HA2 GLY 3 HA2 GLY 3 7.999 3.169 -55.602 27 HA3 GLY 3 HA3 GLY 3 8.179 2.296 -57.124 28 H SER 4 H SER 4 6.429 4.400 -58.503 29 HA SER 4 HA SER 4 8.610 6.124 -59.335 30 HB2 SER 4 HB2 SER 4 5.699 6.081 -60.207 31 HB3 SER 4 HB3 SER 4 7.027 6.944 -61.008 32 HG SER 4 HG SER 4 6.607 4.891 -61.984 33 H HIS 5 H HIS 5 9.157 7.965 -58.408 34 HA HIS 5 HA HIS 5 7.218 10.095 -58.124 35 HB2 HIS 5 HB2 HIS 5 7.737 10.741 -55.846 36 HB3 HIS 5 HB3 HIS 5 7.061 9.124 -55.858 37 HD2 HIS 5 HD2 HIS 5 8.834 7.043 -55.410 38 HE1 HIS 5 HE1 HIS 5 11.746 9.469 -53.456 39 HE2 HIS 5 HE2 HIS 5 10.991 7.077 -53.896 40 H HIS 6 H HIS 6 8.217 12.194 -57.977 41 HA HIS 6 HA HIS 6 10.704 12.255 -59.534 42 HB2 HIS 6 HB2 HIS 6 8.719 14.435 -58.806 43 HB3 HIS 6 HB3 HIS 6 10.084 14.612 -59.908 44 HD2 HIS 6 HD2 HIS 6 9.975 13.272 -62.281 45 HE1 HIS 6 HE1 HIS 6 5.802 12.393 -62.136 46 HE2 HIS 6 HE2 HIS 6 7.868 12.430 -63.625 47 H HIS 7 H HIS 7 11.890 11.435 -57.558 48 HA HIS 7 HA HIS 7 12.455 13.157 -55.352 49 HB2 HIS 7 HB2 HIS 7 12.864 10.715 -55.380 50 HB3 HIS 7 HB3 HIS 7 14.167 10.945 -56.544 51 HD2 HIS 7 HD2 HIS 7 13.244 11.863 -52.871 52 HE1 HIS 7 HE1 HIS 7 17.491 12.138 -53.196 53 HE2 HIS 7 HE2 HIS 7 15.516 12.270 -51.594 54 H HIS 8 H HIS 8 13.977 14.659 -54.929 55 HA HIS 8 HA HIS 8 16.301 15.125 -56.590 56 HB2 HIS 8 HB2 HIS 8 15.873 17.410 -57.183 57 HB3 HIS 8 HB3 HIS 8 14.572 16.430 -57.830 58 HD2 HIS 8 HD2 HIS 8 12.213 16.453 -56.140 59 HE1 HIS 8 HE1 HIS 8 12.906 20.486 -54.941 60 HE2 HIS 8 HE2 HIS 8 11.180 18.615 -55.043 61 H HIS 9 H HIS 9 17.741 16.821 -55.587 62 HA HIS 9 HA HIS 9 17.886 16.316 -52.751 63 HB2 HIS 9 HB2 HIS 9 19.944 17.481 -52.760 64 HB3 HIS 9 HB3 HIS 9 19.878 16.512 -54.223 65 HD2 HIS 9 HD2 HIS 9 19.751 17.848 -56.591 66 HE1 HIS 9 HE1 HIS 9 20.492 21.744 -55.014 67 HE2 HIS 9 HE2 HIS 9 20.329 20.360 -57.145 68 H HIS 10 H HIS 10 17.741 17.683 -50.989 69 HA HIS 10 HA HIS 10 16.335 20.287 -51.336 70 HB2 HIS 10 HB2 HIS 10 14.729 18.331 -51.204 71 HB3 HIS 10 HB3 HIS 10 15.298 18.055 -49.561 72 HD2 HIS 10 HD2 HIS 10 13.494 18.963 -47.946 73 HE1 HIS 10 HE1 HIS 10 12.320 22.514 -50.003 74 HE2 HIS 10 HE2 HIS 10 11.948 21.101 -47.916 75 H GLY 11 H GLY 11 19.037 19.863 -50.577 76 HA2 GLY 11 HA2 GLY 11 19.424 20.021 -47.721 77 HA3 GLY 11 HA3 GLY 11 20.598 20.451 -48.961 78 H SER 28 H SER 28 20.026 21.798 -46.439 79 HA SER 28 HA SER 28 19.665 24.559 -47.427 80 HB2 SER 28 HB2 SER 28 18.052 25.123 -45.677 81 HB3 SER 28 HB3 SER 28 17.406 23.892 -46.770 82 HG SER 28 HG SER 28 17.001 23.374 -44.562 83 H VAL 29 H VAL 29 20.335 26.197 -45.915 84 HA VAL 29 HA VAL 29 21.880 25.446 -43.543 85 HB VAL 29 HB VAL 29 23.489 25.102 -45.375 86 HG11 VAL 29 HG11 VAL 29 23.252 28.080 -45.967 87 HG12 VAL 29 HG12 VAL 29 24.401 26.936 -46.684 88 HG13 VAL 29 HG13 VAL 29 22.673 26.766 -47.016 89 HG21 VAL 29 HG21 VAL 29 24.272 25.842 -43.140 90 HG22 VAL 29 HG22 VAL 29 25.338 26.330 -44.465 91 HG23 VAL 29 HG23 VAL 29 24.270 27.529 -43.720 92 H SER 30 H SER 30 22.256 27.185 -42.121 93 HA SER 30 HA SER 30 21.489 29.919 -42.901 94 HB2 SER 30 HB2 SER 30 19.363 28.850 -42.150 95 HB3 SER 30 HB3 SER 30 20.112 28.518 -40.577 96 HG SER 30 HG SER 30 18.889 30.500 -40.614 97 H PHE 31 H PHE 31 22.488 31.479 -41.713 98 HA PHE 31 HA PHE 31 23.832 30.953 -39.180 99 HB2 PHE 31 HB2 PHE 31 25.482 30.169 -40.916 100 HB3 PHE 31 HB3 PHE 31 25.476 31.783 -41.612 101 HD1 PHE 31 HD1 PHE 31 26.183 29.870 -38.460 102 HD2 PHE 31 HD2 PHE 31 26.945 33.465 -40.722 103 HE1 PHE 31 HE1 PHE 31 27.940 30.527 -36.828 104 HE2 PHE 31 HE2 PHE 31 28.701 34.116 -39.090 105 HZ PHE 31 HZ PHE 31 29.198 32.651 -37.141 106 H GLY 32 H GLY 32 24.547 32.945 -38.134 107 HA2 GLY 32 HA2 GLY 32 24.354 35.558 -39.150 108 HA3 GLY 32 HA3 GLY 32 22.741 35.139 -38.573 109 H ALA 33 H ALA 33 22.885 36.803 -37.060 110 HA ALA 33 HA ALA 33 23.320 37.882 -35.134 111 HB1 ALA 33 HB1 ALA 33 23.529 35.046 -34.075 112 HB2 ALA 33 HB2 ALA 33 23.126 36.503 -33.140 113 HB3 ALA 33 HB3 ALA 33 22.027 35.935 -34.410 114 HA PRO 34 HA PRO 34 28.019 37.587 -35.128 115 HB2 PRO 34 HB2 PRO 34 28.618 39.933 -36.370 116 HB3 PRO 34 HB3 PRO 34 28.263 38.434 -37.279 117 HG2 PRO 34 HG2 PRO 34 26.340 40.692 -36.605 118 HG3 PRO 34 HG3 PRO 34 26.655 39.954 -38.211 119 HD2 PRO 34 HD2 PRO 34 24.568 39.156 -36.660 120 HD3 PRO 34 HD3 PRO 34 25.499 37.981 -37.638 121 H SER 35 H SER 35 29.401 38.932 -33.820 122 HA SER 35 HA SER 35 28.048 40.902 -32.030 123 HB2 SER 35 HB2 SER 35 29.061 39.711 -30.092 124 HB3 SER 35 HB3 SER 35 27.801 38.817 -30.945 125 HG SER 35 HG SER 35 29.631 37.495 -30.459 126 HA PRO 36 HA PRO 36 32.367 42.369 -33.235 127 HB2 PRO 36 HB2 PRO 36 31.705 44.733 -34.437 128 HB3 PRO 36 HB3 PRO 36 31.756 43.173 -35.315 129 HG2 PRO 36 HG2 PRO 36 29.327 44.546 -34.109 130 HG3 PRO 36 HG3 PRO 36 29.512 43.881 -35.764 131 HD2 PRO 36 HD2 PRO 36 28.320 42.450 -33.789 132 HD3 PRO 36 HD3 PRO 36 29.385 41.658 -34.988 133 H LEU 37 H LEU 37 33.511 43.773 -31.949 134 HA LEU 37 HA LEU 37 32.196 45.779 -30.245 135 HB2 LEU 37 HB2 LEU 37 31.874 43.613 -29.052 136 HB3 LEU 37 HB3 LEU 37 33.605 43.313 -29.132 137 HG LEU 37 HG LEU 37 34.012 45.286 -27.658 138 HD11 LEU 37 HD11 LEU 37 30.966 45.383 -27.465 139 HD12 LEU 37 HD12 LEU 37 32.100 46.280 -26.430 140 HD13 LEU 37 HD13 LEU 37 32.004 46.651 -28.151 141 HD21 LEU 37 HD21 LEU 37 33.772 43.026 -26.715 142 HD22 LEU 37 HD22 LEU 37 33.148 44.257 -25.606 143 HD23 LEU 37 HD23 LEU 37 32.017 43.266 -26.558 144 H SER 38 H SER 38 33.569 47.393 -29.604 145 HA SER 38 HA SER 38 36.457 46.935 -29.411 146 HB2 SER 38 HB2 SER 38 37.036 49.001 -30.635 147 HB3 SER 38 HB3 SER 38 36.341 47.749 -31.674 148 HG SER 38 HG SER 38 35.446 49.822 -32.119 149 H SER 39 H SER 39 37.415 48.087 -27.820 150 HA SER 39 HA SER 39 35.772 50.004 -26.206 151 HB2 SER 39 HB2 SER 39 37.208 47.550 -25.130 152 HB3 SER 39 HB3 SER 39 36.255 48.715 -24.196 153 HG SER 39 HG SER 39 35.044 46.836 -24.673 154 H GLU 40 H GLU 40 38.455 50.138 -27.857 155 HA GLU 40 HA GLU 40 40.070 51.553 -25.823 156 HB2 GLU 40 HB2 GLU 40 42.071 50.226 -26.279 157 HB3 GLU 40 HB3 GLU 40 40.785 49.242 -25.588 158 HG2 GLU 40 HG2 GLU 40 40.235 48.400 -27.902 159 HG3 GLU 40 HG3 GLU 40 41.597 49.331 -28.528 160 H SER 41 H SER 41 41.804 52.807 -26.641 161 HA SER 41 HA SER 41 42.235 53.114 -29.513 162 HB2 SER 41 HB2 SER 41 40.223 54.552 -29.056 163 HB3 SER 41 HB3 SER 41 41.198 55.485 -27.906 164 HG SER 41 HG SER 41 41.148 56.413 -30.042 165 H GLU 42 H GLU 42 44.154 54.244 -29.975 166 HA GLU 42 HA GLU 42 46.351 54.717 -29.699 167 HB2 GLU 42 HB2 GLU 42 44.960 56.755 -28.869 168 HB3 GLU 42 HB3 GLU 42 45.611 56.362 -27.280 169 HG2 GLU 42 HG2 GLU 42 47.934 56.613 -28.235 170 HG3 GLU 42 HG3 GLU 42 47.221 56.974 -29.803 171 H ASP 43 H ASP 43 45.476 52.276 -28.209 172 HA ASP 43 HA ASP 43 47.025 52.155 -25.793 173 HB2 ASP 43 HB2 ASP 43 44.957 50.839 -26.280 174 HB3 ASP 43 HB3 ASP 43 45.870 49.895 -27.460 175 H GLU 44 H GLU 44 47.820 51.507 -29.049 176 HA GLU 44 HA GLU 44 50.564 50.554 -28.315 177 HB2 GLU 44 HB2 GLU 44 50.508 48.934 -30.100 178 HB3 GLU 44 HB3 GLU 44 49.163 48.666 -29.000 179 HG2 GLU 44 HG2 GLU 44 47.603 49.741 -30.587 180 HG3 GLU 44 HG3 GLU 44 48.937 50.124 -31.676 181 H ILE 45 H ILE 45 49.230 53.215 -29.545 182 HA ILE 45 HA ILE 45 50.766 53.446 -32.046 183 HB ILE 45 HB ILE 45 49.025 55.490 -30.635 184 HG12 ILE 45 HG12 ILE 45 48.486 53.608 -32.983 185 HG13 ILE 45 HG13 ILE 45 47.744 53.518 -31.389 186 HG21 ILE 45 HG21 ILE 45 50.205 55.501 -33.458 187 HG22 ILE 45 HG22 ILE 45 49.147 56.744 -32.756 188 HG23 ILE 45 HG23 ILE 45 50.762 56.526 -32.117 189 HD11 ILE 45 HD11 ILE 45 47.274 55.657 -33.490 190 HD12 ILE 45 HD12 ILE 45 46.134 54.464 -32.858 191 HD13 ILE 45 HD13 ILE 45 46.695 55.783 -31.811 192 H ASN 46 H ASN 46 52.883 53.514 -31.769 193 HA ASN 46 HA ASN 46 54.103 55.845 -30.434 194 HB2 ASN 46 HB2 ASN 46 54.013 54.053 -28.700 195 HB3 ASN 46 HB3 ASN 46 54.872 52.957 -29.781 196 HD21 ASN 46 HD22 ASN 46 56.106 53.099 -27.509 197 HD22 ASN 46 HD21 ASN 46 57.450 54.231 -27.533 198 H TYR 47 H TYR 47 55.672 56.668 -31.697 199 HA TYR 47 HA TYR 47 56.674 55.101 -34.028 200 HB2 TYR 47 HB2 TYR 47 55.334 57.221 -34.309 201 HB3 TYR 47 HB3 TYR 47 56.672 58.100 -33.586 202 HD1 TYR 47 HD2 TYR 47 55.821 55.745 -36.395 203 HD2 TYR 47 HD1 TYR 47 58.403 58.916 -35.012 204 HE1 TYR 47 HE2 TYR 47 56.849 55.902 -38.662 205 HE2 TYR 47 HE1 TYR 47 59.423 59.074 -37.275 206 HH TYR 47 HH TYR 47 59.451 58.254 -39.427 207 H MET 48 H MET 48 57.798 55.925 -30.960 208 HA MET 48 HA MET 48 60.440 56.904 -31.682 209 HB2 MET 48 HB2 MET 48 59.288 56.062 -28.996 210 HB3 MET 48 HB3 MET 48 60.829 56.882 -29.244 211 HG2 MET 48 HG2 MET 48 59.657 58.811 -30.268 212 HG3 MET 48 HG3 MET 48 58.111 58.007 -30.004 213 HE1 MET 48 HE1 MET 48 61.123 59.905 -28.419 214 HE2 MET 48 HE2 MET 48 60.790 59.820 -26.676 215 HE3 MET 48 HE3 MET 48 61.308 58.364 -27.547 216 H THR 49 H THR 49 59.328 53.757 -31.813 217 HA THR 49 HA THR 49 62.025 52.630 -31.194 218 HB THR 49 HB THR 49 60.606 51.906 -29.506 219 HG1 THR 49 HG1 THR 49 60.900 49.700 -29.802 220 HG21 THR 49 HG21 THR 49 58.727 50.619 -31.528 221 HG22 THR 49 HG22 THR 49 58.644 50.524 -29.763 222 HG23 THR 49 HG23 THR 49 58.358 52.068 -30.565 223 HA PRO 50 HA PRO 50 61.557 51.603 -35.571 224 HB2 PRO 50 HB2 PRO 50 64.156 51.514 -36.303 225 HB3 PRO 50 HB3 PRO 50 63.353 53.050 -35.863 226 HG2 PRO 50 HG2 PRO 50 65.083 51.286 -34.095 227 HG3 PRO 50 HG3 PRO 50 65.212 53.056 -34.357 228 HD2 PRO 50 HD2 PRO 50 63.862 51.938 -32.232 229 HD3 PRO 50 HD3 PRO 50 63.374 53.490 -32.980 230 HA PRO 51 HA PRO 51 61.988 47.203 -35.479 231 HB2 PRO 51 HB2 PRO 51 61.756 46.484 -38.081 232 HB3 PRO 51 HB3 PRO 51 60.484 47.420 -37.245 233 HG2 PRO 51 HG2 PRO 51 62.738 48.510 -38.974 234 HG3 PRO 51 HG3 PRO 51 60.977 48.812 -39.146 235 HD2 PRO 51 HD2 PRO 51 62.611 50.519 -37.783 236 HD3 PRO 51 HD3 PRO 51 60.932 50.202 -37.254 237 H GLU 52 H GLU 52 64.749 48.760 -35.836 238 HA GLU 52 HA GLU 52 66.358 47.202 -37.599 239 HB2 GLU 52 HB2 GLU 52 67.136 49.035 -35.296 240 HB3 GLU 52 HB3 GLU 52 68.266 48.380 -36.485 241 HG2 GLU 52 HG2 GLU 52 66.971 49.484 -38.311 242 HG3 GLU 52 HG3 GLU 52 65.925 50.225 -37.101 243 H GLN 53 H GLN 53 65.525 46.564 -34.297 244 HA GLN 53 HA GLN 53 66.954 44.006 -34.362 245 HB2 GLN 53 HB2 GLN 53 68.613 45.711 -33.476 246 HB3 GLN 53 HB3 GLN 53 67.531 45.981 -32.106 247 HG2 GLN 53 HG2 GLN 53 67.795 43.614 -31.427 248 HG3 GLN 53 HG3 GLN 53 68.778 43.294 -32.860 249 HE21 GLN 53 HE22 GLN 53 70.933 44.451 -33.003 250 HE22 GLN 53 HE21 GLN 53 71.711 44.894 -31.491 251 H GLU 54 H GLU 54 65.991 42.438 -33.066 252 HA GLU 54 HA GLU 54 63.286 42.852 -32.247 253 HB2 GLU 54 HB2 GLU 54 65.212 40.557 -31.668 254 HB3 GLU 54 HB3 GLU 54 63.490 40.547 -31.324 255 HG2 GLU 54 HG2 GLU 54 63.795 39.348 -33.345 256 HG3 GLU 54 HG3 GLU 54 62.967 40.856 -33.715 257 H ALA 55 H ALA 55 66.243 42.409 -30.276 258 HA ALA 55 HA ALA 55 66.740 42.834 -28.104 259 HB1 ALA 55 HB1 ALA 55 65.118 45.315 -28.768 260 HB2 ALA 55 HB2 ALA 55 66.400 45.192 -27.545 261 HB3 ALA 55 HB3 ALA 55 66.796 45.001 -29.260 262 H GLN 56 H GLN 56 64.649 41.005 -28.043 263 HA GLN 56 HA GLN 56 63.357 41.532 -25.456 264 HB2 GLN 56 HB2 GLN 56 61.907 42.683 -27.150 265 HB3 GLN 56 HB3 GLN 56 61.638 41.133 -27.947 266 HG2 GLN 56 HG2 GLN 56 60.616 40.267 -25.815 267 HG3 GLN 56 HG3 GLN 56 60.928 41.827 -25.053 268 HE21 GLN 56 HE22 GLN 56 58.407 41.269 -24.785 269 HE22 GLN 56 HE21 GLN 56 57.400 42.029 -26.011 270 HA PRO 57 HA PRO 57 64.636 37.280 -26.670 271 HB2 PRO 57 HB2 PRO 57 66.422 36.654 -24.752 272 HB3 PRO 57 HB3 PRO 57 66.757 37.878 -26.030 273 HG2 PRO 57 HG2 PRO 57 65.763 38.412 -23.204 274 HG3 PRO 57 HG3 PRO 57 67.200 39.115 -24.018 275 HD2 PRO 57 HD2 PRO 57 64.786 40.390 -24.019 276 HD3 PRO 57 HD3 PRO 57 65.872 40.437 -25.441 277 H GLY 58 H GLY 58 63.026 38.278 -23.737 278 HA2 GLY 58 HA2 GLY 58 61.282 37.303 -22.619 279 HA3 GLY 58 HA3 GLY 58 61.159 36.188 -23.978 280 H ALA 59 H ALA 59 63.928 36.385 -21.716 281 HA ALA 59 HA ALA 59 63.230 33.735 -20.564 282 HB1 ALA 59 HB1 ALA 59 65.879 34.516 -21.854 283 HB2 ALA 59 HB2 ALA 59 65.555 32.997 -20.991 284 HB3 ALA 59 HB3 ALA 59 64.695 33.359 -22.501 285 H LEU 60 H LEU 60 64.174 33.238 -18.645 286 HA LEU 60 HA LEU 60 65.194 35.454 -16.946 287 HB2 LEU 60 HB2 LEU 60 64.385 34.368 -15.089 288 HB3 LEU 60 HB3 LEU 60 63.126 34.128 -16.281 289 HG LEU 60 HG LEU 60 65.189 32.054 -15.380 290 HD11 LEU 60 HD11 LEU 60 62.195 32.258 -14.870 291 HD12 LEU 60 HD12 LEU 60 63.275 30.959 -14.312 292 HD13 LEU 60 HD13 LEU 60 63.481 32.603 -13.690 293 HD21 LEU 60 HD21 LEU 60 64.566 31.519 -17.680 294 HD22 LEU 60 HD22 LEU 60 63.761 30.403 -16.584 295 HD23 LEU 60 HD23 LEU 60 62.835 31.741 -17.295 296 H ALA 61 H ALA 61 66.838 34.766 -15.235 297 HA ALA 61 HA ALA 61 68.821 32.854 -16.334 298 HB1 ALA 61 HB1 ALA 61 69.376 35.444 -14.856 299 HB2 ALA 61 HB2 ALA 61 70.591 34.250 -15.366 300 HB3 ALA 61 HB3 ALA 61 69.650 35.127 -16.583 301 H ALA 62 H ALA 62 69.159 31.128 -15.118 302 HA ALA 62 HA ALA 62 68.562 31.107 -12.215 303 HB1 ALA 62 HB1 ALA 62 69.544 28.912 -14.078 304 HB2 ALA 62 HB2 ALA 62 69.099 28.717 -12.372 305 HB3 ALA 62 HB3 ALA 62 67.863 29.175 -13.562 306 H LEU 63 H LEU 63 70.142 30.811 -10.635 307 HA LEU 63 HA LEU 63 72.926 31.564 -11.426 308 HB2 LEU 63 HB2 LEU 63 71.348 32.656 -9.074 309 HB3 LEU 63 HB3 LEU 63 72.970 33.130 -9.563 310 HG LEU 63 HG LEU 63 70.409 33.667 -11.132 311 HD11 LEU 63 HD11 LEU 63 72.245 35.534 -9.578 312 HD12 LEU 63 HD12 LEU 63 70.803 36.003 -10.505 313 HD13 LEU 63 HD13 LEU 63 70.632 34.993 -9.061 314 HD21 LEU 63 HD21 LEU 63 72.370 33.455 -12.650 315 HD22 LEU 63 HD22 LEU 63 71.782 35.108 -12.550 316 HD23 LEU 63 HD23 LEU 63 73.252 34.633 -11.661 317 H HIS 64 H HIS 64 74.582 31.139 -9.906 318 HA HIS 64 HA HIS 64 74.245 28.741 -8.200 319 HB2 HIS 64 HB2 HIS 64 76.552 30.584 -8.851 320 HB3 HIS 64 HB3 HIS 64 76.689 29.269 -7.694 321 HD2 HIS 64 HD2 HIS 64 77.006 30.036 -11.352 322 HE1 HIS 64 HE1 HIS 64 77.134 25.780 -11.060 323 HE2 HIS 64 HE2 HIS 64 77.596 27.782 -12.565 324 H ALA 65 H ALA 65 74.067 28.787 -5.965 325 HA ALA 65 HA ALA 65 73.406 31.401 -4.771 326 HB1 ALA 65 HB1 ALA 65 73.091 28.560 -3.726 327 HB2 ALA 65 HB2 ALA 65 72.394 30.031 -3.016 328 HB3 ALA 65 HB3 ALA 65 71.864 29.491 -4.619 329 H GLU 66 H GLU 66 76.096 29.175 -4.604 330 HA GLU 66 HA GLU 66 77.277 30.592 -2.257 331 HB2 GLU 66 HB2 GLU 66 76.857 27.595 -2.597 332 HB3 GLU 66 HB3 GLU 66 77.944 28.281 -1.404 333 HG2 GLU 66 HG2 GLU 66 74.933 28.711 -1.519 334 HG3 GLU 66 HG3 GLU 66 75.795 27.637 -0.430 335 H GLY 67 H GLY 67 79.554 30.010 -1.867 336 HA2 GLY 67 HA2 GLY 67 81.747 29.626 -2.498 337 HA3 GLY 67 HA3 GLY 67 81.148 28.749 -3.901 338 HA PRO 68 HA PRO 68 83.329 32.652 -5.227 339 HB2 PRO 68 HB2 PRO 68 84.776 31.614 -7.320 340 HB3 PRO 68 HB3 PRO 68 85.279 31.494 -5.608 341 HG2 PRO 68 HG2 PRO 68 83.788 29.421 -7.253 342 HG3 PRO 68 HG3 PRO 68 85.257 29.188 -6.250 343 HD2 PRO 68 HD2 PRO 68 82.803 28.600 -5.290 344 HD3 PRO 68 HD3 PRO 68 84.020 29.380 -4.234 345 H LEU 69 H LEU 69 81.186 30.471 -6.900 346 HA LEU 69 HA LEU 69 80.655 32.412 -9.076 347 HB2 LEU 69 HB2 LEU 69 79.596 29.609 -8.603 348 HB3 LEU 69 HB3 LEU 69 79.198 30.620 -9.986 349 HG LEU 69 HG LEU 69 81.987 29.587 -9.346 350 HD11 LEU 69 HD11 LEU 69 80.013 28.774 -11.511 351 HD12 LEU 69 HD12 LEU 69 81.635 28.097 -11.236 352 HD13 LEU 69 HD13 LEU 69 80.358 27.841 -10.039 353 HD21 LEU 69 HD21 LEU 69 82.159 31.680 -10.597 354 HD22 LEU 69 HD22 LEU 69 82.514 30.326 -11.671 355 HD23 LEU 69 HD23 LEU 69 80.930 31.120 -11.763 356 H ALA 70 H ALA 70 79.608 32.394 -5.937 357 HA ALA 70 HA ALA 70 76.832 32.295 -6.102 358 HB1 ALA 70 HB1 ALA 70 78.556 34.078 -4.329 359 HB2 ALA 70 HB2 ALA 70 76.850 33.669 -4.045 360 HB3 ALA 70 HB3 ALA 70 78.085 32.399 -3.989 361 H GLY 71 H GLY 71 75.349 33.391 -7.052 362 HA2 GLY 71 HA2 GLY 71 74.104 35.172 -7.913 363 HA3 GLY 71 HA3 GLY 71 75.448 36.279 -7.639 364 H LEU 72 H LEU 72 76.667 33.599 -9.313 365 HA LEU 72 HA LEU 72 76.536 35.020 -11.924 366 HB2 LEU 72 HB2 LEU 72 78.516 32.899 -11.031 367 HB3 LEU 72 HB3 LEU 72 78.629 33.915 -12.433 368 HG LEU 72 HG LEU 72 79.014 34.765 -9.560 369 HD11 LEU 72 HD11 LEU 72 80.790 35.006 -12.025 370 HD12 LEU 72 HD12 LEU 72 81.228 35.366 -10.341 371 HD13 LEU 72 HD13 LEU 72 80.899 33.700 -10.837 372 HD21 LEU 72 HD21 LEU 72 77.777 36.615 -10.612 373 HD22 LEU 72 HD22 LEU 72 79.471 37.048 -10.402 374 HD23 LEU 72 HD23 LEU 72 78.872 36.582 -12.005 375 HA PRO 73 HA PRO 73 73.938 32.243 -13.788 376 HB2 PRO 73 HB2 PRO 73 74.812 31.896 -16.367 377 HB3 PRO 73 HB3 PRO 73 74.274 33.473 -15.715 378 HG2 PRO 73 HG2 PRO 73 77.077 32.378 -16.067 379 HG3 PRO 73 HG3 PRO 73 76.485 34.025 -16.441 380 HD2 PRO 73 HD2 PRO 73 77.820 33.320 -14.176 381 HD3 PRO 73 HD3 PRO 73 76.665 34.693 -14.222 382 H VAL 74 H VAL 74 73.294 30.122 -14.488 383 HA VAL 74 HA VAL 74 75.354 28.036 -14.031 384 HB VAL 74 HB VAL 74 72.357 27.719 -14.289 385 HG11 VAL 74 HG11 VAL 74 74.524 25.795 -13.350 386 HG12 VAL 74 HG12 VAL 74 72.773 25.522 -13.224 387 HG13 VAL 74 HG13 VAL 74 73.526 25.627 -14.814 388 HG21 VAL 74 HG21 VAL 74 72.941 29.032 -12.281 389 HG22 VAL 74 HG22 VAL 74 72.424 27.410 -11.832 390 HG23 VAL 74 HG23 VAL 74 74.153 27.820 -11.824 391 H THR 75 H THR 75 73.155 29.057 -16.698 392 HA THR 75 HA THR 75 74.738 27.323 -18.570 393 HB THR 75 HB THR 75 72.817 27.055 -19.919 394 HG1 THR 75 HG1 THR 75 70.800 28.055 -19.107 395 HG21 THR 75 HG21 THR 75 71.838 26.745 -17.065 396 HG22 THR 75 HG22 THR 75 71.345 25.822 -18.504 397 HG23 THR 75 HG23 THR 75 72.992 25.650 -17.859 398 H ARG 76 H ARG 76 74.571 28.030 -20.956 399 HA ARG 76 HA ARG 76 75.682 30.687 -21.244 400 HB2 ARG 76 HB2 ARG 76 76.229 28.818 -22.769 401 HB3 ARG 76 HB3 ARG 76 74.561 28.785 -23.358 402 HG2 ARG 76 HG2 ARG 76 74.812 31.049 -24.304 403 HG3 ARG 76 HG3 ARG 76 76.395 31.222 -23.541 404 HD2 ARG 76 HD2 ARG 76 76.665 30.801 -25.884 405 HD3 ARG 76 HD3 ARG 76 77.295 29.417 -24.975 406 HE ARG 76 HE ARG 76 74.641 28.757 -25.604 407 HH11 ARG 76 HH11 ARG 76 77.468 29.594 -27.530 408 HH12 ARG 76 HH12 ARG 76 76.966 28.562 -28.850 409 HH21 ARG 76 HH21 ARG 76 74.073 27.472 -27.338 410 HH22 ARG 76 HH22 ARG 76 75.091 27.409 -28.743 411 H SER 77 H SER 77 72.387 29.409 -21.706 412 HA SER 77 HA SER 77 71.156 31.837 -22.574 413 HB2 SER 77 HB2 SER 77 69.974 29.659 -20.806 414 HB3 SER 77 HB3 SER 77 69.079 30.873 -21.740 415 HG SER 77 HG SER 77 69.231 28.853 -22.860 416 H ASP 78 H ASP 78 71.781 30.584 -19.213 417 HA ASP 78 HA ASP 78 70.653 32.865 -17.903 418 HB2 ASP 78 HB2 ASP 78 72.915 31.077 -16.977 419 HB3 ASP 78 HB3 ASP 78 71.990 32.181 -15.964 420 H ALA 79 H ALA 79 74.083 32.262 -18.946 421 HA ALA 79 HA ALA 79 75.076 34.765 -18.018 422 HB1 ALA 79 HB1 ALA 79 76.071 32.968 -20.285 423 HB2 ALA 79 HB2 ALA 79 77.010 34.221 -19.452 424 HB3 ALA 79 HB3 ALA 79 76.484 32.780 -18.563 425 H ARG 80 H ARG 80 73.726 33.918 -21.235 426 HA ARG 80 HA ARG 80 74.084 36.471 -22.487 427 HB2 ARG 80 HB2 ARG 80 73.567 34.368 -23.680 428 HB3 ARG 80 HB3 ARG 80 72.013 34.255 -22.871 429 HG2 ARG 80 HG2 ARG 80 71.635 34.974 -25.107 430 HG3 ARG 80 HG3 ARG 80 71.236 36.306 -24.040 431 HD2 ARG 80 HD2 ARG 80 72.399 37.193 -25.957 432 HD3 ARG 80 HD3 ARG 80 73.439 37.368 -24.558 433 HE ARG 80 HE ARG 80 74.985 35.908 -25.511 434 HH11 ARG 80 HH11 ARG 80 72.001 35.418 -27.310 435 HH12 ARG 80 HH12 ARG 80 72.817 34.563 -28.584 436 HH21 ARG 80 HH21 ARG 80 75.969 35.085 -27.340 437 HH22 ARG 80 HH22 ARG 80 74.990 34.285 -28.535 438 H VAL 81 H VAL 81 71.299 35.202 -20.619 439 HA VAL 81 HA VAL 81 69.695 37.594 -20.796 440 HB VAL 81 HB VAL 81 69.722 35.317 -18.787 441 HG11 VAL 81 HG11 VAL 81 67.709 37.601 -19.083 442 HG12 VAL 81 HG12 VAL 81 67.417 36.118 -18.167 443 HG13 VAL 81 HG13 VAL 81 68.676 37.229 -17.635 444 HG21 VAL 81 HG21 VAL 81 69.066 34.833 -21.160 445 HG22 VAL 81 HG22 VAL 81 67.785 34.554 -19.975 446 HG23 VAL 81 HG23 VAL 81 67.758 36.017 -20.999 447 H LEU 82 H LEU 82 71.995 36.490 -18.252 448 HA LEU 82 HA LEU 82 71.782 38.814 -16.612 449 HB2 LEU 82 HB2 LEU 82 74.084 36.915 -17.178 450 HB3 LEU 82 HB3 LEU 82 74.313 38.323 -16.153 451 HG LEU 82 HG LEU 82 72.366 36.059 -15.581 452 HD11 LEU 82 HD11 LEU 82 74.933 36.945 -14.188 453 HD12 LEU 82 HD12 LEU 82 73.966 35.492 -13.847 454 HD13 LEU 82 HD13 LEU 82 74.843 35.641 -15.382 455 HD21 LEU 82 HD21 LEU 82 71.428 38.076 -14.597 456 HD22 LEU 82 HD22 LEU 82 72.249 37.199 -13.307 457 HD23 LEU 82 HD23 LEU 82 73.031 38.609 -14.037 458 H ILE 83 H ILE 83 74.066 38.315 -19.369 459 HA ILE 83 HA ILE 83 75.250 40.886 -19.303 460 HB ILE 83 HB ILE 83 74.712 38.936 -21.559 461 HG12 ILE 83 HG12 ILE 83 77.334 39.887 -20.314 462 HG13 ILE 83 HG13 ILE 83 76.419 38.525 -19.677 463 HG21 ILE 83 HG21 ILE 83 76.200 41.595 -21.818 464 HG22 ILE 83 HG22 ILE 83 76.201 40.294 -23.024 465 HG23 ILE 83 HG23 ILE 83 74.712 41.143 -22.677 466 HD11 ILE 83 HD11 ILE 83 77.665 38.675 -22.448 467 HD12 ILE 83 HD12 ILE 83 78.172 37.672 -21.082 468 HD13 ILE 83 HD13 ILE 83 76.613 37.358 -21.869 469 H PHE 84 H PHE 84 72.316 39.898 -21.182 470 HA PHE 84 HA PHE 84 71.861 42.531 -22.145 471 HB2 PHE 84 HB2 PHE 84 70.953 40.340 -23.056 472 HB3 PHE 84 HB3 PHE 84 69.764 40.362 -21.766 473 HD1 PHE 84 HD1 PHE 84 71.177 42.804 -24.296 474 HD2 PHE 84 HD2 PHE 84 67.633 41.213 -22.411 475 HE1 PHE 84 HE1 PHE 84 69.799 44.073 -25.863 476 HE2 PHE 84 HE2 PHE 84 66.232 42.623 -23.907 477 HZ PHE 84 HZ PHE 84 67.300 44.038 -25.647 478 H ASN 85 H ASN 85 70.330 40.895 -19.306 479 HA ASN 85 HA ASN 85 68.587 43.105 -18.740 480 HB2 ASN 85 HB2 ASN 85 68.143 40.792 -17.985 481 HB3 ASN 85 HB3 ASN 85 69.546 40.859 -16.909 482 HD21 ASN 85 HD22 ASN 85 69.407 42.210 -14.972 483 HD22 ASN 85 HD21 ASN 85 67.943 43.090 -14.579 484 H GLU 86 H GLU 86 71.817 42.212 -17.347 485 HA GLU 86 HA GLU 86 71.892 44.455 -15.525 486 HB2 GLU 86 HB2 GLU 86 74.113 42.808 -16.804 487 HB3 GLU 86 HB3 GLU 86 74.423 44.158 -15.730 488 HG2 GLU 86 HG2 GLU 86 72.792 41.708 -14.953 489 HG3 GLU 86 HG3 GLU 86 74.490 41.971 -14.561 490 H TRP 87 H TRP 87 73.222 44.091 -18.935 491 HA TRP 87 HA TRP 87 74.136 46.764 -19.061 492 HB2 TRP 87 HB2 TRP 87 74.765 45.140 -20.707 493 HB3 TRP 87 HB3 TRP 87 73.086 44.859 -21.154 494 HD1 TRP 87 HD1 TRP 87 75.735 47.655 -21.441 495 HE1 TRP 87 HE1 TRP 87 75.261 48.945 -23.610 496 HE3 TRP 87 HE3 TRP 87 71.367 45.375 -22.802 497 HZ2 TRP 87 HZ2 TRP 87 73.369 48.833 -25.775 498 HZ3 TRP 87 HZ3 TRP 87 70.367 45.870 -24.976 499 HH2 TRP 87 HH2 TRP 87 71.311 47.611 -26.483 500 H GLU 88 H GLU 88 70.822 45.513 -19.881 501 HA GLU 88 HA GLU 88 69.758 47.994 -20.728 502 HB2 GLU 88 HB2 GLU 88 68.576 45.480 -19.534 503 HB3 GLU 88 HB3 GLU 88 67.563 46.885 -19.790 504 HG2 GLU 88 HG2 GLU 88 69.225 45.788 -22.068 505 HG3 GLU 88 HG3 GLU 88 67.665 45.097 -21.642 506 H GLU 89 H GLU 89 69.700 46.657 -17.334 507 HA GLU 89 HA GLU 89 68.361 49.038 -16.320 508 HB2 GLU 89 HB2 GLU 89 69.868 46.809 -14.890 509 HB3 GLU 89 HB3 GLU 89 68.987 48.113 -14.085 510 HG2 GLU 89 HG2 GLU 89 66.908 47.411 -15.322 511 HG3 GLU 89 HG3 GLU 89 67.796 46.023 -15.951 512 H ARG 90 H ARG 90 71.761 47.960 -16.257 513 HA ARG 90 HA ARG 90 72.855 50.202 -14.808 514 HB2 ARG 90 HB2 ARG 90 74.140 48.491 -16.972 515 HB3 ARG 90 HB3 ARG 90 75.019 49.552 -15.869 516 HG2 ARG 90 HG2 ARG 90 73.274 47.304 -14.847 517 HG3 ARG 90 HG3 ARG 90 74.910 47.004 -15.426 518 HD2 ARG 90 HD2 ARG 90 75.799 48.507 -13.685 519 HD3 ARG 90 HD3 ARG 90 74.140 48.857 -13.135 520 HE ARG 90 HE ARG 90 74.410 46.038 -13.140 521 HH11 ARG 90 HH11 ARG 90 75.886 48.629 -11.270 522 HH12 ARG 90 HH12 ARG 90 76.161 47.564 -9.918 523 HH21 ARG 90 HH21 ARG 90 74.745 44.838 -11.547 524 HH22 ARG 90 HH22 ARG 90 75.514 45.388 -10.051 525 H LYS 91 H LYS 91 72.428 49.649 -18.313 526 HA LYS 91 HA LYS 91 73.329 52.310 -18.998 527 HB2 LYS 91 HB2 LYS 91 73.316 50.342 -20.582 528 HB3 LYS 91 HB3 LYS 91 71.562 50.511 -20.730 529 HG2 LYS 91 HG2 LYS 91 71.794 52.709 -21.749 530 HG3 LYS 91 HG3 LYS 91 73.524 52.743 -21.367 531 HD2 LYS 91 HD2 LYS 91 73.862 50.791 -22.873 532 HD3 LYS 91 HD3 LYS 91 72.164 50.907 -23.376 533 HE2 LYS 91 HE2 LYS 91 72.526 53.147 -24.270 534 HE3 LYS 91 HE3 LYS 91 74.123 53.247 -23.524 535 HZ1 LYS 91 HZ1 LYS 91 73.418 51.390 -25.740 536 HZ2 LYS 91 HZ2 LYS 91 74.303 52.749 -25.888 537 HZ3 LYS 91 HZ3 LYS 91 74.907 51.496 -25.022 538 H LYS 92 H LYS 92 70.016 51.148 -18.234 539 HA LYS 92 HA LYS 92 68.711 53.621 -18.828 540 HB2 LYS 92 HB2 LYS 92 67.617 51.468 -18.259 541 HB3 LYS 92 HB3 LYS 92 68.085 51.652 -16.574 542 HG2 LYS 92 HG2 LYS 92 66.525 53.854 -17.937 543 HG3 LYS 92 HG3 LYS 92 65.708 52.351 -17.511 544 HD2 LYS 92 HD2 LYS 92 66.291 52.622 -15.137 545 HD3 LYS 92 HD3 LYS 92 67.223 54.071 -15.503 546 HE2 LYS 92 HE2 LYS 92 65.148 54.813 -14.628 547 HE3 LYS 92 HE3 LYS 92 65.156 55.192 -16.349 548 HZ1 LYS 92 HZ1 LYS 92 63.767 52.849 -15.126 549 HZ2 LYS 92 HZ2 LYS 92 63.034 54.217 -15.619 550 HZ3 LYS 92 HZ3 LYS 92 63.726 53.236 -16.719 551 H SER 93 H SER 93 70.676 52.661 -15.990 552 HA SER 93 HA SER 93 70.544 55.366 -14.843 553 HB2 SER 93 HB2 SER 93 70.954 53.255 -13.550 554 HB3 SER 93 HB3 SER 93 72.581 53.205 -14.248 555 HG SER 93 HG SER 93 72.480 54.284 -12.182 556 H GLU 94 H GLU 94 72.786 53.741 -17.042 557 HA GLU 94 HA GLU 94 74.571 56.129 -17.257 558 HB2 GLU 94 HB2 GLU 94 75.290 53.169 -17.354 559 HB3 GLU 94 HB3 GLU 94 76.394 54.530 -17.465 560 HG2 GLU 94 HG2 GLU 94 75.632 55.215 -15.141 561 HG3 GLU 94 HG3 GLU 94 74.732 53.691 -15.079 562 HA PRO 95 HA PRO 95 72.621 55.015 -21.305 563 HB2 PRO 95 HB2 PRO 95 72.498 57.547 -22.471 564 HB3 PRO 95 HB3 PRO 95 71.309 56.843 -21.338 565 HG2 PRO 95 HG2 PRO 95 73.656 58.655 -20.691 566 HG3 PRO 95 HG3 PRO 95 71.947 58.819 -20.163 567 HD2 PRO 95 HD2 PRO 95 73.750 57.704 -18.524 568 HD3 PRO 95 HD3 PRO 95 72.137 56.952 -18.691 569 H TRP 96 H TRP 96 75.769 55.577 -20.821 570 HA TRP 96 HA TRP 96 76.638 55.701 -23.668 571 HB2 TRP 96 HB2 TRP 96 78.880 56.086 -22.588 572 HB3 TRP 96 HB3 TRP 96 77.671 57.321 -22.308 573 HD1 TRP 96 HD1 TRP 96 79.500 54.505 -20.453 574 HE1 TRP 96 HE1 TRP 96 79.369 54.923 -17.920 575 HE3 TRP 96 HE3 TRP 96 76.282 58.492 -20.454 576 HZ2 TRP 96 HZ2 TRP 96 78.016 56.731 -16.127 577 HZ3 TRP 96 HZ3 TRP 96 75.574 59.532 -18.310 578 HH2 TRP 96 HH2 TRP 96 76.426 58.660 -16.146 579 H LEU 97 H LEU 97 75.965 53.253 -21.366 580 HA LEU 97 HA LEU 97 78.241 51.730 -21.417 581 HB2 LEU 97 HB2 LEU 97 76.054 51.700 -19.965 582 HB3 LEU 97 HB3 LEU 97 75.449 50.587 -21.165 583 HG LEU 97 HG LEU 97 77.307 49.059 -20.672 584 HD11 LEU 97 HD11 LEU 97 77.989 51.026 -18.449 585 HD12 LEU 97 HD12 LEU 97 78.607 49.362 -18.558 586 HD13 LEU 97 HD13 LEU 97 79.051 50.538 -19.793 587 HD21 LEU 97 HD21 LEU 97 75.097 48.909 -19.497 588 HD22 LEU 97 HD22 LEU 97 76.429 48.318 -18.485 589 HD23 LEU 97 HD23 LEU 97 75.749 49.939 -18.208 590 H ARG 98 H ARG 98 79.089 50.036 -22.508 591 HA ARG 98 HA ARG 98 78.028 49.331 -25.173 592 HB2 ARG 98 HB2 ARG 98 80.199 48.442 -25.638 593 HB3 ARG 98 HB3 ARG 98 80.376 50.025 -24.888 594 HG2 ARG 98 HG2 ARG 98 80.887 48.872 -22.690 595 HG3 ARG 98 HG3 ARG 98 80.774 47.317 -23.525 596 HD2 ARG 98 HD2 ARG 98 83.099 47.859 -23.388 597 HD3 ARG 98 HD3 ARG 98 82.612 48.048 -25.063 598 HE ARG 98 HE ARG 98 82.957 50.350 -24.946 599 HH11 ARG 98 HH11 ARG 98 83.341 49.074 -21.695 600 HH12 ARG 98 HH12 ARG 98 84.020 50.563 -21.100 601 HH21 ARG 98 HH21 ARG 98 83.822 52.210 -24.114 602 HH22 ARG 98 HH22 ARG 98 84.287 52.289 -22.441 603 H LEU 99 H LEU 99 78.014 47.163 -25.967 604 HA LEU 99 HA LEU 99 77.187 45.047 -24.032 605 HB2 LEU 99 HB2 LEU 99 75.330 46.440 -24.761 606 HB3 LEU 99 HB3 LEU 99 75.681 46.180 -26.435 607 HG LEU 99 HG LEU 99 73.663 45.017 -25.547 608 HD11 LEU 99 HD11 LEU 99 75.674 42.946 -26.464 609 HD12 LEU 99 HD12 LEU 99 73.952 43.104 -26.875 610 HD13 LEU 99 HD13 LEU 99 75.103 44.237 -27.537 611 HD21 LEU 99 HD21 LEU 99 74.713 44.503 -23.302 612 HD22 LEU 99 HD22 LEU 99 73.591 43.372 -24.023 613 HD23 LEU 99 HD23 LEU 99 75.364 43.046 -24.081 614 H ASP 100 H ASP 100 78.046 43.071 -24.576 615 HA ASP 100 HA ASP 100 78.511 42.385 -27.412 616 HB2 ASP 100 HB2 ASP 100 80.681 43.272 -26.383 617 HB3 ASP 100 HB3 ASP 100 80.674 41.846 -25.349 618 H MET 101 H MET 101 78.024 40.291 -27.868 619 HA MET 101 HA MET 101 77.116 38.523 -25.621 620 HB2 MET 101 HB2 MET 101 75.771 39.249 -28.253 621 HB3 MET 101 HB3 MET 101 75.269 37.875 -27.273 622 HG2 MET 101 HG2 MET 101 74.857 39.344 -25.345 623 HG3 MET 101 HG3 MET 101 75.344 40.747 -26.299 624 HE1 MET 101 HE1 MET 101 72.899 41.921 -25.580 625 HE2 MET 101 HE2 MET 101 71.404 40.978 -25.760 626 HE3 MET 101 HE3 MET 101 72.675 40.414 -24.653 627 H SER 102 H SER 102 79.564 38.577 -27.742 628 HA SER 102 HA SER 102 79.331 36.060 -29.156 629 HB2 SER 102 HB2 SER 102 80.892 37.858 -29.808 630 HB3 SER 102 HB3 SER 102 81.796 37.628 -28.295 631 HG SER 102 HG SER 102 82.657 36.489 -30.192 632 H ASP 103 H ASP 103 80.259 34.013 -28.645 633 HA ASP 103 HA ASP 103 80.000 33.061 -26.005 634 HB2 ASP 103 HB2 ASP 103 81.646 31.971 -28.324 635 HB3 ASP 103 HB3 ASP 103 81.314 31.094 -26.833 636 H LYS 104 H LYS 104 82.865 34.429 -27.571 637 HA LYS 104 HA LYS 104 84.865 33.830 -25.659 638 HB2 LYS 104 HB2 LYS 104 85.131 34.893 -27.945 639 HB3 LYS 104 HB3 LYS 104 84.505 36.393 -27.279 640 HG2 LYS 104 HG2 LYS 104 86.884 36.547 -27.401 641 HG3 LYS 104 HG3 LYS 104 86.455 36.472 -25.693 642 HD2 LYS 104 HD2 LYS 104 87.134 34.103 -25.590 643 HD3 LYS 104 HD3 LYS 104 87.398 34.082 -27.351 644 HE2 LYS 104 HE2 LYS 104 89.144 35.859 -27.074 645 HE3 LYS 104 HE3 LYS 104 88.915 35.796 -25.324 646 HZ1 LYS 104 HZ1 LYS 104 89.851 33.519 -27.010 647 HZ2 LYS 104 HZ2 LYS 104 90.795 34.417 -26.031 648 HZ3 LYS 104 HZ3 LYS 104 89.649 33.454 -25.385 649 H ALA 105 H ALA 105 82.417 36.419 -25.587 650 HA ALA 105 HA ALA 105 83.398 37.749 -23.221 651 HB1 ALA 105 HB1 ALA 105 80.598 37.710 -24.419 652 HB2 ALA 105 HB2 ALA 105 81.227 38.878 -23.254 653 HB3 ALA 105 HB3 ALA 105 81.908 38.811 -24.888 654 H ILE 106 H ILE 106 81.213 35.022 -23.730 655 HA ILE 106 HA ILE 106 80.379 34.866 -20.940 656 HB ILE 106 HB ILE 106 79.993 33.065 -23.356 657 HG12 ILE 106 HG12 ILE 106 77.598 33.588 -22.917 658 HG13 ILE 106 HG13 ILE 106 78.077 34.658 -21.599 659 HG21 ILE 106 HG21 ILE 106 79.046 32.529 -20.502 660 HG22 ILE 106 HG22 ILE 106 78.480 31.672 -21.952 661 HG23 ILE 106 HG23 ILE 106 80.160 31.523 -21.459 662 HD11 ILE 106 HD11 ILE 106 78.813 35.057 -24.523 663 HD12 ILE 106 HD12 ILE 106 77.454 35.842 -23.702 664 HD13 ILE 106 HD13 ILE 106 79.108 36.220 -23.203 665 H PHE 107 H PHE 107 82.697 32.971 -22.961 666 HA PHE 107 HA PHE 107 83.724 31.323 -20.893 667 HB2 PHE 107 HB2 PHE 107 85.404 32.663 -23.041 668 HB3 PHE 107 HB3 PHE 107 85.771 31.176 -22.191 669 HD1 PHE 107 HD1 PHE 107 82.848 29.941 -22.578 670 HD2 PHE 107 HD2 PHE 107 85.733 31.814 -25.176 671 HE1 PHE 107 HE1 PHE 107 81.978 28.624 -24.489 672 HE2 PHE 107 HE2 PHE 107 84.825 30.522 -27.109 673 HZ PHE 107 HZ PHE 107 82.960 28.909 -26.755 674 H ARG 108 H ARG 108 84.799 34.625 -21.825 675 HA ARG 108 HA ARG 108 86.907 34.766 -19.916 676 HB2 ARG 108 HB2 ARG 108 86.600 35.887 -22.146 677 HB3 ARG 108 HB3 ARG 108 85.490 37.034 -21.396 678 HG2 ARG 108 HG2 ARG 108 88.367 36.575 -20.496 679 HG3 ARG 108 HG3 ARG 108 87.921 37.705 -21.776 680 HD2 ARG 108 HD2 ARG 108 86.513 38.982 -20.173 681 HD3 ARG 108 HD3 ARG 108 87.057 37.906 -18.867 682 HE ARG 108 HE ARG 108 89.332 38.973 -20.231 683 HH11 ARG 108 HH11 ARG 108 86.885 40.050 -17.957 684 HH12 ARG 108 HH12 ARG 108 87.929 41.267 -17.276 685 HH21 ARG 108 HH21 ARG 108 90.605 40.541 -19.316 686 HH22 ARG 108 HH22 ARG 108 89.981 41.534 -18.032 687 H ARG 109 H ARG 109 83.542 36.029 -19.750 688 HA ARG 109 HA ARG 109 83.868 37.132 -17.047 689 HB2 ARG 109 HB2 ARG 109 81.454 36.412 -18.759 690 HB3 ARG 109 HB3 ARG 109 81.303 37.029 -17.110 691 HG2 ARG 109 HG2 ARG 109 82.391 39.094 -17.643 692 HG3 ARG 109 HG3 ARG 109 82.851 38.526 -19.255 693 HD2 ARG 109 HD2 ARG 109 80.516 38.483 -19.977 694 HD3 ARG 109 HD3 ARG 109 79.961 38.758 -18.327 695 HE ARG 109 HE ARG 109 80.264 41.003 -18.560 696 HH11 ARG 109 HH11 ARG 109 82.228 39.587 -21.098 697 HH12 ARG 109 HH12 ARG 109 82.595 41.144 -21.796 698 HH21 ARG 109 HH21 ARG 109 80.773 42.933 -19.493 699 HH22 ARG 109 HH22 ARG 109 81.784 42.989 -20.904 700 H TYR 110 H TYR 110 82.760 34.021 -18.307 701 HA TYR 110 HA TYR 110 82.391 32.960 -15.539 702 HB2 TYR 110 HB2 TYR 110 80.681 32.402 -17.977 703 HB3 TYR 110 HB3 TYR 110 80.402 31.897 -16.327 704 HD1 TYR 110 HD2 TYR 110 80.393 33.984 -14.552 705 HD2 TYR 110 HD1 TYR 110 79.437 34.201 -18.753 706 HE1 TYR 110 HE2 TYR 110 79.129 36.105 -14.175 707 HE2 TYR 110 HE1 TYR 110 78.134 36.288 -18.359 708 HH TYR 110 HH TYR 110 77.449 37.858 -16.801 709 HA PRO 111 HA PRO 111 85.423 30.379 -17.908 710 HB2 PRO 111 HB2 PRO 111 87.101 29.697 -15.837 711 HB3 PRO 111 HB3 PRO 111 87.180 31.251 -16.720 712 HG2 PRO 111 HG2 PRO 111 85.764 30.675 -14.096 713 HG3 PRO 111 HG3 PRO 111 86.904 32.012 -14.467 714 HD2 PRO 111 HD2 PRO 111 84.235 32.393 -14.565 715 HD3 PRO 111 HD3 PRO 111 85.294 33.129 -15.808 716 H HIS 112 H HIS 112 83.329 29.578 -15.232 717 HA HIS 112 HA HIS 112 83.737 26.694 -15.305 718 HB2 HIS 112 HB2 HIS 112 81.962 26.609 -13.780 719 HB3 HIS 112 HB3 HIS 112 82.779 28.117 -13.385 720 HD2 HIS 112 HD2 HIS 112 79.438 26.717 -14.054 721 HE1 HIS 112 HE1 HIS 112 78.903 30.776 -15.206 722 HE2 HIS 112 HE2 HIS 112 77.723 28.663 -14.647 723 H LEU 113 H LEU 113 81.874 28.983 -17.226 724 HA LEU 113 HA LEU 113 79.894 27.132 -18.133 725 HB2 LEU 113 HB2 LEU 113 80.134 29.848 -17.824 726 HB3 LEU 113 HB3 LEU 113 80.487 29.729 -19.530 727 HG LEU 113 HG LEU 113 78.189 30.278 -19.170 728 HD11 LEU 113 HD11 LEU 113 78.203 27.332 -19.928 729 HD12 LEU 113 HD12 LEU 113 77.086 28.587 -20.473 730 HD13 LEU 113 HD13 LEU 113 78.765 28.633 -21.010 731 HD21 LEU 113 HD21 LEU 113 77.776 29.549 -16.971 732 HD22 LEU 113 HD22 LEU 113 76.608 28.779 -18.016 733 HD23 LEU 113 HD23 LEU 113 77.964 27.827 -17.403 734 H ARG 114 H ARG 114 83.063 28.052 -19.324 735 HA ARG 114 HA ARG 114 82.782 27.121 -22.052 736 HB2 ARG 114 HB2 ARG 114 84.525 28.732 -21.350 737 HB3 ARG 114 HB3 ARG 114 85.284 27.484 -20.353 738 HG2 ARG 114 HG2 ARG 114 85.797 26.130 -22.304 739 HG3 ARG 114 HG3 ARG 114 84.853 27.194 -23.361 740 HD2 ARG 114 HD2 ARG 114 86.448 29.014 -23.049 741 HD3 ARG 114 HD3 ARG 114 87.292 28.108 -21.792 742 HE ARG 114 HE ARG 114 88.438 26.914 -23.368 743 HH11 ARG 114 HH11 ARG 114 85.808 28.463 -25.129 744 HH12 ARG 114 HH12 ARG 114 86.426 27.917 -26.660 745 HH21 ARG 114 HH21 ARG 114 89.146 26.287 -25.351 746 HH22 ARG 114 HH22 ARG 114 88.268 26.736 -26.782 Start of MODEL 4 1 H1 MET 1 H1 MET 1 69.599 103.203 28.111 2 H2 MET 1 H2 MET 1 68.925 103.901 26.796 3 H3 MET 1 H3 MET 1 70.449 103.327 26.716 4 HA MET 1 HA MET 1 68.908 101.850 25.572 5 HB2 MET 1 HB2 MET 1 69.575 99.724 26.640 6 HB3 MET 1 HB3 MET 1 70.897 100.819 26.296 7 HG2 MET 1 HG2 MET 1 71.058 101.438 28.683 8 HG3 MET 1 HG3 MET 1 69.709 100.363 29.064 9 HE1 MET 1 HE1 MET 1 71.121 99.221 30.953 10 HE2 MET 1 HE2 MET 1 72.749 98.553 30.706 11 HE3 MET 1 HE3 MET 1 72.482 100.306 30.583 12 H ARG 2 H ARG 2 66.748 102.683 25.754 13 HA ARG 2 HA ARG 2 65.002 100.923 27.311 14 HB2 ARG 2 HB2 ARG 2 63.764 102.638 28.466 15 HB3 ARG 2 HB3 ARG 2 65.452 102.733 28.936 16 HG2 ARG 2 HG2 ARG 2 65.757 104.650 27.324 17 HG3 ARG 2 HG3 ARG 2 64.022 104.604 26.984 18 HD2 ARG 2 HD2 ARG 2 65.286 105.056 29.716 19 HD3 ARG 2 HD3 ARG 2 64.665 106.333 28.657 20 HE ARG 2 HE ARG 2 62.479 104.708 28.911 21 HH11 ARG 2 HH11 ARG 2 64.492 106.278 31.314 22 HH12 ARG 2 HH12 ARG 2 63.206 106.337 32.488 23 HH21 ARG 2 HH21 ARG 2 60.888 104.797 30.461 24 HH22 ARG 2 HH22 ARG 2 61.214 105.528 32.004 25 H GLY 3 H GLY 3 62.728 101.193 26.796 26 HA2 GLY 3 HA2 GLY 3 60.914 101.664 25.427 27 HA3 GLY 3 HA3 GLY 3 61.916 102.657 24.380 28 H SER 4 H SER 4 59.937 100.823 23.552 29 HA SER 4 HA SER 4 61.437 98.908 21.841 30 HB2 SER 4 HB2 SER 4 59.077 98.155 23.620 31 HB3 SER 4 HB3 SER 4 59.804 97.117 22.383 32 HG SER 4 HG SER 4 60.607 96.652 24.492 33 H HIS 5 H HIS 5 60.153 98.044 20.087 34 HA HIS 5 HA HIS 5 57.667 99.541 19.368 35 HB2 HIS 5 HB2 HIS 5 59.995 98.891 17.519 36 HB3 HIS 5 HB3 HIS 5 58.445 99.566 17.016 37 HD2 HIS 5 HD2 HIS 5 57.842 102.108 18.008 38 HE1 HIS 5 HE1 HIS 5 61.915 103.203 18.661 39 HE2 HIS 5 HE2 HIS 5 59.531 104.079 18.479 40 H HIS 6 H HIS 6 56.202 98.417 18.022 41 HA HIS 6 HA HIS 6 56.409 95.435 18.074 42 HB2 HIS 6 HB2 HIS 6 54.278 95.326 19.176 43 HB3 HIS 6 HB3 HIS 6 55.313 96.381 20.117 44 HD2 HIS 6 HD2 HIS 6 51.917 96.232 18.663 45 HE1 HIS 6 HE1 HIS 6 52.568 100.410 19.231 46 HE2 HIS 6 HE2 HIS 6 50.820 98.628 18.723 47 H HIS 7 H HIS 7 54.341 94.466 17.086 48 HA HIS 7 HA HIS 7 53.236 93.909 15.200 49 HB2 HIS 7 HB2 HIS 7 51.813 95.680 16.215 50 HB3 HIS 7 HB3 HIS 7 52.493 96.840 15.077 51 HD2 HIS 7 HD2 HIS 7 50.765 97.246 13.195 52 HE1 HIS 7 HE1 HIS 7 49.257 93.289 12.665 53 HE2 HIS 7 HE2 HIS 7 49.118 95.695 11.838 54 H HIS 8 H HIS 8 55.794 93.911 14.627 55 HA HIS 8 HA HIS 8 56.471 95.426 12.227 56 HB2 HIS 8 HB2 HIS 8 57.809 92.985 13.456 57 HB3 HIS 8 HB3 HIS 8 58.503 94.059 12.245 58 HD2 HIS 8 HD2 HIS 8 58.144 93.640 15.966 59 HE1 HIS 8 HE1 HIS 8 59.707 97.577 15.450 60 HE2 HIS 8 HE2 HIS 8 59.178 95.752 17.155 61 H HIS 9 H HIS 9 54.790 92.447 12.770 62 HA HIS 9 HA HIS 9 55.604 91.070 10.387 63 HB2 HIS 9 HB2 HIS 9 53.242 90.522 12.220 64 HB3 HIS 9 HB3 HIS 9 53.981 89.391 11.091 65 HD2 HIS 9 HD2 HIS 9 56.346 88.285 11.793 66 HE1 HIS 9 HE1 HIS 9 56.491 89.791 15.783 67 HE2 HIS 9 HE2 HIS 9 57.549 88.162 14.136 68 H HIS 10 H HIS 10 54.634 90.741 8.458 69 HA HIS 10 HA HIS 10 51.882 91.523 7.890 70 HB2 HIS 10 HB2 HIS 10 52.372 93.050 6.085 71 HB3 HIS 10 HB3 HIS 10 53.097 93.670 7.556 72 HD2 HIS 10 HD2 HIS 10 55.833 93.572 7.733 73 HE1 HIS 10 HE1 HIS 10 56.533 92.828 3.590 74 HE2 HIS 10 HE2 HIS 10 57.619 93.497 5.795 75 H GLY 11 H GLY 11 51.173 90.796 5.748 76 HA2 GLY 11 HA2 GLY 11 52.559 89.544 3.754 77 HA3 GLY 11 HA3 GLY 11 52.377 88.248 4.936 78 H SER 28 H SER 28 51.354 88.005 2.422 79 HA SER 28 HA SER 28 48.557 87.413 3.016 80 HB2 SER 28 HB2 SER 28 48.518 89.755 2.053 81 HB3 SER 28 HB3 SER 28 49.188 89.085 0.552 82 HG SER 28 HG SER 28 46.858 89.216 0.557 83 H VAL 29 H VAL 29 47.642 85.902 1.468 84 HA VAL 29 HA VAL 29 49.698 84.072 0.417 85 HB VAL 29 HB VAL 29 47.872 83.280 1.884 86 HG11 VAL 29 HG11 VAL 29 46.054 83.590 -0.536 87 HG12 VAL 29 HG12 VAL 29 45.650 82.844 1.020 88 HG13 VAL 29 HG13 VAL 29 45.970 84.582 0.936 89 HG21 VAL 29 HG21 VAL 29 49.154 81.745 0.427 90 HG22 VAL 29 HG22 VAL 29 47.499 81.196 0.730 91 HG23 VAL 29 HG23 VAL 29 47.908 81.922 -0.832 92 H SER 30 H SER 30 49.933 83.388 -1.691 93 HA SER 30 HA SER 30 49.003 85.174 -3.810 94 HB2 SER 30 HB2 SER 30 50.634 82.614 -3.960 95 HB3 SER 30 HB3 SER 30 50.358 83.758 -5.287 96 HG SER 30 HG SER 30 52.368 84.140 -4.217 97 H PHE 31 H PHE 31 47.829 84.565 -5.676 98 HA PHE 31 HA PHE 31 46.147 82.100 -5.486 99 HB2 PHE 31 HB2 PHE 31 45.265 84.878 -6.332 100 HB3 PHE 31 HB3 PHE 31 44.311 83.415 -6.524 101 HD1 PHE 31 HD1 PHE 31 43.476 82.152 -4.522 102 HD2 PHE 31 HD2 PHE 31 45.430 85.982 -4.157 103 HE1 PHE 31 HE1 PHE 31 42.575 82.396 -2.219 104 HE2 PHE 31 HE2 PHE 31 44.528 86.220 -1.856 105 HZ PHE 31 HZ PHE 31 43.099 84.429 -0.885 106 H GLY 32 H GLY 32 45.629 81.062 -7.393 107 HA2 GLY 32 HA2 GLY 32 45.996 80.276 -9.548 108 HA3 GLY 32 HA3 GLY 32 46.730 81.813 -9.996 109 H ALA 33 H ALA 33 47.942 79.816 -11.091 110 HA ALA 33 HA ALA 33 50.558 79.612 -9.761 111 HB1 ALA 33 HB1 ALA 33 48.951 77.161 -10.622 112 HB2 ALA 33 HB2 ALA 33 50.640 77.141 -10.080 113 HB3 ALA 33 HB3 ALA 33 49.358 77.613 -8.952 114 HA PRO 34 HA PRO 34 51.884 80.022 -14.019 115 HB2 PRO 34 HB2 PRO 34 54.434 79.042 -13.957 116 HB3 PRO 34 HB3 PRO 34 53.962 80.583 -13.177 117 HG2 PRO 34 HG2 PRO 34 54.220 77.847 -11.882 118 HG3 PRO 34 HG3 PRO 34 54.914 79.403 -11.323 119 HD2 PRO 34 HD2 PRO 34 52.582 78.435 -10.318 120 HD3 PRO 34 HD3 PRO 34 52.808 80.187 -10.594 121 H SER 35 H SER 35 52.049 78.845 -15.937 122 HA SER 35 HA SER 35 50.967 76.181 -15.902 123 HB2 SER 35 HB2 SER 35 52.068 77.804 -18.223 124 HB3 SER 35 HB3 SER 35 51.100 76.324 -18.357 125 HG SER 35 HG SER 35 49.809 78.235 -18.546 126 HA PRO 36 HA PRO 36 54.801 73.809 -16.293 127 HB2 PRO 36 HB2 PRO 36 53.881 71.468 -17.337 128 HB3 PRO 36 HB3 PRO 36 53.510 71.982 -15.662 129 HG2 PRO 36 HG2 PRO 36 51.782 72.331 -18.139 130 HG3 PRO 36 HG3 PRO 36 51.309 71.643 -16.552 131 HD2 PRO 36 HD2 PRO 36 50.835 74.247 -17.198 132 HD3 PRO 36 HD3 PRO 36 51.281 73.770 -15.533 133 H LEU 37 H LEU 37 56.149 72.775 -17.972 134 HA LEU 37 HA LEU 37 55.524 73.489 -20.788 135 HB2 LEU 37 HB2 LEU 37 56.791 75.323 -19.755 136 HB3 LEU 37 HB3 LEU 37 58.108 74.235 -19.346 137 HG LEU 37 HG LEU 37 57.202 74.486 -22.233 138 HD11 LEU 37 HD11 LEU 37 59.074 76.417 -20.798 139 HD12 LEU 37 HD12 LEU 37 58.782 76.357 -22.553 140 HD13 LEU 37 HD13 LEU 37 57.468 76.800 -21.456 141 HD21 LEU 37 HD21 LEU 37 58.988 72.801 -21.676 142 HD22 LEU 37 HD22 LEU 37 59.590 74.093 -22.716 143 HD23 LEU 37 HD23 LEU 37 59.965 74.101 -20.981 144 H SER 38 H SER 38 55.853 71.878 -22.111 145 HA SER 38 HA SER 38 57.756 69.658 -21.487 146 HB2 SER 38 HB2 SER 38 54.841 69.303 -22.289 147 HB3 SER 38 HB3 SER 38 56.023 68.011 -22.008 148 HG SER 38 HG SER 38 54.677 68.364 -20.177 149 H SER 39 H SER 39 57.941 71.852 -23.427 150 HA SER 39 HA SER 39 56.919 71.122 -25.951 151 HB2 SER 39 HB2 SER 39 59.126 73.117 -25.345 152 HB3 SER 39 HB3 SER 39 58.062 73.092 -26.766 153 HG SER 39 HG SER 39 57.253 74.572 -25.256 154 H GLU 40 H GLU 40 59.749 69.814 -24.568 155 HA GLU 40 HA GLU 40 60.768 68.972 -27.253 156 HB2 GLU 40 HB2 GLU 40 62.444 69.824 -24.864 157 HB3 GLU 40 HB3 GLU 40 63.062 69.044 -26.325 158 HG2 GLU 40 HG2 GLU 40 62.205 70.947 -27.692 159 HG3 GLU 40 HG3 GLU 40 61.669 71.757 -26.216 160 H SER 41 H SER 41 61.200 66.868 -27.511 161 HA SER 41 HA SER 41 61.592 64.992 -25.297 162 HB2 SER 41 HB2 SER 41 59.626 63.616 -25.851 163 HB3 SER 41 HB3 SER 41 59.151 65.219 -25.282 164 HG SER 41 HG SER 41 57.959 64.588 -27.146 165 H GLU 42 H GLU 42 61.831 62.735 -26.091 166 HA GLU 42 HA GLU 42 62.803 61.150 -27.359 167 HB2 GLU 42 HB2 GLU 42 60.560 61.824 -28.533 168 HB3 GLU 42 HB3 GLU 42 61.611 62.363 -29.841 169 HG2 GLU 42 HG2 GLU 42 62.571 60.032 -29.944 170 HG3 GLU 42 HG3 GLU 42 61.507 59.568 -28.617 171 H ASP 43 H ASP 43 64.409 63.698 -27.079 172 HA ASP 43 HA ASP 43 65.952 63.969 -29.476 173 HB2 ASP 43 HB2 ASP 43 65.573 65.735 -27.754 174 HB3 ASP 43 HB3 ASP 43 66.610 64.839 -26.642 175 H GLU 44 H GLU 44 66.226 61.762 -26.905 176 HA GLU 44 HA GLU 44 68.749 60.616 -28.026 177 HB2 GLU 44 HB2 GLU 44 68.981 62.158 -25.946 178 HB3 GLU 44 HB3 GLU 44 68.296 60.813 -25.038 179 HG2 GLU 44 HG2 GLU 44 70.207 59.388 -25.715 180 HG3 GLU 44 HG3 GLU 44 70.775 60.641 -26.818 181 H ILE 45 H ILE 45 65.716 59.833 -27.974 182 HA ILE 45 HA ILE 45 65.839 57.250 -26.512 183 HB ILE 45 HB ILE 45 63.467 58.764 -27.620 184 HG12 ILE 45 HG12 ILE 45 64.393 60.067 -25.801 185 HG13 ILE 45 HG13 ILE 45 62.894 59.316 -25.299 186 HG21 ILE 45 HG21 ILE 45 63.591 56.272 -25.872 187 HG22 ILE 45 HG22 ILE 45 62.127 57.235 -26.152 188 HG23 ILE 45 HG23 ILE 45 62.906 56.423 -27.505 189 HD11 ILE 45 HD11 ILE 45 65.696 58.384 -24.520 190 HD12 ILE 45 HD12 ILE 45 64.541 59.252 -23.500 191 HD13 ILE 45 HD13 ILE 45 64.178 57.599 -24.019 192 H ASN 46 H ASN 46 65.683 55.346 -27.433 193 HA ASN 46 HA ASN 46 65.733 53.678 -28.930 194 HB2 ASN 46 HB2 ASN 46 63.329 54.364 -28.908 195 HB3 ASN 46 HB3 ASN 46 63.613 55.263 -30.400 196 HD21 ASN 46 HD22 ASN 46 61.894 53.811 -31.258 197 HD22 ASN 46 HD21 ASN 46 62.361 52.200 -31.785 198 H TYR 47 H TYR 47 67.920 55.125 -29.318 199 HA TYR 47 HA TYR 47 68.388 54.971 -32.269 200 HB2 TYR 47 HB2 TYR 47 69.875 56.664 -30.246 201 HB3 TYR 47 HB3 TYR 47 70.217 56.567 -31.968 202 HD1 TYR 47 HD2 TYR 47 68.004 56.967 -33.529 203 HD2 TYR 47 HD1 TYR 47 68.709 58.591 -29.595 204 HE1 TYR 47 HE2 TYR 47 66.380 58.800 -33.992 205 HE2 TYR 47 HE1 TYR 47 67.085 60.427 -30.069 206 HH TYR 47 HH TYR 47 65.537 61.271 -31.536 207 H MET 48 H MET 48 68.409 52.705 -30.448 208 HA MET 48 HA MET 48 71.183 51.730 -30.904 209 HB2 MET 48 HB2 MET 48 71.187 50.561 -28.800 210 HB3 MET 48 HB3 MET 48 71.015 52.286 -28.539 211 HG2 MET 48 HG2 MET 48 68.730 50.270 -28.442 212 HG3 MET 48 HG3 MET 48 69.632 50.813 -27.043 213 HE1 MET 48 HE1 MET 48 69.935 53.989 -27.383 214 HE2 MET 48 HE2 MET 48 68.476 54.490 -26.505 215 HE3 MET 48 HE3 MET 48 69.449 53.137 -25.896 216 H THR 49 H THR 49 71.441 49.503 -31.237 217 HA THR 49 HA THR 49 69.024 47.985 -32.134 218 HB THR 49 HB THR 49 70.371 47.401 -34.200 219 HG1 THR 49 HG1 THR 49 71.981 48.863 -34.785 220 HG21 THR 49 HG21 THR 49 69.600 50.335 -33.928 221 HG22 THR 49 HG22 THR 49 69.706 49.380 -35.422 222 HG23 THR 49 HG23 THR 49 68.463 49.000 -34.222 223 HA PRO 50 HA PRO 50 71.911 45.137 -29.799 224 HB2 PRO 50 HB2 PRO 50 70.053 44.079 -28.069 225 HB3 PRO 50 HB3 PRO 50 70.992 45.565 -27.733 226 HG2 PRO 50 HG2 PRO 50 68.187 45.347 -28.879 227 HG3 PRO 50 HG3 PRO 50 68.747 46.378 -27.523 228 HD2 PRO 50 HD2 PRO 50 68.497 47.356 -30.042 229 HD3 PRO 50 HD3 PRO 50 69.856 47.866 -28.994 230 HA PRO 51 HA PRO 51 70.575 41.846 -32.408 231 HB2 PRO 51 HB2 PRO 51 71.779 39.630 -31.363 232 HB3 PRO 51 HB3 PRO 51 72.685 40.987 -32.096 233 HG2 PRO 51 HG2 PRO 51 72.130 40.504 -29.152 234 HG3 PRO 51 HG3 PRO 51 73.695 40.898 -29.930 235 HD2 PRO 51 HD2 PRO 51 72.133 42.806 -28.758 236 HD3 PRO 51 HD3 PRO 51 73.079 43.150 -30.237 237 H GLU 52 H GLU 52 68.561 41.141 -32.613 238 HA GLU 52 HA GLU 52 67.298 39.382 -30.564 239 HB2 GLU 52 HB2 GLU 52 66.001 41.813 -31.869 240 HB3 GLU 52 HB3 GLU 52 65.142 40.575 -30.951 241 HG2 GLU 52 HG2 GLU 52 66.522 41.128 -28.942 242 HG3 GLU 52 HG3 GLU 52 67.276 42.447 -29.845 243 H GLN 53 H GLN 53 65.965 37.794 -31.367 244 HA GLN 53 HA GLN 53 65.565 37.600 -34.329 245 HB2 GLN 53 HB2 GLN 53 66.540 35.414 -32.449 246 HB3 GLN 53 HB3 GLN 53 66.111 35.188 -34.152 247 HG2 GLN 53 HG2 GLN 53 67.880 36.818 -34.807 248 HG3 GLN 53 HG3 GLN 53 68.388 36.922 -33.118 249 HE21 GLN 53 HE22 GLN 53 70.353 36.202 -34.800 250 HE22 GLN 53 HE21 GLN 53 70.665 34.475 -34.686 251 H GLU 54 H GLU 54 63.738 38.265 -31.922 252 HA GLU 54 HA GLU 54 61.694 37.778 -31.063 253 HB2 GLU 54 HB2 GLU 54 61.124 36.729 -33.853 254 HB3 GLU 54 HB3 GLU 54 59.934 37.229 -32.649 255 HG2 GLU 54 HG2 GLU 54 60.896 39.529 -32.662 256 HG3 GLU 54 HG3 GLU 54 62.008 39.043 -33.945 257 H ALA 55 H ALA 55 63.657 35.761 -30.560 258 HA ALA 55 HA ALA 55 61.952 33.362 -30.033 259 HB1 ALA 55 HB1 ALA 55 64.827 33.423 -31.044 260 HB2 ALA 55 HB2 ALA 55 63.901 31.969 -30.604 261 HB3 ALA 55 HB3 ALA 55 63.391 32.963 -31.982 262 H GLN 56 H GLN 56 61.634 34.612 -28.020 263 HA GLN 56 HA GLN 56 63.567 33.829 -25.937 264 HB2 GLN 56 HB2 GLN 56 64.315 36.076 -26.736 265 HB3 GLN 56 HB3 GLN 56 62.751 36.747 -26.277 266 HG2 GLN 56 HG2 GLN 56 63.186 36.086 -23.903 267 HG3 GLN 56 HG3 GLN 56 64.726 35.370 -24.387 268 HE21 GLN 56 HE22 GLN 56 66.423 36.898 -25.279 269 HE22 GLN 56 HE21 GLN 56 66.362 38.570 -24.742 270 HA PRO 57 HA PRO 57 59.032 33.459 -25.072 271 HB2 PRO 57 HB2 PRO 57 58.740 30.804 -24.825 272 HB3 PRO 57 HB3 PRO 57 59.084 31.578 -26.412 273 HG2 PRO 57 HG2 PRO 57 61.104 30.281 -24.541 274 HG3 PRO 57 HG3 PRO 57 60.836 29.947 -26.282 275 HD2 PRO 57 HD2 PRO 57 62.720 31.734 -25.383 276 HD3 PRO 57 HD3 PRO 57 61.843 31.947 -26.927 277 H GLY 58 H GLY 58 59.867 34.748 -23.288 278 HA2 GLY 58 HA2 GLY 58 59.722 35.097 -20.913 279 HA3 GLY 58 HA3 GLY 58 60.059 33.394 -20.620 280 H ALA 59 H ALA 59 61.416 35.701 -19.529 281 HA ALA 59 HA ALA 59 64.163 35.529 -20.707 282 HB1 ALA 59 HB1 ALA 59 62.741 37.906 -19.477 283 HB2 ALA 59 HB2 ALA 59 64.353 37.907 -20.236 284 HB3 ALA 59 HB3 ALA 59 62.910 37.605 -21.226 285 H LEU 60 H LEU 60 62.954 34.056 -18.382 286 HA LEU 60 HA LEU 60 64.353 34.968 -15.985 287 HB2 LEU 60 HB2 LEU 60 62.888 32.392 -16.705 288 HB3 LEU 60 HB3 LEU 60 63.709 32.614 -15.181 289 HG LEU 60 HG LEU 60 61.374 32.922 -14.873 290 HD11 LEU 60 HD11 LEU 60 62.686 35.659 -14.663 291 HD12 LEU 60 HD12 LEU 60 61.317 35.041 -13.724 292 HD13 LEU 60 HD13 LEU 60 62.918 34.317 -13.515 293 HD21 LEU 60 HD21 LEU 60 60.746 33.709 -17.153 294 HD22 LEU 60 HD22 LEU 60 60.025 34.649 -15.839 295 HD23 LEU 60 HD23 LEU 60 61.394 35.321 -16.737 296 H ALA 61 H ALA 61 66.027 33.860 -14.915 297 HA ALA 61 HA ALA 61 67.680 31.945 -16.395 298 HB1 ALA 61 HB1 ALA 61 68.697 34.643 -15.398 299 HB2 ALA 61 HB2 ALA 61 69.749 33.300 -15.889 300 HB3 ALA 61 HB3 ALA 61 68.664 34.039 -17.075 301 H ALA 62 H ALA 62 69.106 30.730 -15.137 302 HA ALA 62 HA ALA 62 68.512 30.640 -12.219 303 HB1 ALA 62 HB1 ALA 62 69.850 28.596 -14.029 304 HB2 ALA 62 HB2 ALA 62 69.470 28.387 -12.309 305 HB3 ALA 62 HB3 ALA 62 68.157 28.569 -13.488 306 H LEU 63 H LEU 63 70.157 30.511 -10.678 307 HA LEU 63 HA LEU 63 72.868 31.496 -11.438 308 HB2 LEU 63 HB2 LEU 63 71.151 32.476 -9.124 309 HB3 LEU 63 HB3 LEU 63 72.817 32.947 -9.428 310 HG LEU 63 HG LEU 63 70.446 33.608 -11.232 311 HD11 LEU 63 HD11 LEU 63 72.109 35.360 -9.377 312 HD12 LEU 63 HD12 LEU 63 70.772 35.893 -10.417 313 HD13 LEU 63 HD13 LEU 63 70.450 34.803 -9.061 314 HD21 LEU 63 HD21 LEU 63 72.447 33.505 -12.599 315 HD22 LEU 63 HD22 LEU 63 72.090 35.201 -12.282 316 HD23 LEU 63 HD23 LEU 63 73.385 34.397 -11.383 317 H HIS 64 H HIS 64 74.533 31.049 -9.894 318 HA HIS 64 HA HIS 64 74.210 28.585 -8.288 319 HB2 HIS 64 HB2 HIS 64 76.508 30.457 -8.884 320 HB3 HIS 64 HB3 HIS 64 76.650 29.123 -7.747 321 HD2 HIS 64 HD2 HIS 64 77.070 29.934 -11.361 322 HE1 HIS 64 HE1 HIS 64 77.002 25.666 -11.164 323 HE2 HIS 64 HE2 HIS 64 77.585 27.671 -12.615 324 H ALA 65 H ALA 65 74.132 28.509 -6.054 325 HA ALA 65 HA ALA 65 73.419 31.053 -4.714 326 HB1 ALA 65 HB1 ALA 65 72.985 28.152 -3.905 327 HB2 ALA 65 HB2 ALA 65 72.289 29.586 -3.121 328 HB3 ALA 65 HB3 ALA 65 71.823 29.178 -4.782 329 H GLU 66 H GLU 66 76.196 29.049 -4.793 330 HA GLU 66 HA GLU 66 77.288 30.220 -2.307 331 HB2 GLU 66 HB2 GLU 66 77.859 28.065 -1.351 332 HB3 GLU 66 HB3 GLU 66 76.119 28.203 -1.554 333 HG2 GLU 66 HG2 GLU 66 76.243 26.799 -3.613 334 HG3 GLU 66 HG3 GLU 66 77.991 26.658 -3.402 335 H GLY 67 H GLY 67 79.597 29.566 -1.937 336 HA2 GLY 67 HA2 GLY 67 81.792 29.319 -2.623 337 HA3 GLY 67 HA3 GLY 67 81.203 28.551 -4.093 338 HA PRO 68 HA PRO 68 83.193 32.645 -5.130 339 HB2 PRO 68 HB2 PRO 68 84.681 31.826 -7.288 340 HB3 PRO 68 HB3 PRO 68 85.202 31.618 -5.589 341 HG2 PRO 68 HG2 PRO 68 83.812 29.584 -7.366 342 HG3 PRO 68 HG3 PRO 68 85.298 29.363 -6.387 343 HD2 PRO 68 HD2 PRO 68 82.884 28.582 -5.461 344 HD3 PRO 68 HD3 PRO 68 84.069 29.347 -4.359 345 H LEU 69 H LEU 69 81.153 30.456 -6.908 346 HA LEU 69 HA LEU 69 80.514 32.458 -8.995 347 HB2 LEU 69 HB2 LEU 69 79.577 29.601 -8.593 348 HB3 LEU 69 HB3 LEU 69 79.100 30.633 -9.934 349 HG LEU 69 HG LEU 69 81.957 29.741 -9.397 350 HD11 LEU 69 HD11 LEU 69 79.946 28.820 -11.477 351 HD12 LEU 69 HD12 LEU 69 81.621 28.248 -11.291 352 HD13 LEU 69 HD13 LEU 69 80.427 27.901 -10.035 353 HD21 LEU 69 HD21 LEU 69 81.979 31.839 -10.626 354 HD22 LEU 69 HD22 LEU 69 82.349 30.524 -11.738 355 HD23 LEU 69 HD23 LEU 69 80.727 31.242 -11.750 356 H ALA 70 H ALA 70 79.493 32.271 -5.842 357 HA ALA 70 HA ALA 70 76.714 32.102 -6.014 358 HB1 ALA 70 HB1 ALA 70 78.390 33.848 -4.154 359 HB2 ALA 70 HB2 ALA 70 76.699 33.370 -3.891 360 HB3 ALA 70 HB3 ALA 70 77.976 32.141 -3.897 361 H GLY 71 H GLY 71 75.219 33.201 -6.950 362 HA2 GLY 71 HA2 GLY 71 73.950 34.997 -7.748 363 HA3 GLY 71 HA3 GLY 71 75.266 36.116 -7.404 364 H LEU 72 H LEU 72 76.513 33.500 -9.189 365 HA LEU 72 HA LEU 72 76.376 35.015 -11.749 366 HB2 LEU 72 HB2 LEU 72 78.408 32.928 -10.889 367 HB3 LEU 72 HB3 LEU 72 78.493 33.935 -12.295 368 HG LEU 72 HG LEU 72 78.870 34.786 -9.415 369 HD11 LEU 72 HD11 LEU 72 80.620 35.106 -11.892 370 HD12 LEU 72 HD12 LEU 72 81.059 35.477 -10.210 371 HD13 LEU 72 HD13 LEU 72 80.781 33.803 -10.706 372 HD21 LEU 72 HD21 LEU 72 77.575 36.617 -10.437 373 HD22 LEU 72 HD22 LEU 72 79.255 37.092 -10.222 374 HD23 LEU 72 HD23 LEU 72 78.669 36.638 -11.832 375 HA PRO 73 HA PRO 73 73.852 32.170 -13.645 376 HB2 PRO 73 HB2 PRO 73 74.540 32.168 -16.277 377 HB3 PRO 73 HB3 PRO 73 74.035 33.664 -15.422 378 HG2 PRO 73 HG2 PRO 73 76.836 32.670 -16.026 379 HG3 PRO 73 HG3 PRO 73 76.161 34.312 -16.272 380 HD2 PRO 73 HD2 PRO 73 77.626 33.563 -14.097 381 HD3 PRO 73 HD3 PRO 73 76.366 34.845 -14.017 382 H VAL 74 H VAL 74 73.351 30.124 -14.679 383 HA VAL 74 HA VAL 74 75.501 28.128 -14.198 384 HB VAL 74 HB VAL 74 72.528 27.644 -14.423 385 HG11 VAL 74 HG11 VAL 74 74.803 25.942 -13.323 386 HG12 VAL 74 HG12 VAL 74 73.073 25.554 -13.209 387 HG13 VAL 74 HG13 VAL 74 73.850 25.611 -14.789 388 HG21 VAL 74 HG21 VAL 74 72.948 29.108 -12.489 389 HG22 VAL 74 HG22 VAL 74 72.565 27.479 -11.949 390 HG23 VAL 74 HG23 VAL 74 74.250 28.038 -11.936 391 H THR 75 H THR 75 73.247 29.072 -16.835 392 HA THR 75 HA THR 75 74.802 27.286 -18.679 393 HB THR 75 HB THR 75 72.863 26.970 -19.991 394 HG1 THR 75 HG1 THR 75 70.857 27.985 -19.224 395 HG21 THR 75 HG21 THR 75 71.928 26.750 -17.114 396 HG22 THR 75 HG22 THR 75 71.427 25.769 -18.514 397 HG23 THR 75 HG23 THR 75 73.086 25.641 -17.882 398 H ARG 76 H ARG 76 74.620 27.887 -21.039 399 HA ARG 76 HA ARG 76 75.860 30.426 -21.543 400 HB2 ARG 76 HB2 ARG 76 75.906 28.182 -22.844 401 HB3 ARG 76 HB3 ARG 76 74.363 28.667 -23.540 402 HG2 ARG 76 HG2 ARG 76 75.589 30.741 -24.461 403 HG3 ARG 76 HG3 ARG 76 77.095 29.987 -23.876 404 HD2 ARG 76 HD2 ARG 76 76.318 27.867 -25.145 405 HD3 ARG 76 HD3 ARG 76 75.097 28.902 -25.901 406 HE ARG 76 HE ARG 76 77.842 29.917 -26.211 407 HH11 ARG 76 HH11 ARG 76 75.424 27.792 -27.664 408 HH12 ARG 76 HH12 ARG 76 76.356 27.599 -29.121 409 HH21 ARG 76 HH21 ARG 76 79.046 29.385 -27.959 410 HH22 ARG 76 HH22 ARG 76 78.333 28.552 -29.326 411 H SER 77 H SER 77 72.505 29.317 -21.948 412 HA SER 77 HA SER 77 71.346 31.770 -22.846 413 HB2 SER 77 HB2 SER 77 70.080 29.569 -21.165 414 HB3 SER 77 HB3 SER 77 69.228 30.806 -22.111 415 HG SER 77 HG SER 77 69.413 28.805 -23.260 416 H ASP 78 H ASP 78 71.804 30.470 -19.462 417 HA ASP 78 HA ASP 78 70.633 32.732 -18.159 418 HB2 ASP 78 HB2 ASP 78 72.932 30.987 -17.220 419 HB3 ASP 78 HB3 ASP 78 72.038 32.124 -16.221 420 H ALA 79 H ALA 79 74.090 32.151 -19.099 421 HA ALA 79 HA ALA 79 75.047 34.628 -18.110 422 HB1 ALA 79 HB1 ALA 79 76.110 32.847 -20.349 423 HB2 ALA 79 HB2 ALA 79 77.015 34.142 -19.542 424 HB3 ALA 79 HB3 ALA 79 76.506 32.719 -18.615 425 H ARG 80 H ARG 80 73.733 33.905 -21.398 426 HA ARG 80 HA ARG 80 74.117 36.594 -22.375 427 HB2 ARG 80 HB2 ARG 80 73.680 34.620 -23.815 428 HB3 ARG 80 HB3 ARG 80 72.017 34.541 -23.211 429 HG2 ARG 80 HG2 ARG 80 71.544 36.778 -24.143 430 HG3 ARG 80 HG3 ARG 80 73.237 36.955 -24.641 431 HD2 ARG 80 HD2 ARG 80 73.004 35.086 -26.205 432 HD3 ARG 80 HD3 ARG 80 71.328 34.818 -25.671 433 HE ARG 80 HE ARG 80 71.479 37.511 -26.485 434 HH11 ARG 80 HH11 ARG 80 71.828 34.413 -28.079 435 HH12 ARG 80 HH12 ARG 80 71.282 35.028 -29.612 436 HH21 ARG 80 HH21 ARG 80 70.735 38.236 -28.470 437 HH22 ARG 80 HH22 ARG 80 70.684 37.141 -29.815 438 H VAL 81 H VAL 81 71.306 35.138 -20.660 439 HA VAL 81 HA VAL 81 69.654 37.496 -20.690 440 HB VAL 81 HB VAL 81 69.821 35.180 -18.728 441 HG11 VAL 81 HG11 VAL 81 67.770 37.440 -18.816 442 HG12 VAL 81 HG12 VAL 81 67.572 35.924 -17.918 443 HG13 VAL 81 HG13 VAL 81 68.847 37.041 -17.458 444 HG21 VAL 81 HG21 VAL 81 69.001 34.710 -21.044 445 HG22 VAL 81 HG22 VAL 81 67.777 34.444 -19.792 446 HG23 VAL 81 HG23 VAL 81 67.716 35.910 -20.803 447 H LEU 82 H LEU 82 71.952 36.346 -18.166 448 HA LEU 82 HA LEU 82 71.649 38.640 -16.532 449 HB2 LEU 82 HB2 LEU 82 73.745 36.467 -16.762 450 HB3 LEU 82 HB3 LEU 82 74.103 37.883 -15.800 451 HG LEU 82 HG LEU 82 73.310 36.156 -14.368 452 HD11 LEU 82 HD11 LEU 82 71.028 38.154 -14.561 453 HD12 LEU 82 HD12 LEU 82 71.635 37.327 -13.126 454 HD13 LEU 82 HD13 LEU 82 72.638 38.561 -13.906 455 HD21 LEU 82 HD21 LEU 82 71.911 34.788 -15.755 456 HD22 LEU 82 HD22 LEU 82 70.967 35.344 -14.377 457 HD23 LEU 82 HD23 LEU 82 70.726 36.104 -15.960 458 H ILE 83 H ILE 83 74.087 38.150 -19.156 459 HA ILE 83 HA ILE 83 75.306 40.728 -18.934 460 HB ILE 83 HB ILE 83 74.821 38.876 -21.284 461 HG12 ILE 83 HG12 ILE 83 77.407 39.779 -19.929 462 HG13 ILE 83 HG13 ILE 83 76.497 38.367 -19.408 463 HG21 ILE 83 HG21 ILE 83 76.283 41.562 -21.386 464 HG22 ILE 83 HG22 ILE 83 76.333 40.324 -22.654 465 HG23 ILE 83 HG23 ILE 83 74.825 41.134 -22.303 466 HD11 ILE 83 HD11 ILE 83 77.825 38.722 -22.120 467 HD12 ILE 83 HD12 ILE 83 78.292 37.625 -20.813 468 HD13 ILE 83 HD13 ILE 83 76.767 37.358 -21.679 469 H PHE 84 H PHE 84 72.413 39.764 -20.874 470 HA PHE 84 HA PHE 84 71.947 42.345 -21.886 471 HB2 PHE 84 HB2 PHE 84 71.009 40.136 -22.708 472 HB3 PHE 84 HB3 PHE 84 69.861 40.186 -21.384 473 HD1 PHE 84 HD1 PHE 84 71.141 42.694 -23.919 474 HD2 PHE 84 HD2 PHE 84 67.699 40.797 -22.139 475 HE1 PHE 84 HE1 PHE 84 69.704 43.844 -25.524 476 HE2 PHE 84 HE2 PHE 84 66.225 42.052 -23.697 477 HZ PHE 84 HZ PHE 84 67.214 43.562 -25.411 478 H ASN 85 H ASN 85 70.396 40.824 -18.993 479 HA ASN 85 HA ASN 85 68.756 43.121 -18.456 480 HB2 ASN 85 HB2 ASN 85 68.192 40.868 -17.647 481 HB3 ASN 85 HB3 ASN 85 69.628 40.850 -16.614 482 HD21 ASN 85 HD22 ASN 85 69.609 42.139 -14.657 483 HD22 ASN 85 HD21 ASN 85 68.245 43.160 -14.236 484 H GLU 86 H GLU 86 71.963 42.112 -17.125 485 HA GLU 86 HA GLU 86 72.293 44.257 -15.262 486 HB2 GLU 86 HB2 GLU 86 73.773 42.265 -15.385 487 HB3 GLU 86 HB3 GLU 86 74.361 42.804 -16.966 488 HG2 GLU 86 HG2 GLU 86 75.165 44.944 -15.792 489 HG3 GLU 86 HG3 GLU 86 74.800 44.132 -14.268 490 H TRP 87 H TRP 87 73.360 44.005 -18.741 491 HA TRP 87 HA TRP 87 74.266 46.690 -18.904 492 HB2 TRP 87 HB2 TRP 87 74.918 45.098 -20.558 493 HB3 TRP 87 HB3 TRP 87 73.247 44.729 -20.958 494 HD1 TRP 87 HD1 TRP 87 75.756 47.657 -21.366 495 HE1 TRP 87 HE1 TRP 87 75.145 48.894 -23.527 496 HE3 TRP 87 HE3 TRP 87 71.453 45.157 -22.561 497 HZ2 TRP 87 HZ2 TRP 87 73.177 48.684 -25.615 498 HZ3 TRP 87 HZ3 TRP 87 70.313 45.634 -24.667 499 HH2 TRP 87 HH2 TRP 87 71.120 47.414 -26.210 500 H GLU 88 H GLU 88 70.961 45.370 -19.725 501 HA GLU 88 HA GLU 88 69.864 47.786 -20.629 502 HB2 GLU 88 HB2 GLU 88 68.720 45.329 -19.297 503 HB3 GLU 88 HB3 GLU 88 67.685 46.710 -19.573 504 HG2 GLU 88 HG2 GLU 88 69.291 45.584 -21.873 505 HG3 GLU 88 HG3 GLU 88 67.786 44.833 -21.358 506 H GLU 89 H GLU 89 69.857 46.633 -17.175 507 HA GLU 89 HA GLU 89 68.487 49.024 -16.250 508 HB2 GLU 89 HB2 GLU 89 70.154 46.954 -14.754 509 HB3 GLU 89 HB3 GLU 89 69.246 48.268 -13.991 510 HG2 GLU 89 HG2 GLU 89 67.152 47.397 -15.077 511 HG3 GLU 89 HG3 GLU 89 68.072 46.019 -15.676 512 H ARG 90 H ARG 90 71.943 48.070 -16.239 513 HA ARG 90 HA ARG 90 72.955 50.476 -15.009 514 HB2 ARG 90 HB2 ARG 90 74.217 48.540 -16.995 515 HB3 ARG 90 HB3 ARG 90 75.107 49.821 -16.171 516 HG2 ARG 90 HG2 ARG 90 73.590 47.631 -14.738 517 HG3 ARG 90 HG3 ARG 90 75.290 47.502 -15.195 518 HD2 ARG 90 HD2 ARG 90 74.080 49.546 -13.277 519 HD3 ARG 90 HD3 ARG 90 75.040 48.147 -12.818 520 HE ARG 90 HE ARG 90 76.019 50.594 -14.272 521 HH11 ARG 90 HH11 ARG 90 77.008 47.715 -12.487 522 HH12 ARG 90 HH12 ARG 90 78.675 48.224 -12.516 523 HH21 ARG 90 HH21 ARG 90 77.947 51.117 -14.295 524 HH22 ARG 90 HH22 ARG 90 79.239 50.178 -13.527 525 H LYS 91 H LYS 91 72.589 49.630 -18.408 526 HA LYS 91 HA LYS 91 73.379 52.159 -19.502 527 HB2 LYS 91 HB2 LYS 91 73.222 50.060 -20.846 528 HB3 LYS 91 HB3 LYS 91 71.477 50.028 -20.610 529 HG2 LYS 91 HG2 LYS 91 72.083 50.622 -22.861 530 HG3 LYS 91 HG3 LYS 91 71.122 51.874 -22.082 531 HD2 LYS 91 HD2 LYS 91 72.978 53.316 -21.832 532 HD3 LYS 91 HD3 LYS 91 74.156 52.070 -22.223 533 HE2 LYS 91 HE2 LYS 91 72.078 53.100 -24.205 534 HE3 LYS 91 HE3 LYS 91 73.661 53.841 -24.007 535 HZ1 LYS 91 HZ1 LYS 91 73.187 51.046 -24.909 536 HZ2 LYS 91 HZ2 LYS 91 73.788 52.275 -25.801 537 HZ3 LYS 91 HZ3 LYS 91 74.688 51.652 -24.583 538 H LYS 92 H LYS 92 70.084 51.107 -18.449 539 HA LYS 92 HA LYS 92 68.765 53.535 -19.170 540 HB2 LYS 92 HB2 LYS 92 67.674 51.440 -18.462 541 HB3 LYS 92 HB3 LYS 92 68.212 51.681 -16.805 542 HG2 LYS 92 HG2 LYS 92 66.590 53.823 -18.193 543 HG3 LYS 92 HG3 LYS 92 65.802 52.351 -17.628 544 HD2 LYS 92 HD2 LYS 92 66.582 52.751 -15.324 545 HD3 LYS 92 HD3 LYS 92 67.372 54.254 -15.834 546 HE2 LYS 92 HE2 LYS 92 65.185 55.149 -16.603 547 HE3 LYS 92 HE3 LYS 92 64.394 53.650 -16.105 548 HZ1 LYS 92 HZ1 LYS 92 65.793 55.529 -14.261 549 HZ2 LYS 92 HZ2 LYS 92 64.176 55.370 -14.400 550 HZ3 LYS 92 HZ3 LYS 92 65.060 54.139 -13.801 551 H SER 93 H SER 93 70.748 52.754 -16.267 552 HA SER 93 HA SER 93 70.639 55.549 -15.350 553 HB2 SER 93 HB2 SER 93 72.414 53.246 -14.493 554 HB3 SER 93 HB3 SER 93 72.346 54.840 -13.721 555 HG SER 93 HG SER 93 70.958 53.308 -12.682 556 H GLU 94 H GLU 94 72.668 53.931 -17.654 557 HA GLU 94 HA GLU 94 74.713 56.117 -17.683 558 HB2 GLU 94 HB2 GLU 94 75.172 53.112 -17.882 559 HB3 GLU 94 HB3 GLU 94 76.382 54.371 -18.033 560 HG2 GLU 94 HG2 GLU 94 75.812 55.106 -15.681 561 HG3 GLU 94 HG3 GLU 94 74.751 53.693 -15.583 562 HA PRO 95 HA PRO 95 72.860 55.528 -21.884 563 HB2 PRO 95 HB2 PRO 95 73.314 58.093 -22.870 564 HB3 PRO 95 HB3 PRO 95 71.910 57.566 -21.900 565 HG2 PRO 95 HG2 PRO 95 74.460 58.888 -20.930 566 HG3 PRO 95 HG3 PRO 95 72.764 59.317 -20.528 567 HD2 PRO 95 HD2 PRO 95 74.213 57.815 -18.843 568 HD3 PRO 95 HD3 PRO 95 72.508 57.382 -19.161 569 H TRP 96 H TRP 96 76.077 55.757 -21.055 570 HA TRP 96 HA TRP 96 77.167 55.707 -23.821 571 HB2 TRP 96 HB2 TRP 96 79.350 55.846 -22.575 572 HB3 TRP 96 HB3 TRP 96 78.269 57.212 -22.381 573 HD1 TRP 96 HD1 TRP 96 79.615 54.205 -20.404 574 HE1 TRP 96 HE1 TRP 96 79.275 54.616 -17.884 575 HE3 TRP 96 HE3 TRP 96 76.931 58.566 -20.636 576 HZ2 TRP 96 HZ2 TRP 96 78.015 56.577 -16.197 577 HZ3 TRP 96 HZ3 TRP 96 76.157 59.674 -18.551 578 HH2 TRP 96 HH2 TRP 96 76.683 58.688 -16.331 579 H LEU 97 H LEU 97 76.152 53.352 -21.473 580 HA LEU 97 HA LEU 97 78.316 51.637 -21.522 581 HB2 LEU 97 HB2 LEU 97 76.114 51.787 -20.034 582 HB3 LEU 97 HB3 LEU 97 75.479 50.637 -21.180 583 HG LEU 97 HG LEU 97 77.354 49.119 -20.662 584 HD11 LEU 97 HD11 LEU 97 77.983 51.123 -18.453 585 HD12 LEU 97 HD12 LEU 97 78.614 49.464 -18.534 586 HD13 LEU 97 HD13 LEU 97 79.074 50.631 -19.770 587 HD21 LEU 97 HD21 LEU 97 75.132 48.966 -19.528 588 HD22 LEU 97 HD22 LEU 97 76.441 48.460 -18.440 589 HD23 LEU 97 HD23 LEU 97 75.723 50.086 -18.291 590 H ARG 98 H ARG 98 78.979 49.866 -22.596 591 HA ARG 98 HA ARG 98 77.740 49.226 -25.232 592 HB2 ARG 98 HB2 ARG 98 80.491 48.411 -24.228 593 HB3 ARG 98 HB3 ARG 98 79.908 48.429 -25.888 594 HG2 ARG 98 HG2 ARG 98 80.549 50.831 -24.129 595 HG3 ARG 98 HG3 ARG 98 81.466 50.260 -25.514 596 HD2 ARG 98 HD2 ARG 98 79.710 50.931 -27.060 597 HD3 ARG 98 HD3 ARG 98 78.592 51.249 -25.736 598 HE ARG 98 HE ARG 98 79.643 53.216 -25.171 599 HH11 ARG 98 HH11 ARG 98 81.515 51.737 -27.756 600 HH12 ARG 98 HH12 ARG 98 82.434 53.188 -28.046 601 HH21 ARG 98 HH21 ARG 98 80.845 55.032 -25.611 602 HH22 ARG 98 HH22 ARG 98 82.058 55.007 -26.858 603 H LEU 99 H LEU 99 77.810 47.036 -25.995 604 HA LEU 99 HA LEU 99 77.119 44.975 -23.951 605 HB2 LEU 99 HB2 LEU 99 75.216 46.305 -24.625 606 HB3 LEU 99 HB3 LEU 99 75.497 46.031 -26.312 607 HG LEU 99 HG LEU 99 73.548 44.863 -25.289 608 HD11 LEU 99 HD11 LEU 99 75.499 42.813 -26.371 609 HD12 LEU 99 HD12 LEU 99 73.750 42.956 -26.652 610 HD13 LEU 99 HD13 LEU 99 74.840 44.109 -27.384 611 HD21 LEU 99 HD21 LEU 99 74.760 44.328 -23.127 612 HD22 LEU 99 HD22 LEU 99 73.578 43.213 -23.778 613 HD23 LEU 99 HD23 LEU 99 75.338 42.872 -23.969 614 H ASP 100 H ASP 100 77.882 42.956 -24.484 615 HA ASP 100 HA ASP 100 78.468 42.270 -27.309 616 HB2 ASP 100 HB2 ASP 100 80.567 43.147 -26.309 617 HB3 ASP 100 HB3 ASP 100 80.463 41.924 -25.042 618 H MET 101 H MET 101 77.820 40.287 -27.818 619 HA MET 101 HA MET 101 77.184 38.300 -25.674 620 HB2 MET 101 HB2 MET 101 75.486 39.026 -28.092 621 HB3 MET 101 HB3 MET 101 75.181 37.655 -27.014 622 HG2 MET 101 HG2 MET 101 74.958 39.179 -25.093 623 HG3 MET 101 HG3 MET 101 75.228 40.568 -26.153 624 HE1 MET 101 HE1 MET 101 72.870 41.727 -25.271 625 HE2 MET 101 HE2 MET 101 71.421 40.709 -25.137 626 HE3 MET 101 HE3 MET 101 72.868 40.316 -24.182 627 H SER 102 H SER 102 79.342 38.767 -28.069 628 HA SER 102 HA SER 102 79.312 36.180 -29.401 629 HB2 SER 102 HB2 SER 102 81.549 38.170 -28.863 630 HB3 SER 102 HB3 SER 102 81.734 36.684 -29.814 631 HG SER 102 HG SER 102 81.251 38.559 -31.117 632 H ASP 103 H ASP 103 80.503 34.307 -28.863 633 HA ASP 103 HA ASP 103 80.093 33.583 -26.221 634 HB2 ASP 103 HB2 ASP 103 80.667 32.294 -28.617 635 HB3 ASP 103 HB3 ASP 103 82.087 31.922 -27.671 636 H LYS 104 H LYS 104 83.065 34.863 -27.555 637 HA LYS 104 HA LYS 104 84.917 34.233 -25.481 638 HB2 LYS 104 HB2 LYS 104 84.706 36.670 -27.302 639 HB3 LYS 104 HB3 LYS 104 86.073 36.334 -26.231 640 HG2 LYS 104 HG2 LYS 104 86.492 34.182 -27.394 641 HG3 LYS 104 HG3 LYS 104 85.120 34.484 -28.463 642 HD2 LYS 104 HD2 LYS 104 87.126 35.026 -29.651 643 HD3 LYS 104 HD3 LYS 104 86.250 36.529 -29.334 644 HE2 LYS 104 HE2 LYS 104 87.773 37.016 -27.425 645 HE3 LYS 104 HE3 LYS 104 88.608 35.479 -27.691 646 HZ1 LYS 104 HZ1 LYS 104 88.517 37.728 -29.647 647 HZ2 LYS 104 HZ2 LYS 104 89.804 37.330 -28.726 648 HZ3 LYS 104 HZ3 LYS 104 89.292 36.307 -29.888 649 H ALA 105 H ALA 105 82.380 36.734 -25.509 650 HA ALA 105 HA ALA 105 83.240 38.087 -23.111 651 HB1 ALA 105 HB1 ALA 105 80.456 37.791 -24.309 652 HB2 ALA 105 HB2 ALA 105 80.952 38.967 -23.077 653 HB3 ALA 105 HB3 ALA 105 81.636 39.053 -24.709 654 H ILE 106 H ILE 106 81.234 35.217 -23.683 655 HA ILE 106 HA ILE 106 80.477 34.894 -20.890 656 HB ILE 106 HB ILE 106 80.191 33.102 -23.334 657 HG12 ILE 106 HG12 ILE 106 77.792 33.528 -23.048 658 HG13 ILE 106 HG13 ILE 106 78.107 34.573 -21.663 659 HG21 ILE 106 HG21 ILE 106 79.209 32.604 -20.486 660 HG22 ILE 106 HG22 ILE 106 78.702 31.688 -21.923 661 HG23 ILE 106 HG23 ILE 106 80.378 31.619 -21.396 662 HD11 ILE 106 HD11 ILE 106 79.072 35.190 -24.485 663 HD12 ILE 106 HD12 ILE 106 77.527 35.753 -23.809 664 HD13 ILE 106 HD13 ILE 106 79.044 36.292 -23.085 665 H PHE 107 H PHE 107 82.863 33.244 -23.055 666 HA PHE 107 HA PHE 107 84.024 31.548 -21.118 667 HB2 PHE 107 HB2 PHE 107 85.592 33.105 -23.204 668 HB3 PHE 107 HB3 PHE 107 86.059 31.596 -22.445 669 HD1 PHE 107 HD2 PHE 107 83.152 30.273 -22.867 670 HD2 PHE 107 HD1 PHE 107 86.007 32.311 -25.378 671 HE1 PHE 107 HE2 PHE 107 82.294 29.046 -24.843 672 HE2 PHE 107 HE1 PHE 107 85.116 31.096 -27.368 673 HZ PHE 107 HZ PHE 107 83.282 29.442 -27.087 674 H ARG 108 H ARG 108 84.947 34.957 -21.838 675 HA ARG 108 HA ARG 108 87.061 34.997 -19.918 676 HB2 ARG 108 HB2 ARG 108 86.811 36.194 -22.117 677 HB3 ARG 108 HB3 ARG 108 85.696 37.326 -21.353 678 HG2 ARG 108 HG2 ARG 108 88.497 36.805 -20.289 679 HG3 ARG 108 HG3 ARG 108 88.213 37.903 -21.636 680 HD2 ARG 108 HD2 ARG 108 86.774 39.338 -20.232 681 HD3 ARG 108 HD3 ARG 108 86.981 38.244 -18.872 682 HE ARG 108 HE ARG 108 89.135 38.991 -18.496 683 HH11 ARG 108 HH11 ARG 108 88.040 40.505 -21.474 684 HH12 ARG 108 HH12 ARG 108 89.374 41.625 -21.489 685 HH21 ARG 108 HH21 ARG 108 90.795 40.442 -18.589 686 HH22 ARG 108 HH22 ARG 108 90.892 41.586 -19.895 687 H ARG 109 H ARG 109 83.720 36.317 -19.772 688 HA ARG 109 HA ARG 109 84.085 37.406 -17.080 689 HB2 ARG 109 HB2 ARG 109 82.458 38.289 -18.772 690 HB3 ARG 109 HB3 ARG 109 81.523 36.791 -18.611 691 HG2 ARG 109 HG2 ARG 109 81.241 37.281 -16.171 692 HG3 ARG 109 HG3 ARG 109 82.079 38.820 -16.385 693 HD2 ARG 109 HD2 ARG 109 79.675 38.182 -18.121 694 HD3 ARG 109 HD3 ARG 109 79.457 38.537 -16.405 695 HE ARG 109 HE ARG 109 80.965 40.493 -18.057 696 HH11 ARG 109 HH11 ARG 109 78.033 39.760 -16.233 697 HH12 ARG 109 HH12 ARG 109 77.692 41.463 -15.975 698 HH21 ARG 109 HH21 ARG 109 80.263 42.672 -17.797 699 HH22 ARG 109 HH22 ARG 109 78.734 42.945 -16.956 700 H TYR 110 H TYR 110 82.742 34.378 -18.368 701 HA TYR 110 HA TYR 110 82.359 33.306 -15.603 702 HB2 TYR 110 HB2 TYR 110 80.686 32.780 -18.076 703 HB3 TYR 110 HB3 TYR 110 80.427 32.139 -16.474 704 HD1 TYR 110 HD1 TYR 110 80.370 34.135 -14.550 705 HD2 TYR 110 HD2 TYR 110 79.235 34.477 -18.700 706 HE1 TYR 110 HE1 TYR 110 78.897 36.065 -14.003 707 HE2 TYR 110 HE2 TYR 110 77.682 36.348 -18.123 708 HH TYR 110 HH TYR 110 77.289 37.547 -14.767 709 HA PRO 111 HA PRO 111 85.432 30.759 -17.995 710 HB2 PRO 111 HB2 PRO 111 87.251 30.280 -15.991 711 HB3 PRO 111 HB3 PRO 111 87.200 31.790 -16.950 712 HG2 PRO 111 HG2 PRO 111 85.943 31.276 -14.231 713 HG3 PRO 111 HG3 PRO 111 87.006 32.639 -14.719 714 HD2 PRO 111 HD2 PRO 111 84.322 32.912 -14.711 715 HD3 PRO 111 HD3 PRO 111 85.297 33.617 -16.039 716 H HIS 112 H HIS 112 83.384 30.009 -15.328 717 HA HIS 112 HA HIS 112 83.981 27.144 -15.216 718 HB2 HIS 112 HB2 HIS 112 82.216 27.059 -13.666 719 HB3 HIS 112 HB3 HIS 112 82.986 28.610 -13.356 720 HD2 HIS 112 HD2 HIS 112 79.682 27.071 -13.917 721 HE1 HIS 112 HE1 HIS 112 78.987 31.077 -15.151 722 HE2 HIS 112 HE2 HIS 112 77.889 28.959 -14.497 723 H LEU 113 H LEU 113 81.990 29.232 -17.223 724 HA LEU 113 HA LEU 113 79.856 27.437 -17.588 725 HB2 LEU 113 HB2 LEU 113 80.116 30.044 -17.649 726 HB3 LEU 113 HB3 LEU 113 80.538 29.831 -19.331 727 HG LEU 113 HG LEU 113 78.274 30.485 -19.116 728 HD11 LEU 113 HD11 LEU 113 78.099 27.520 -19.729 729 HD12 LEU 113 HD12 LEU 113 77.173 28.851 -20.429 730 HD13 LEU 113 HD13 LEU 113 78.879 28.692 -20.822 731 HD21 LEU 113 HD21 LEU 113 77.791 29.838 -16.858 732 HD22 LEU 113 HD22 LEU 113 76.561 29.227 -17.935 733 HD23 LEU 113 HD23 LEU 113 77.783 28.109 -17.300 734 H ARG 114 H ARG 114 82.448 28.413 -19.826 735 HA ARG 114 HA ARG 114 83.177 27.637 -21.867 736 HB2 ARG 114 HB2 ARG 114 82.743 24.923 -20.577 737 HB3 ARG 114 HB3 ARG 114 83.855 25.300 -21.889 738 HG2 ARG 114 HG2 ARG 114 84.071 26.298 -19.016 739 HG3 ARG 114 HG3 ARG 114 85.018 25.012 -19.754 740 HD2 ARG 114 HD2 ARG 114 86.031 26.601 -21.331 741 HD3 ARG 114 HD3 ARG 114 85.063 27.919 -20.661 742 HE ARG 114 HE ARG 114 86.168 27.557 -18.478 743 HH11 ARG 114 HH11 ARG 114 87.963 26.457 -21.295 744 HH12 ARG 114 HH12 ARG 114 89.485 26.545 -20.452 745 HH21 ARG 114 HH21 ARG 114 88.096 27.621 -17.490 746 HH22 ARG 114 HH22 ARG 114 89.557 27.199 -18.341 Start of MODEL 5 1 H1 MET 1 H1 MET 1 9.755 -2.868 -75.589 2 H2 MET 1 H2 MET 1 9.922 -2.169 -77.054 3 H3 MET 1 H3 MET 1 9.004 -1.452 -75.900 4 HA MET 1 HA MET 1 11.936 -1.840 -75.761 5 HB2 MET 1 HB2 MET 1 10.318 0.724 -76.166 6 HB3 MET 1 HB3 MET 1 12.027 0.684 -75.741 7 HG2 MET 1 HG2 MET 1 12.550 -0.536 -77.829 8 HG3 MET 1 HG3 MET 1 10.843 -0.509 -78.273 9 HE1 MET 1 HE1 MET 1 14.176 1.487 -77.974 10 HE2 MET 1 HE2 MET 1 13.680 3.159 -78.306 11 HE3 MET 1 HE3 MET 1 13.233 2.398 -76.768 12 H ARG 2 H ARG 2 12.998 -0.983 -73.888 13 HA ARG 2 HA ARG 2 11.374 -0.155 -71.563 14 HB2 ARG 2 HB2 ARG 2 12.396 -1.858 -70.088 15 HB3 ARG 2 HB3 ARG 2 11.280 -2.539 -71.254 16 HG2 ARG 2 HG2 ARG 2 12.928 -3.618 -72.476 17 HG3 ARG 2 HG3 ARG 2 14.220 -2.531 -71.975 18 HD2 ARG 2 HD2 ARG 2 12.886 -4.404 -69.982 19 HD3 ARG 2 HD3 ARG 2 14.193 -4.931 -71.033 20 HE ARG 2 HE ARG 2 15.732 -3.483 -70.014 21 HH11 ARG 2 HH11 ARG 2 12.710 -3.370 -68.234 22 HH12 ARG 2 HH12 ARG 2 13.370 -2.348 -66.990 23 HH21 ARG 2 HH21 ARG 2 16.554 -2.319 -68.338 24 HH22 ARG 2 HH22 ARG 2 15.525 -1.834 -67.015 25 H GLY 3 H GLY 3 12.571 0.654 -69.796 26 HA2 GLY 3 HA2 GLY 3 15.492 1.015 -69.976 27 HA3 GLY 3 HA3 GLY 3 14.537 2.487 -70.171 28 H SER 4 H SER 4 13.246 0.084 -67.966 29 HA SER 4 HA SER 4 13.477 1.976 -65.747 30 HB2 SER 4 HB2 SER 4 11.952 0.409 -64.611 31 HB3 SER 4 HB3 SER 4 11.353 0.899 -66.205 32 HG SER 4 HG SER 4 11.180 -1.385 -65.845 33 H HIS 5 H HIS 5 14.124 1.404 -63.604 34 HA HIS 5 HA HIS 5 15.830 -0.990 -63.221 35 HB2 HIS 5 HB2 HIS 5 17.605 0.235 -62.203 36 HB3 HIS 5 HB3 HIS 5 17.323 0.949 -63.782 37 HD2 HIS 5 HD2 HIS 5 17.557 1.811 -60.137 38 HE1 HIS 5 HE1 HIS 5 15.934 5.315 -61.953 39 HE2 HIS 5 HE2 HIS 5 16.947 4.357 -59.822 40 H HIS 6 H HIS 6 16.180 -1.514 -60.937 41 HA HIS 6 HA HIS 6 14.254 -0.342 -58.995 42 HB2 HIS 6 HB2 HIS 6 13.039 -2.136 -60.165 43 HB3 HIS 6 HB3 HIS 6 14.311 -3.284 -59.755 44 HD2 HIS 6 HD2 HIS 6 13.112 -4.860 -58.069 45 HE1 HIS 6 HE1 HIS 6 11.575 -1.968 -55.332 46 HE2 HIS 6 HE2 HIS 6 11.873 -4.459 -55.775 47 H HIS 7 H HIS 7 16.149 0.518 -58.069 48 HA HIS 7 HA HIS 7 17.262 -1.241 -56.010 49 HB2 HIS 7 HB2 HIS 7 18.900 -1.514 -57.852 50 HB3 HIS 7 HB3 HIS 7 19.100 0.235 -57.945 51 HD2 HIS 7 HD2 HIS 7 19.741 -2.724 -55.496 52 HE1 HIS 7 HE1 HIS 7 22.338 0.452 -54.319 53 HE2 HIS 7 HE2 HIS 7 21.692 -1.974 -53.887 54 H HIS 8 H HIS 8 17.813 -0.159 -54.156 55 HA HIS 8 HA HIS 8 18.263 2.721 -54.103 56 HB2 HIS 8 HB2 HIS 8 16.538 3.203 -52.428 57 HB3 HIS 8 HB3 HIS 8 15.829 2.699 -53.952 58 HD2 HIS 8 HD2 HIS 8 16.088 1.696 -50.278 59 HE1 HIS 8 HE1 HIS 8 13.527 -1.190 -52.099 60 HE2 HIS 8 HE2 HIS 8 14.431 -0.317 -49.884 61 H HIS 9 H HIS 9 19.387 3.414 -52.299 62 HA HIS 9 HA HIS 9 19.858 1.712 -49.972 63 HB2 HIS 9 HB2 HIS 9 21.458 0.766 -51.636 64 HB3 HIS 9 HB3 HIS 9 22.156 2.369 -51.868 65 HD2 HIS 9 HD2 HIS 9 24.391 2.573 -50.597 66 HE1 HIS 9 HE1 HIS 9 23.496 0.303 -47.096 67 HE2 HIS 9 HE2 HIS 9 25.275 1.693 -48.274 68 H HIS 10 H HIS 10 20.996 2.818 -48.281 69 HA HIS 10 HA HIS 10 21.918 5.564 -48.679 70 HB2 HIS 10 HB2 HIS 10 19.564 5.999 -48.175 71 HB3 HIS 10 HB3 HIS 10 19.637 4.951 -46.755 72 HD2 HIS 10 HD2 HIS 10 21.457 8.186 -48.033 73 HE1 HIS 10 HE1 HIS 10 21.310 8.389 -43.773 74 HE2 HIS 10 HE2 HIS 10 22.090 9.580 -45.883 75 H GLY 11 H GLY 11 23.558 6.101 -47.325 76 HA2 GLY 11 HA2 GLY 11 23.988 4.939 -44.716 77 HA3 GLY 11 HA3 GLY 11 25.041 4.191 -45.921 78 H SER 28 H SER 28 24.082 7.657 -45.905 79 HA SER 28 HA SER 28 26.749 8.496 -44.962 80 HB2 SER 28 HB2 SER 28 27.026 7.999 -47.397 81 HB3 SER 28 HB3 SER 28 25.790 9.220 -47.756 82 HG SER 28 HG SER 28 27.965 10.051 -47.861 83 H VAL 29 H VAL 29 26.846 10.541 -44.192 84 HA VAL 29 HA VAL 29 24.866 12.580 -44.758 85 HB VAL 29 HB VAL 29 23.669 11.326 -43.026 86 HG11 VAL 29 HG11 VAL 29 25.938 11.996 -41.110 87 HG12 VAL 29 HG12 VAL 29 24.398 11.214 -40.715 88 HG13 VAL 29 HG13 VAL 29 25.566 10.378 -41.744 89 HG21 VAL 29 HG21 VAL 29 23.387 13.781 -43.194 90 HG22 VAL 29 HG22 VAL 29 23.108 13.152 -41.563 91 HG23 VAL 29 HG23 VAL 29 24.624 13.993 -41.928 92 H SER 30 H SER 30 25.681 14.654 -44.381 93 HA SER 30 HA SER 30 28.143 15.069 -42.837 94 HB2 SER 30 HB2 SER 30 29.428 15.953 -44.739 95 HB3 SER 30 HB3 SER 30 29.054 14.238 -44.946 96 HG SER 30 HG SER 30 28.681 15.440 -46.876 97 H PHE 31 H PHE 31 28.804 17.284 -42.678 98 HA PHE 31 HA PHE 31 27.163 19.401 -43.853 99 HB2 PHE 31 HB2 PHE 31 25.938 18.951 -41.765 100 HB3 PHE 31 HB3 PHE 31 27.421 19.096 -40.832 101 HD1 PHE 31 HD2 PHE 31 25.076 21.004 -43.055 102 HD2 PHE 31 HD1 PHE 31 28.194 21.245 -40.082 103 HE1 PHE 31 HE2 PHE 31 24.741 23.461 -42.897 104 HE2 PHE 31 HE1 PHE 31 27.859 23.702 -39.932 105 HZ PHE 31 HZ PHE 31 26.134 24.814 -41.341 106 H GLY 32 H GLY 32 28.226 21.420 -43.910 107 HA2 GLY 32 HA2 GLY 32 30.621 22.099 -42.533 108 HA3 GLY 32 HA3 GLY 32 31.071 21.417 -44.101 109 H ALA 33 H ALA 33 28.384 23.597 -43.061 110 HA ALA 33 HA ALA 33 29.232 25.576 -45.140 111 HB1 ALA 33 HB1 ALA 33 26.436 24.479 -44.685 112 HB2 ALA 33 HB2 ALA 33 26.907 25.718 -45.870 113 HB3 ALA 33 HB3 ALA 33 27.521 24.064 -46.030 114 HA PRO 34 HA PRO 34 28.283 28.065 -41.286 115 HB2 PRO 34 HB2 PRO 34 30.744 29.108 -40.809 116 HB3 PRO 34 HB3 PRO 34 30.274 27.490 -40.204 117 HG2 PRO 34 HG2 PRO 34 31.826 28.144 -42.736 118 HG3 PRO 34 HG3 PRO 34 32.266 26.982 -41.442 119 HD2 PRO 34 HD2 PRO 34 30.990 26.201 -43.726 120 HD3 PRO 34 HD3 PRO 34 30.639 25.436 -42.147 121 H SER 35 H SER 35 28.544 30.475 -41.221 122 HA SER 35 HA SER 35 29.197 31.768 -43.835 123 HB2 SER 35 HB2 SER 35 26.763 31.333 -43.720 124 HB3 SER 35 HB3 SER 35 26.667 32.356 -42.277 125 HG SER 35 HG SER 35 26.237 33.487 -44.289 126 HA PRO 36 HA PRO 36 31.139 34.107 -40.365 127 HB2 PRO 36 HB2 PRO 36 33.709 34.159 -41.204 128 HB3 PRO 36 HB3 PRO 36 32.968 32.683 -40.529 129 HG2 PRO 36 HG2 PRO 36 33.284 33.405 -43.464 130 HG3 PRO 36 HG3 PRO 36 33.755 31.882 -42.645 131 HD2 PRO 36 HD2 PRO 36 31.367 32.192 -43.964 132 HD3 PRO 36 HD3 PRO 36 31.531 31.153 -42.516 133 H LEU 37 H LEU 37 29.470 35.502 -41.641 134 HA LEU 37 HA LEU 37 30.417 37.179 -43.754 135 HB2 LEU 37 HB2 LEU 37 28.260 37.956 -43.933 136 HB3 LEU 37 HB3 LEU 37 28.071 36.303 -43.381 137 HG LEU 37 HG LEU 37 27.770 38.835 -41.687 138 HD11 LEU 37 HD11 LEU 37 25.711 36.828 -42.684 139 HD12 LEU 37 HD12 LEU 37 25.391 38.247 -41.661 140 HD13 LEU 37 HD13 LEU 37 25.961 38.468 -43.321 141 HD21 LEU 37 HD21 LEU 37 28.519 37.022 -40.216 142 HD22 LEU 37 HD22 LEU 37 26.810 37.348 -39.949 143 HD23 LEU 37 HD23 LEU 37 27.289 35.930 -40.903 144 H SER 38 H SER 38 31.073 37.612 -40.491 145 HA SER 38 HA SER 38 30.617 40.366 -40.070 146 HB2 SER 38 HB2 SER 38 32.787 38.629 -38.839 147 HB3 SER 38 HB3 SER 38 32.158 40.157 -38.192 148 HG SER 38 HG SER 38 31.151 38.330 -37.204 149 H SER 39 H SER 39 31.731 42.207 -40.406 150 HA SER 39 HA SER 39 34.314 42.143 -41.909 151 HB2 SER 39 HB2 SER 39 33.375 43.917 -43.341 152 HB3 SER 39 HB3 SER 39 32.458 42.406 -43.435 153 HG SER 39 HG SER 39 31.080 44.253 -43.219 154 H GLU 40 H GLU 40 33.520 42.921 -38.971 155 HA GLU 40 HA GLU 40 33.710 45.741 -38.722 156 HB2 GLU 40 HB2 GLU 40 34.389 43.547 -36.721 157 HB3 GLU 40 HB3 GLU 40 34.225 45.261 -36.327 158 HG2 GLU 40 HG2 GLU 40 31.873 45.224 -37.150 159 HG3 GLU 40 HG3 GLU 40 32.014 43.491 -37.451 160 H SER 41 H SER 41 36.325 43.374 -38.989 161 HA SER 41 HA SER 41 38.454 45.301 -38.361 162 HB2 SER 41 HB2 SER 41 39.923 43.443 -39.180 163 HB3 SER 41 HB3 SER 41 38.867 43.012 -37.822 164 HG SER 41 HG SER 41 38.841 41.395 -39.469 165 H GLU 42 H GLU 42 37.165 43.735 -41.319 166 HA GLU 42 HA GLU 42 38.877 44.941 -43.219 167 HB2 GLU 42 HB2 GLU 42 35.958 44.161 -43.593 168 HB3 GLU 42 HB3 GLU 42 37.163 44.373 -44.867 169 HG2 GLU 42 HG2 GLU 42 38.497 42.503 -43.879 170 HG3 GLU 42 HG3 GLU 42 37.205 42.224 -42.705 171 H ASP 43 H ASP 43 36.016 46.295 -41.646 172 HA ASP 43 HA ASP 43 35.658 48.564 -43.330 173 HB2 ASP 43 HB2 ASP 43 34.003 47.611 -41.707 174 HB3 ASP 43 HB3 ASP 43 34.999 48.214 -40.382 175 H GLU 44 H GLU 44 38.180 47.937 -41.159 176 HA GLU 44 HA GLU 44 39.161 50.735 -41.402 177 HB2 GLU 44 HB2 GLU 44 39.878 50.818 -39.080 178 HB3 GLU 44 HB3 GLU 44 38.136 50.623 -39.208 179 HG2 GLU 44 HG2 GLU 44 38.319 48.232 -38.653 180 HG3 GLU 44 HG3 GLU 44 40.079 48.343 -38.652 181 H ILE 45 H ILE 45 39.911 47.570 -41.924 182 HA ILE 45 HA ILE 45 42.835 48.192 -42.166 183 HB ILE 45 HB ILE 45 41.516 45.540 -41.480 184 HG12 ILE 45 HG12 ILE 45 43.510 47.271 -39.937 185 HG13 ILE 45 HG13 ILE 45 41.785 47.166 -39.603 186 HG21 ILE 45 HG21 ILE 45 44.417 46.176 -42.190 187 HG22 ILE 45 HG22 ILE 45 43.885 44.656 -41.433 188 HG23 ILE 45 HG23 ILE 45 43.316 45.056 -43.030 189 HD11 ILE 45 HD11 ILE 45 43.804 44.938 -39.240 190 HD12 ILE 45 HD12 ILE 45 42.875 45.797 -38.008 191 HD13 ILE 45 HD13 ILE 45 42.037 44.718 -39.140 192 H ASN 46 H ASN 46 43.340 48.545 -44.201 193 HA ASN 46 HA ASN 46 41.832 47.334 -46.420 194 HB2 ASN 46 HB2 ASN 46 42.513 49.791 -46.221 195 HB3 ASN 46 HB3 ASN 46 44.157 49.282 -46.600 196 HD21 ASN 46 HD22 ASN 46 44.316 47.928 -48.715 197 HD22 ASN 46 HD21 ASN 46 43.302 48.502 -50.046 198 H TYR 47 H TYR 47 42.801 45.281 -45.216 199 HA TYR 47 HA TYR 47 44.080 43.424 -45.231 200 HB2 TYR 47 HB2 TYR 47 44.474 44.005 -48.166 201 HB3 TYR 47 HB3 TYR 47 44.325 42.441 -47.377 202 HD1 TYR 47 HD2 TYR 47 42.050 41.959 -46.128 203 HD2 TYR 47 HD1 TYR 47 42.573 45.029 -49.119 204 HE1 TYR 47 HE2 TYR 47 39.581 42.055 -46.471 205 HE2 TYR 47 HE1 TYR 47 40.111 45.121 -49.458 206 HH TYR 47 HH TYR 47 38.057 44.292 -48.829 207 H MET 48 H MET 48 45.723 45.849 -44.645 208 HA MET 48 HA MET 48 48.431 44.771 -45.303 209 HB2 MET 48 HB2 MET 48 47.481 46.662 -46.790 210 HB3 MET 48 HB3 MET 48 47.740 47.723 -45.404 211 HG2 MET 48 HG2 MET 48 50.164 47.153 -45.468 212 HG3 MET 48 HG3 MET 48 49.860 46.015 -46.783 213 HE1 MET 48 HE1 MET 48 51.835 47.152 -48.136 214 HE2 MET 48 HE2 MET 48 51.928 48.895 -48.471 215 HE3 MET 48 HE3 MET 48 52.092 48.302 -46.804 216 H THR 49 H THR 49 46.764 44.758 -42.737 217 HA THR 49 HA THR 49 48.793 46.043 -40.935 218 HB THR 49 HB THR 49 45.831 46.018 -40.341 219 HG1 THR 49 HG1 THR 49 46.036 48.286 -40.785 220 HG21 THR 49 HG21 THR 49 48.187 47.522 -39.104 221 HG22 THR 49 HG22 THR 49 46.480 47.677 -38.629 222 HG23 THR 49 HG23 THR 49 47.333 46.157 -38.356 223 HA PRO 50 HA PRO 50 48.423 41.591 -39.749 224 HB2 PRO 50 HB2 PRO 50 51.084 41.036 -39.477 225 HB3 PRO 50 HB3 PRO 50 50.253 41.042 -41.064 226 HG2 PRO 50 HG2 PRO 50 51.868 43.283 -39.799 227 HG3 PRO 50 HG3 PRO 50 52.021 42.611 -41.455 228 HD2 PRO 50 HD2 PRO 50 50.576 44.856 -40.929 229 HD3 PRO 50 HD3 PRO 50 50.045 43.680 -42.169 230 HA PRO 51 HA PRO 51 48.839 42.463 -35.387 231 HB2 PRO 51 HB2 PRO 51 49.236 40.004 -34.259 232 HB3 PRO 51 HB3 PRO 51 47.690 40.494 -35.017 233 HG2 PRO 51 HG2 PRO 51 49.950 38.897 -36.271 234 HG3 PRO 51 HG3 PRO 51 48.201 38.505 -36.249 235 HD2 PRO 51 HD2 PRO 51 49.360 39.730 -38.378 236 HD3 PRO 51 HD3 PRO 51 47.711 40.177 -37.847 237 H GLU 52 H GLU 52 50.315 42.759 -33.706 238 HA GLU 52 HA GLU 52 53.190 42.107 -34.239 239 HB2 GLU 52 HB2 GLU 52 53.805 44.377 -33.698 240 HB3 GLU 52 HB3 GLU 52 52.665 44.351 -35.037 241 HG2 GLU 52 HG2 GLU 52 50.820 45.002 -33.523 242 HG3 GLU 52 HG3 GLU 52 51.916 44.968 -32.142 243 H GLN 53 H GLN 53 50.981 41.216 -32.152 244 HA GLN 53 HA GLN 53 52.079 42.076 -29.608 245 HB2 GLN 53 HB2 GLN 53 49.680 41.586 -30.101 246 HB3 GLN 53 HB3 GLN 53 50.077 39.868 -30.236 247 HG2 GLN 53 HG2 GLN 53 50.783 39.834 -27.863 248 HG3 GLN 53 HG3 GLN 53 50.505 41.575 -27.739 249 HE21 GLN 53 HE22 GLN 53 48.202 42.348 -27.942 250 HE22 GLN 53 HE21 GLN 53 46.920 41.219 -27.530 251 H GLU 54 H GLU 54 52.666 39.332 -31.666 252 HA GLU 54 HA GLU 54 53.944 37.501 -31.657 253 HB2 GLU 54 HB2 GLU 54 55.609 38.928 -29.565 254 HB3 GLU 54 HB3 GLU 54 56.090 37.522 -30.512 255 HG2 GLU 54 HG2 GLU 54 55.784 38.844 -32.611 256 HG3 GLU 54 HG3 GLU 54 55.429 40.273 -31.638 257 H ALA 55 H ALA 55 52.786 38.237 -28.424 258 HA ALA 55 HA ALA 55 52.053 36.954 -26.728 259 HB1 ALA 55 HB1 ALA 55 51.251 35.101 -28.994 260 HB2 ALA 55 HB2 ALA 55 50.503 35.197 -27.385 261 HB3 ALA 55 HB3 ALA 55 50.392 36.574 -28.494 262 H GLN 56 H GLN 56 54.807 36.636 -26.945 263 HA GLN 56 HA GLN 56 55.176 34.033 -25.605 264 HB2 GLN 56 HB2 GLN 56 57.061 33.369 -27.013 265 HB3 GLN 56 HB3 GLN 56 55.556 33.490 -27.906 266 HG2 GLN 56 HG2 GLN 56 56.382 35.857 -28.644 267 HG3 GLN 56 HG3 GLN 56 57.959 35.340 -28.061 268 HE21 GLN 56 HE22 GLN 56 55.356 34.627 -30.403 269 HE22 GLN 56 HE21 GLN 56 56.385 33.691 -31.494 270 HA PRO 57 HA PRO 57 57.563 37.775 -24.034 271 HB2 PRO 57 HB2 PRO 57 56.229 38.527 -21.810 272 HB3 PRO 57 HB3 PRO 57 55.589 38.873 -23.450 273 HG2 PRO 57 HG2 PRO 57 54.871 36.513 -21.659 274 HG3 PRO 57 HG3 PRO 57 53.753 37.698 -22.415 275 HD2 PRO 57 HD2 PRO 57 54.319 35.319 -23.615 276 HD3 PRO 57 HD3 PRO 57 54.107 36.829 -24.553 277 H GLY 58 H GLY 58 58.878 38.133 -22.154 278 HA2 GLY 58 HA2 GLY 58 59.825 37.744 -20.092 279 HA3 GLY 58 HA3 GLY 58 58.916 36.257 -19.914 280 H ALA 59 H ALA 59 61.692 36.918 -19.314 281 HA ALA 59 HA ALA 59 62.895 34.438 -20.298 282 HB1 ALA 59 HB1 ALA 59 64.275 37.136 -20.691 283 HB2 ALA 59 HB2 ALA 59 65.015 35.543 -20.962 284 HB3 ALA 59 HB3 ALA 59 63.667 36.076 -21.982 285 H LEU 60 H LEU 60 64.355 33.565 -18.833 286 HA LEU 60 HA LEU 60 64.778 34.983 -16.225 287 HB2 LEU 60 HB2 LEU 60 63.976 32.083 -16.746 288 HB3 LEU 60 HB3 LEU 60 64.593 32.657 -15.219 289 HG LEU 60 HG LEU 60 62.303 32.419 -14.962 290 HD11 LEU 60 HD11 LEU 60 62.725 35.408 -15.314 291 HD12 LEU 60 HD12 LEU 60 61.541 34.601 -14.271 292 HD13 LEU 60 HD13 LEU 60 63.269 34.449 -13.916 293 HD21 LEU 60 HD21 LEU 60 61.626 32.530 -17.374 294 HD22 LEU 60 HD22 LEU 60 60.545 33.354 -16.237 295 HD23 LEU 60 HD23 LEU 60 61.646 34.306 -17.236 296 H ALA 61 H ALA 61 66.599 34.297 -14.987 297 HA ALA 61 HA ALA 61 68.620 32.646 -16.359 298 HB1 ALA 61 HB1 ALA 61 69.198 35.218 -14.844 299 HB2 ALA 61 HB2 ALA 61 70.413 34.092 -15.486 300 HB3 ALA 61 HB3 ALA 61 69.350 34.973 -16.595 301 H ALA 62 H ALA 62 69.156 30.918 -15.178 302 HA ALA 62 HA ALA 62 68.579 30.791 -12.279 303 HB1 ALA 62 HB1 ALA 62 69.674 28.697 -14.193 304 HB2 ALA 62 HB2 ALA 62 69.212 28.434 -12.500 305 HB3 ALA 62 HB3 ALA 62 67.977 28.878 -13.696 306 H LEU 63 H LEU 63 70.140 30.522 -10.688 307 HA LEU 63 HA LEU 63 72.904 31.412 -11.405 308 HB2 LEU 63 HB2 LEU 63 71.256 32.315 -9.019 309 HB3 LEU 63 HB3 LEU 63 72.861 32.881 -9.465 310 HG LEU 63 HG LEU 63 70.286 33.394 -11.020 311 HD11 LEU 63 HD11 LEU 63 72.063 35.253 -9.387 312 HD12 LEU 63 HD12 LEU 63 70.602 35.713 -10.288 313 HD13 LEU 63 HD13 LEU 63 70.472 34.634 -8.888 314 HD21 LEU 63 HD21 LEU 63 72.238 33.316 -12.551 315 HD22 LEU 63 HD22 LEU 63 71.616 34.949 -12.361 316 HD23 LEU 63 HD23 LEU 63 73.101 34.463 -11.506 317 H HIS 64 H HIS 64 74.564 30.975 -9.892 318 HA HIS 64 HA HIS 64 74.289 28.514 -8.266 319 HB2 HIS 64 HB2 HIS 64 76.548 30.426 -8.874 320 HB3 HIS 64 HB3 HIS 64 76.720 29.093 -7.742 321 HD2 HIS 64 HD2 HIS 64 77.024 29.933 -11.379 322 HE1 HIS 64 HE1 HIS 64 77.204 25.674 -11.177 323 HE2 HIS 64 HE2 HIS 64 77.644 27.712 -12.640 324 H ALA 65 H ALA 65 74.080 28.482 -6.046 325 HA ALA 65 HA ALA 65 73.348 31.032 -4.768 326 HB1 ALA 65 HB1 ALA 65 73.082 28.148 -3.833 327 HB2 ALA 65 HB2 ALA 65 72.330 29.575 -3.089 328 HB3 ALA 65 HB3 ALA 65 71.851 29.077 -4.722 329 H GLU 66 H GLU 66 76.163 29.022 -4.734 330 HA GLU 66 HA GLU 66 77.313 30.438 -2.408 331 HB2 GLU 66 HB2 GLU 66 77.846 28.393 -1.215 332 HB3 GLU 66 HB3 GLU 66 76.108 28.548 -1.414 333 HG2 GLU 66 HG2 GLU 66 76.175 26.914 -3.298 334 HG3 GLU 66 HG3 GLU 66 77.921 26.758 -3.093 335 H GLY 67 H GLY 67 79.618 29.691 -1.983 336 HA2 GLY 67 HA2 GLY 67 81.785 29.251 -2.675 337 HA3 GLY 67 HA3 GLY 67 81.132 28.452 -4.102 338 HA PRO 68 HA PRO 68 83.374 32.367 -5.299 339 HB2 PRO 68 HB2 PRO 68 84.782 31.388 -7.444 340 HB3 PRO 68 HB3 PRO 68 85.301 31.196 -5.742 341 HG2 PRO 68 HG2 PRO 68 83.763 29.209 -7.450 342 HG3 PRO 68 HG3 PRO 68 85.238 28.916 -6.471 343 HD2 PRO 68 HD2 PRO 68 82.784 28.329 -5.507 344 HD3 PRO 68 HD3 PRO 68 84.024 29.050 -4.437 345 H LEU 69 H LEU 69 81.182 30.282 -7.029 346 HA LEU 69 HA LEU 69 80.652 32.324 -9.115 347 HB2 LEU 69 HB2 LEU 69 79.595 29.501 -8.781 348 HB3 LEU 69 HB3 LEU 69 79.196 30.577 -10.112 349 HG LEU 69 HG LEU 69 81.984 29.512 -9.531 350 HD11 LEU 69 HD11 LEU 69 80.014 28.808 -11.735 351 HD12 LEU 69 HD12 LEU 69 81.628 28.108 -11.475 352 HD13 LEU 69 HD13 LEU 69 80.339 27.808 -10.303 353 HD21 LEU 69 HD21 LEU 69 82.156 31.662 -10.682 354 HD22 LEU 69 HD22 LEU 69 82.505 30.359 -11.819 355 HD23 LEU 69 HD23 LEU 69 80.923 31.159 -11.871 356 H ALA 70 H ALA 70 79.637 32.207 -5.988 357 HA ALA 70 HA ALA 70 76.863 32.064 -6.099 358 HB1 ALA 70 HB1 ALA 70 78.580 33.869 -4.337 359 HB2 ALA 70 HB2 ALA 70 76.896 33.398 -4.020 360 HB3 ALA 70 HB3 ALA 70 78.175 32.170 -4.014 361 H GLY 71 H GLY 71 75.339 33.142 -7.008 362 HA2 GLY 71 HA2 GLY 71 74.040 34.903 -7.825 363 HA3 GLY 71 HA3 GLY 71 75.352 36.043 -7.523 364 H LEU 72 H LEU 72 76.640 33.453 -9.283 365 HA LEU 72 HA LEU 72 76.451 34.938 -11.854 366 HB2 LEU 72 HB2 LEU 72 78.467 32.819 -11.036 367 HB3 LEU 72 HB3 LEU 72 78.551 33.861 -12.419 368 HG LEU 72 HG LEU 72 78.960 34.665 -9.538 369 HD11 LEU 72 HD11 LEU 72 80.707 34.971 -12.017 370 HD12 LEU 72 HD12 LEU 72 81.157 35.307 -10.331 371 HD13 LEU 72 HD13 LEU 72 80.844 33.646 -10.853 372 HD21 LEU 72 HD21 LEU 72 77.688 36.514 -10.551 373 HD22 LEU 72 HD22 LEU 72 79.378 36.967 -10.351 374 HD23 LEU 72 HD23 LEU 72 78.772 36.515 -11.956 375 HA PRO 73 HA PRO 73 73.859 32.178 -13.760 376 HB2 PRO 73 HB2 PRO 73 74.736 31.859 -16.345 377 HB3 PRO 73 HB3 PRO 73 74.160 33.419 -15.686 378 HG2 PRO 73 HG2 PRO 73 76.987 32.393 -16.041 379 HG3 PRO 73 HG3 PRO 73 76.358 34.026 -16.406 380 HD2 PRO 73 HD2 PRO 73 77.709 33.362 -14.156 381 HD3 PRO 73 HD3 PRO 73 76.499 34.685 -14.180 382 H VAL 74 H VAL 74 73.247 30.055 -14.486 383 HA VAL 74 HA VAL 74 75.326 27.986 -14.057 384 HB VAL 74 HB VAL 74 72.335 27.685 -14.376 385 HG11 VAL 74 HG11 VAL 74 74.474 25.671 -13.566 386 HG12 VAL 74 HG12 VAL 74 72.718 25.418 -13.447 387 HG13 VAL 74 HG13 VAL 74 73.466 25.608 -15.031 388 HG21 VAL 74 HG21 VAL 74 72.960 28.862 -12.291 389 HG22 VAL 74 HG22 VAL 74 72.390 27.231 -11.946 390 HG23 VAL 74 HG23 VAL 74 74.131 27.587 -11.911 391 H THR 75 H THR 75 73.192 29.049 -16.763 392 HA THR 75 HA THR 75 74.834 27.357 -18.614 393 HB THR 75 HB THR 75 72.979 27.089 -20.020 394 HG1 THR 75 HG1 THR 75 70.926 28.098 -19.265 395 HG21 THR 75 HG21 THR 75 71.880 26.784 -17.212 396 HG22 THR 75 HG22 THR 75 71.439 25.870 -18.673 397 HG23 THR 75 HG23 THR 75 73.059 25.685 -17.965 398 H ARG 76 H ARG 76 74.793 28.060 -20.961 399 HA ARG 76 HA ARG 76 75.844 30.727 -21.280 400 HB2 ARG 76 HB2 ARG 76 75.891 30.275 -23.650 401 HB3 ARG 76 HB3 ARG 76 76.471 28.873 -22.766 402 HG2 ARG 76 HG2 ARG 76 74.231 27.767 -23.103 403 HG3 ARG 76 HG3 ARG 76 73.718 29.172 -24.056 404 HD2 ARG 76 HD2 ARG 76 75.551 28.773 -25.657 405 HD3 ARG 76 HD3 ARG 76 76.092 27.377 -24.729 406 HE ARG 76 HE ARG 76 73.682 27.612 -26.437 407 HH11 ARG 76 HH11 ARG 76 75.399 25.494 -24.214 408 HH12 ARG 76 HH12 ARG 76 74.476 24.101 -24.705 409 HH21 ARG 76 HH21 ARG 76 72.563 25.795 -27.007 410 HH22 ARG 76 HH22 ARG 76 72.920 24.271 -26.251 411 H SER 77 H SER 77 72.573 29.453 -21.651 412 HA SER 77 HA SER 77 71.401 31.890 -22.697 413 HB2 SER 77 HB2 SER 77 70.336 29.628 -22.798 414 HB3 SER 77 HB3 SER 77 70.066 29.713 -21.044 415 HG SER 77 HG SER 77 68.244 30.457 -22.294 416 H ASP 78 H ASP 78 71.796 30.569 -19.327 417 HA ASP 78 HA ASP 78 70.609 32.806 -18.009 418 HB2 ASP 78 HB2 ASP 78 72.886 31.041 -17.071 419 HB3 ASP 78 HB3 ASP 78 71.933 32.111 -16.048 420 H ALA 79 H ALA 79 74.058 32.266 -18.965 421 HA ALA 79 HA ALA 79 75.046 34.739 -17.984 422 HB1 ALA 79 HB1 ALA 79 76.010 32.986 -20.298 423 HB2 ALA 79 HB2 ALA 79 76.955 34.253 -19.506 424 HB3 ALA 79 HB3 ALA 79 76.479 32.809 -18.590 425 H ARG 80 H ARG 80 73.735 34.008 -21.273 426 HA ARG 80 HA ARG 80 74.155 36.669 -22.287 427 HB2 ARG 80 HB2 ARG 80 73.777 34.611 -23.648 428 HB3 ARG 80 HB3 ARG 80 72.086 34.591 -23.137 429 HG2 ARG 80 HG2 ARG 80 71.730 36.803 -24.238 430 HG3 ARG 80 HG3 ARG 80 73.451 36.880 -24.639 431 HD2 ARG 80 HD2 ARG 80 72.224 36.200 -26.602 432 HD3 ARG 80 HD3 ARG 80 73.217 34.845 -26.034 433 HE ARG 80 HE ARG 80 70.476 34.812 -24.992 434 HH11 ARG 80 HH11 ARG 80 72.323 33.909 -27.831 435 HH12 ARG 80 HH12 ARG 80 71.189 32.669 -28.288 436 HH21 ARG 80 HH21 ARG 80 69.086 33.185 -25.612 437 HH22 ARG 80 HH22 ARG 80 69.397 32.288 -27.067 438 H VAL 81 H VAL 81 71.304 35.237 -20.650 439 HA VAL 81 HA VAL 81 69.646 37.595 -20.799 440 HB VAL 81 HB VAL 81 69.673 35.286 -18.822 441 HG11 VAL 81 HG11 VAL 81 67.603 37.512 -19.169 442 HG12 VAL 81 HG12 VAL 81 67.329 36.012 -18.262 443 HG13 VAL 81 HG13 VAL 81 68.540 37.162 -17.699 444 HG21 VAL 81 HG21 VAL 81 69.107 34.762 -21.194 445 HG22 VAL 81 HG22 VAL 81 67.754 34.508 -20.087 446 HG23 VAL 81 HG23 VAL 81 67.800 35.956 -21.129 447 H LEU 82 H LEU 82 71.907 36.475 -18.228 448 HA LEU 82 HA LEU 82 71.601 38.769 -16.549 449 HB2 LEU 82 HB2 LEU 82 73.948 36.897 -17.041 450 HB3 LEU 82 HB3 LEU 82 74.081 38.261 -15.943 451 HG LEU 82 HG LEU 82 72.152 35.934 -15.609 452 HD11 LEU 82 HD11 LEU 82 74.568 36.823 -13.974 453 HD12 LEU 82 HD12 LEU 82 73.630 35.323 -13.796 454 HD13 LEU 82 HD13 LEU 82 74.627 35.585 -15.238 455 HD21 LEU 82 HD21 LEU 82 71.084 37.888 -14.629 456 HD22 LEU 82 HD22 LEU 82 71.810 36.966 -13.318 457 HD23 LEU 82 HD23 LEU 82 72.622 38.424 -13.908 458 H ILE 83 H ILE 83 74.006 38.308 -19.210 459 HA ILE 83 HA ILE 83 75.206 40.872 -19.043 460 HB ILE 83 HB ILE 83 74.723 39.006 -21.384 461 HG12 ILE 83 HG12 ILE 83 77.323 39.835 -20.017 462 HG13 ILE 83 HG13 ILE 83 76.353 38.484 -19.447 463 HG21 ILE 83 HG21 ILE 83 76.273 41.642 -21.446 464 HG22 ILE 83 HG22 ILE 83 76.318 40.402 -22.713 465 HG23 ILE 83 HG23 ILE 83 74.824 41.257 -22.396 466 HD11 ILE 83 HD11 ILE 83 77.687 38.686 -22.169 467 HD12 ILE 83 HD12 ILE 83 78.096 37.600 -20.833 468 HD13 ILE 83 HD13 ILE 83 76.557 37.395 -21.688 469 H PHE 84 H PHE 84 72.331 39.903 -21.010 470 HA PHE 84 HA PHE 84 71.880 42.509 -21.998 471 HB2 PHE 84 HB2 PHE 84 70.951 40.283 -22.853 472 HB3 PHE 84 HB3 PHE 84 69.755 40.377 -21.577 473 HD1 PHE 84 HD1 PHE 84 71.205 42.880 -24.044 474 HD2 PHE 84 HD2 PHE 84 67.651 41.007 -22.460 475 HE1 PHE 84 HE1 PHE 84 69.857 44.102 -25.673 476 HE2 PHE 84 HE2 PHE 84 66.273 42.313 -24.061 477 HZ PHE 84 HZ PHE 84 67.363 43.853 -25.684 478 H ASN 85 H ASN 85 70.233 40.915 -19.178 479 HA ASN 85 HA ASN 85 68.580 43.189 -18.656 480 HB2 ASN 85 HB2 ASN 85 68.031 40.931 -17.852 481 HB3 ASN 85 HB3 ASN 85 69.457 40.923 -16.807 482 HD21 ASN 85 HD22 ASN 85 69.416 42.190 -14.846 483 HD22 ASN 85 HD21 ASN 85 68.044 43.195 -14.417 484 H GLU 86 H GLU 86 71.758 42.224 -17.217 485 HA GLU 86 HA GLU 86 71.850 44.389 -15.324 486 HB2 GLU 86 HB2 GLU 86 73.254 42.336 -15.190 487 HB3 GLU 86 HB3 GLU 86 74.159 42.877 -16.616 488 HG2 GLU 86 HG2 GLU 86 74.902 44.893 -15.403 489 HG3 GLU 86 HG3 GLU 86 73.922 44.437 -14.008 490 H TRP 87 H TRP 87 73.168 44.081 -18.716 491 HA TRP 87 HA TRP 87 74.161 46.757 -18.822 492 HB2 TRP 87 HB2 TRP 87 74.817 45.140 -20.470 493 HB3 TRP 87 HB3 TRP 87 73.145 44.853 -20.933 494 HD1 TRP 87 HD1 TRP 87 75.790 47.662 -21.220 495 HE1 TRP 87 HE1 TRP 87 75.336 48.928 -23.403 496 HE3 TRP 87 HE3 TRP 87 71.433 45.363 -22.596 497 HZ2 TRP 87 HZ2 TRP 87 73.382 48.899 -25.507 498 HZ3 TRP 87 HZ3 TRP 87 70.383 45.918 -24.731 499 HH2 TRP 87 HH2 TRP 87 71.305 47.700 -26.208 500 H GLU 88 H GLU 88 70.842 45.488 -19.735 501 HA GLU 88 HA GLU 88 69.857 47.964 -20.641 502 HB2 GLU 88 HB2 GLU 88 68.525 45.543 -19.394 503 HB3 GLU 88 HB3 GLU 88 67.608 46.994 -19.763 504 HG2 GLU 88 HG2 GLU 88 68.398 46.895 -22.128 505 HG3 GLU 88 HG3 GLU 88 69.114 45.323 -21.800 506 H GLU 89 H GLU 89 69.774 46.744 -17.217 507 HA GLU 89 HA GLU 89 68.427 49.130 -16.248 508 HB2 GLU 89 HB2 GLU 89 70.067 47.008 -14.799 509 HB3 GLU 89 HB3 GLU 89 69.189 48.322 -14.002 510 HG2 GLU 89 HG2 GLU 89 67.070 47.520 -15.072 511 HG3 GLU 89 HG3 GLU 89 67.954 46.153 -15.748 512 H ARG 90 H ARG 90 71.880 48.141 -16.163 513 HA ARG 90 HA ARG 90 72.901 50.542 -14.945 514 HB2 ARG 90 HB2 ARG 90 74.169 48.651 -16.975 515 HB3 ARG 90 HB3 ARG 90 75.047 49.930 -16.129 516 HG2 ARG 90 HG2 ARG 90 73.601 47.714 -14.665 517 HG3 ARG 90 HG3 ARG 90 75.249 47.562 -15.274 518 HD2 ARG 90 HD2 ARG 90 75.592 48.191 -13.061 519 HD3 ARG 90 HD3 ARG 90 75.798 49.706 -13.928 520 HE ARG 90 HE ARG 90 73.349 48.849 -12.398 521 HH11 ARG 90 HH11 ARG 90 75.277 51.609 -13.549 522 HH12 ARG 90 HH12 ARG 90 74.532 52.660 -12.377 523 HH21 ARG 90 HH21 ARG 90 72.403 50.324 -11.058 524 HH22 ARG 90 HH22 ARG 90 72.913 51.982 -11.076 525 H LYS 91 H LYS 91 72.595 49.699 -18.353 526 HA LYS 91 HA LYS 91 73.410 52.247 -19.352 527 HB2 LYS 91 HB2 LYS 91 73.420 50.080 -20.617 528 HB3 LYS 91 HB3 LYS 91 71.678 50.181 -20.796 529 HG2 LYS 91 HG2 LYS 91 73.361 52.485 -21.792 530 HG3 LYS 91 HG3 LYS 91 73.423 50.959 -22.665 531 HD2 LYS 91 HD2 LYS 91 70.955 50.974 -22.932 532 HD3 LYS 91 HD3 LYS 91 70.886 52.566 -22.149 533 HE2 LYS 91 HE2 LYS 91 72.383 53.489 -23.915 534 HE3 LYS 91 HE3 LYS 91 72.471 51.899 -24.677 535 HZ1 LYS 91 HZ1 LYS 91 69.968 53.499 -24.378 536 HZ2 LYS 91 HZ2 LYS 91 70.808 53.309 -25.763 537 HZ3 LYS 91 HZ3 LYS 91 70.060 52.026 -25.088 538 H LYS 92 H LYS 92 70.084 51.161 -18.484 539 HA LYS 92 HA LYS 92 68.757 53.557 -19.313 540 HB2 LYS 92 HB2 LYS 92 67.585 51.557 -18.607 541 HB3 LYS 92 HB3 LYS 92 68.240 51.648 -16.988 542 HG2 LYS 92 HG2 LYS 92 66.829 54.126 -17.737 543 HG3 LYS 92 HG3 LYS 92 65.831 52.703 -17.961 544 HD2 LYS 92 HD2 LYS 92 65.457 53.626 -15.750 545 HD3 LYS 92 HD3 LYS 92 66.168 52.012 -15.629 546 HE2 LYS 92 HE2 LYS 92 68.396 53.011 -15.174 547 HE3 LYS 92 HE3 LYS 92 67.719 54.635 -15.373 548 HZ1 LYS 92 HZ1 LYS 92 66.912 52.708 -13.248 549 HZ2 LYS 92 HZ2 LYS 92 67.896 53.992 -13.036 550 HZ3 LYS 92 HZ3 LYS 92 66.322 54.227 -13.417 551 H SER 93 H SER 93 70.687 52.851 -16.346 552 HA SER 93 HA SER 93 70.538 55.687 -15.525 553 HB2 SER 93 HB2 SER 93 72.237 53.412 -14.472 554 HB3 SER 93 HB3 SER 93 72.107 55.032 -13.764 555 HG SER 93 HG SER 93 70.649 53.542 -12.774 556 H GLU 94 H GLU 94 72.613 53.955 -17.664 557 HA GLU 94 HA GLU 94 74.670 56.121 -17.809 558 HB2 GLU 94 HB2 GLU 94 75.137 53.105 -17.741 559 HB3 GLU 94 HB3 GLU 94 76.359 54.349 -17.926 560 HG2 GLU 94 HG2 GLU 94 75.796 55.205 -15.649 561 HG3 GLU 94 HG3 GLU 94 74.615 53.901 -15.483 562 HA PRO 95 HA PRO 95 72.661 54.833 -21.819 563 HB2 PRO 95 HB2 PRO 95 72.680 57.298 -23.139 564 HB3 PRO 95 HB3 PRO 95 71.414 56.703 -22.026 565 HG2 PRO 95 HG2 PRO 95 73.785 58.483 -21.377 566 HG3 PRO 95 HG3 PRO 95 72.063 58.718 -20.926 567 HD2 PRO 95 HD2 PRO 95 73.771 57.652 -19.155 568 HD3 PRO 95 HD3 PRO 95 72.148 56.928 -19.346 569 H TRP 96 H TRP 96 75.833 55.795 -21.299 570 HA TRP 96 HA TRP 96 76.824 55.548 -24.066 571 HB2 TRP 96 HB2 TRP 96 79.010 55.959 -22.916 572 HB3 TRP 96 HB3 TRP 96 77.814 57.219 -22.680 573 HD1 TRP 96 HD1 TRP 96 79.574 54.403 -20.761 574 HE1 TRP 96 HE1 TRP 96 79.348 54.801 -18.234 575 HE3 TRP 96 HE3 TRP 96 76.372 58.406 -20.852 576 HZ2 TRP 96 HZ2 TRP 96 77.954 56.611 -16.479 577 HZ3 TRP 96 HZ3 TRP 96 75.603 59.440 -18.727 578 HH2 TRP 96 HH2 TRP 96 76.381 58.553 -16.541 579 H LEU 97 H LEU 97 76.040 53.261 -21.582 580 HA LEU 97 HA LEU 97 78.349 51.771 -21.476 581 HB2 LEU 97 HB2 LEU 97 76.259 51.816 -19.961 582 HB3 LEU 97 HB3 LEU 97 75.540 50.696 -21.097 583 HG LEU 97 HG LEU 97 77.385 49.113 -20.636 584 HD11 LEU 97 HD11 LEU 97 78.192 51.133 -18.499 585 HD12 LEU 97 HD12 LEU 97 78.779 49.458 -18.580 586 HD13 LEU 97 HD13 LEU 97 79.195 50.589 -19.864 587 HD21 LEU 97 HD21 LEU 97 75.230 49.031 -19.379 588 HD22 LEU 97 HD22 LEU 97 76.585 48.488 -18.371 589 HD23 LEU 97 HD23 LEU 97 75.925 50.130 -18.175 590 H ARG 98 H ARG 98 79.216 50.011 -22.410 591 HA ARG 98 HA ARG 98 78.327 49.190 -25.092 592 HB2 ARG 98 HB2 ARG 98 80.743 48.502 -23.379 593 HB3 ARG 98 HB3 ARG 98 80.491 47.897 -25.020 594 HG2 ARG 98 HG2 ARG 98 80.599 50.134 -25.963 595 HG3 ARG 98 HG3 ARG 98 80.586 50.876 -24.361 596 HD2 ARG 98 HD2 ARG 98 82.828 50.949 -25.211 597 HD3 ARG 98 HD3 ARG 98 82.754 49.847 -23.826 598 HE ARG 98 HE ARG 98 82.432 48.472 -26.380 599 HH11 ARG 98 HH11 ARG 98 84.924 49.788 -24.295 600 HH12 ARG 98 HH12 ARG 98 86.144 48.711 -24.912 601 HH21 ARG 98 HH21 ARG 98 84.036 47.108 -27.114 602 HH22 ARG 98 HH22 ARG 98 85.648 47.239 -26.476 603 H LEU 99 H LEU 99 78.145 47.030 -25.784 604 HA LEU 99 HA LEU 99 77.179 45.012 -23.813 605 HB2 LEU 99 HB2 LEU 99 75.388 46.477 -24.626 606 HB3 LEU 99 HB3 LEU 99 75.745 46.107 -26.278 607 HG LEU 99 HG LEU 99 73.689 45.053 -25.301 608 HD11 LEU 99 HD11 LEU 99 75.582 42.878 -26.203 609 HD12 LEU 99 HD12 LEU 99 73.862 43.121 -26.590 610 HD13 LEU 99 HD13 LEU 99 75.065 44.172 -27.298 611 HD21 LEU 99 HD21 LEU 99 74.850 44.554 -23.067 612 HD22 LEU 99 HD22 LEU 99 73.581 43.526 -23.693 613 HD23 LEU 99 HD23 LEU 99 75.307 43.027 -23.845 614 H ASP 100 H ASP 100 77.966 42.979 -24.296 615 HA ASP 100 HA ASP 100 78.657 42.238 -27.078 616 HB2 ASP 100 HB2 ASP 100 80.681 43.302 -26.077 617 HB3 ASP 100 HB3 ASP 100 80.646 42.109 -24.778 618 H MET 101 H MET 101 78.188 40.147 -27.505 619 HA MET 101 HA MET 101 77.495 38.289 -25.258 620 HB2 MET 101 HB2 MET 101 75.818 38.961 -27.707 621 HB3 MET 101 HB3 MET 101 75.454 37.668 -26.559 622 HG2 MET 101 HG2 MET 101 75.243 39.290 -24.733 623 HG3 MET 101 HG3 MET 101 75.589 40.615 -25.854 624 HE1 MET 101 HE1 MET 101 73.218 41.868 -25.095 625 HE2 MET 101 HE2 MET 101 71.728 40.908 -25.019 626 HE3 MET 101 HE3 MET 101 73.091 40.500 -23.954 627 H SER 102 H SER 102 79.597 38.503 -27.764 628 HA SER 102 HA SER 102 79.297 35.967 -29.101 629 HB2 SER 102 HB2 SER 102 81.764 37.673 -28.580 630 HB3 SER 102 HB3 SER 102 81.706 36.267 -29.662 631 HG SER 102 HG SER 102 81.370 38.276 -30.783 632 H ASP 103 H ASP 103 80.614 34.028 -28.799 633 HA ASP 103 HA ASP 103 80.382 32.881 -26.300 634 HB2 ASP 103 HB2 ASP 103 81.714 31.072 -27.105 635 HB3 ASP 103 HB3 ASP 103 80.654 31.637 -28.375 636 H LYS 104 H LYS 104 83.411 34.333 -27.539 637 HA LYS 104 HA LYS 104 85.071 33.955 -25.298 638 HB2 LYS 104 HB2 LYS 104 84.921 36.259 -27.286 639 HB3 LYS 104 HB3 LYS 104 86.207 36.083 -26.084 640 HG2 LYS 104 HG2 LYS 104 86.847 33.893 -27.021 641 HG3 LYS 104 HG3 LYS 104 85.533 33.988 -28.193 642 HD2 LYS 104 HD2 LYS 104 87.572 34.557 -29.309 643 HD3 LYS 104 HD3 LYS 104 86.571 36.011 -29.205 644 HE2 LYS 104 HE2 LYS 104 87.923 36.808 -27.273 645 HE3 LYS 104 HE3 LYS 104 88.881 35.322 -27.322 646 HZ1 LYS 104 HZ1 LYS 104 88.763 37.343 -29.510 647 HZ2 LYS 104 HZ2 LYS 104 90.010 37.145 -28.477 648 HZ3 LYS 104 HZ3 LYS 104 89.653 35.971 -29.550 649 H ALA 105 H ALA 105 82.534 36.448 -25.618 650 HA ALA 105 HA ALA 105 83.290 37.972 -23.291 651 HB1 ALA 105 HB1 ALA 105 80.541 37.670 -24.573 652 HB2 ALA 105 HB2 ALA 105 81.078 38.972 -23.513 653 HB3 ALA 105 HB3 ALA 105 81.803 38.792 -25.120 654 H ILE 106 H ILE 106 81.194 35.168 -23.771 655 HA ILE 106 HA ILE 106 80.253 35.074 -21.015 656 HB ILE 106 HB ILE 106 79.991 33.271 -23.440 657 HG12 ILE 106 HG12 ILE 106 77.593 33.716 -23.113 658 HG13 ILE 106 HG13 ILE 106 77.941 34.686 -21.682 659 HG21 ILE 106 HG21 ILE 106 79.016 32.619 -20.620 660 HG22 ILE 106 HG22 ILE 106 78.478 31.803 -22.105 661 HG23 ILE 106 HG23 ILE 106 80.160 31.675 -21.608 662 HD11 ILE 106 HD11 ILE 106 78.844 35.385 -24.503 663 HD12 ILE 106 HD12 ILE 106 77.391 36.023 -23.711 664 HD13 ILE 106 HD13 ILE 106 78.990 36.422 -23.065 665 H PHE 107 H PHE 107 82.680 33.165 -22.881 666 HA PHE 107 HA PHE 107 83.620 31.555 -20.744 667 HB2 PHE 107 HB2 PHE 107 85.347 32.876 -22.871 668 HB3 PHE 107 HB3 PHE 107 85.738 31.433 -21.961 669 HD1 PHE 107 HD2 PHE 107 82.784 30.188 -22.390 670 HD2 PHE 107 HD1 PHE 107 85.834 31.866 -24.933 671 HE1 PHE 107 HE2 PHE 107 81.985 28.781 -24.267 672 HE2 PHE 107 HE1 PHE 107 85.020 30.451 -26.827 673 HZ PHE 107 HZ PHE 107 83.112 28.898 -26.482 674 H ARG 108 H ARG 108 84.748 34.840 -21.680 675 HA ARG 108 HA ARG 108 86.756 34.974 -19.652 676 HB2 ARG 108 HB2 ARG 108 86.609 36.012 -21.950 677 HB3 ARG 108 HB3 ARG 108 85.529 37.241 -21.289 678 HG2 ARG 108 HG2 ARG 108 88.340 36.657 -20.256 679 HG3 ARG 108 HG3 ARG 108 88.004 37.772 -21.580 680 HD2 ARG 108 HD2 ARG 108 86.604 39.165 -20.063 681 HD3 ARG 108 HD3 ARG 108 87.057 38.102 -18.711 682 HE ARG 108 HE ARG 108 89.421 39.010 -20.032 683 HH11 ARG 108 HH11 ARG 108 86.962 40.288 -17.879 684 HH12 ARG 108 HH12 ARG 108 88.041 41.479 -17.210 685 HH21 ARG 108 HH21 ARG 108 90.740 40.550 -19.135 686 HH22 ARG 108 HH22 ARG 108 90.127 41.620 -17.909 687 H ARG 109 H ARG 109 83.391 36.230 -19.730 688 HA ARG 109 HA ARG 109 83.537 37.408 -17.045 689 HB2 ARG 109 HB2 ARG 109 81.245 36.509 -18.835 690 HB3 ARG 109 HB3 ARG 109 80.985 37.159 -17.212 691 HG2 ARG 109 HG2 ARG 109 81.931 39.275 -17.743 692 HG3 ARG 109 HG3 ARG 109 82.598 38.692 -19.272 693 HD2 ARG 109 HD2 ARG 109 80.326 38.404 -20.196 694 HD3 ARG 109 HD3 ARG 109 79.623 38.835 -18.637 695 HE ARG 109 HE ARG 109 79.876 41.053 -19.123 696 HH11 ARG 109 HH11 ARG 109 82.173 39.422 -21.208 697 HH12 ARG 109 HH12 ARG 109 82.592 40.899 -22.044 698 HH21 ARG 109 HH21 ARG 109 80.439 42.878 -20.234 699 HH22 ARG 109 HH22 ARG 109 81.617 42.803 -21.506 700 H TYR 110 H TYR 110 82.603 34.207 -18.254 701 HA TYR 110 HA TYR 110 82.275 33.202 -15.461 702 HB2 TYR 110 HB2 TYR 110 80.599 32.489 -17.881 703 HB3 TYR 110 HB3 TYR 110 80.346 32.021 -16.212 704 HD1 TYR 110 HD2 TYR 110 80.230 34.153 -14.504 705 HD2 TYR 110 HD1 TYR 110 79.278 34.195 -18.711 706 HE1 TYR 110 HE2 TYR 110 78.876 36.233 -14.194 707 HE2 TYR 110 HE1 TYR 110 77.899 36.252 -18.386 708 HH TYR 110 HH TYR 110 77.143 37.838 -16.879 709 HA PRO 111 HA PRO 111 85.486 30.760 -17.640 710 HB2 PRO 111 HB2 PRO 111 86.952 29.915 -15.470 711 HB3 PRO 111 HB3 PRO 111 87.074 31.548 -16.190 712 HG2 PRO 111 HG2 PRO 111 85.411 30.692 -13.799 713 HG3 PRO 111 HG3 PRO 111 86.531 32.088 -13.924 714 HD2 PRO 111 HD2 PRO 111 83.871 32.395 -14.272 715 HD3 PRO 111 HD3 PRO 111 85.024 33.285 -15.315 716 H HIS 112 H HIS 112 83.221 29.615 -15.202 717 HA HIS 112 HA HIS 112 83.745 26.775 -15.575 718 HB2 HIS 112 HB2 HIS 112 81.848 26.448 -14.226 719 HB3 HIS 112 HB3 HIS 112 82.644 27.871 -13.569 720 HD2 HIS 112 HD2 HIS 112 79.328 26.677 -14.195 721 HE1 HIS 112 HE1 HIS 112 78.850 30.764 -15.266 722 HE2 HIS 112 HE2 HIS 112 77.640 28.684 -14.660 723 H LEU 113 H LEU 113 81.901 29.198 -17.331 724 HA LEU 113 HA LEU 113 80.328 27.305 -18.834 725 HB2 LEU 113 HB2 LEU 113 80.166 30.020 -18.027 726 HB3 LEU 113 HB3 LEU 113 80.420 30.108 -19.750 727 HG LEU 113 HG LEU 113 78.088 30.191 -19.209 728 HD11 LEU 113 HD11 LEU 113 78.747 27.448 -20.391 729 HD12 LEU 113 HD12 LEU 113 77.229 28.313 -20.589 730 HD13 LEU 113 HD13 LEU 113 78.712 28.983 -21.285 731 HD21 LEU 113 HD21 LEU 113 77.863 29.155 -17.135 732 HD22 LEU 113 HD22 LEU 113 76.908 28.182 -18.238 733 HD23 LEU 113 HD23 LEU 113 78.484 27.588 -17.705 734 H ARG 114 H ARG 114 83.509 27.913 -19.091 735 HA ARG 114 HA ARG 114 83.682 27.827 -22.054 736 HB2 ARG 114 HB2 ARG 114 85.143 29.357 -20.688 737 HB3 ARG 114 HB3 ARG 114 85.948 27.941 -20.031 738 HG2 ARG 114 HG2 ARG 114 85.798 28.610 -23.011 739 HG3 ARG 114 HG3 ARG 114 87.104 29.123 -21.940 740 HD2 ARG 114 HD2 ARG 114 87.593 26.719 -21.434 741 HD3 ARG 114 HD3 ARG 114 86.390 26.261 -22.659 742 HE ARG 114 HE ARG 114 88.216 28.069 -23.853 743 HH11 ARG 114 HH11 ARG 114 88.215 24.772 -22.675 744 HH12 ARG 114 HH12 ARG 114 89.479 24.279 -23.770 745 HH21 ARG 114 HH21 ARG 114 89.827 27.378 -25.224 746 HH22 ARG 114 HH22 ARG 114 90.363 25.726 -25.175 Start of MODEL 6 1 H1 MET 1 H1 MET 1 7.820 90.367 3.647 2 H2 MET 1 H2 MET 1 7.031 89.239 2.771 3 H3 MET 1 H3 MET 1 8.125 90.226 2.049 4 HA MET 1 HA MET 1 8.750 88.178 4.094 5 HB2 MET 1 HB2 MET 1 9.375 88.202 1.101 6 HB3 MET 1 HB3 MET 1 10.094 87.088 2.263 7 HG2 MET 1 HG2 MET 1 7.844 86.223 2.848 8 HG3 MET 1 HG3 MET 1 7.129 87.276 1.619 9 HE1 MET 1 HE1 MET 1 5.884 85.219 0.549 10 HE2 MET 1 HE2 MET 1 6.696 83.714 0.065 11 HE3 MET 1 HE3 MET 1 6.596 84.153 1.785 12 H ARG 2 H ARG 2 11.040 87.862 4.521 13 HA ARG 2 HA ARG 2 12.801 90.245 4.052 14 HB2 ARG 2 HB2 ARG 2 12.189 88.853 6.700 15 HB3 ARG 2 HB3 ARG 2 13.575 89.919 6.456 16 HG2 ARG 2 HG2 ARG 2 12.047 91.777 5.821 17 HG3 ARG 2 HG3 ARG 2 10.655 90.735 6.173 18 HD2 ARG 2 HD2 ARG 2 11.376 90.494 8.504 19 HD3 ARG 2 HD3 ARG 2 12.826 91.445 8.199 20 HE ARG 2 HE ARG 2 10.056 92.413 8.500 21 HH11 ARG 2 HH11 ARG 2 13.297 93.377 7.537 22 HH12 ARG 2 HH12 ARG 2 12.943 95.071 7.736 23 HH21 ARG 2 HH21 ARG 2 9.685 94.584 8.729 24 HH22 ARG 2 HH22 ARG 2 10.950 95.731 8.395 25 H GLY 3 H GLY 3 15.045 89.849 4.573 26 HA2 GLY 3 HA2 GLY 3 16.978 88.529 4.778 27 HA3 GLY 3 HA3 GLY 3 16.075 87.070 4.409 28 H SER 4 H SER 4 18.598 88.259 3.331 29 HA SER 4 HA SER 4 18.197 87.645 0.503 30 HB2 SER 4 HB2 SER 4 17.691 90.115 0.691 31 HB3 SER 4 HB3 SER 4 19.347 90.358 1.277 32 HG SER 4 HG SER 4 19.115 90.662 -1.025 33 H HIS 5 H HIS 5 20.270 87.405 -0.620 34 HA HIS 5 HA HIS 5 22.647 86.959 1.131 35 HB2 HIS 5 HB2 HIS 5 21.386 84.886 -0.704 36 HB3 HIS 5 HB3 HIS 5 22.969 84.732 0.054 37 HD2 HIS 5 HD2 HIS 5 19.258 84.342 0.795 38 HE1 HIS 5 HE1 HIS 5 21.270 83.481 4.460 39 HE2 HIS 5 HE2 HIS 5 19.027 83.416 3.256 40 H HIS 6 H HIS 6 24.640 86.762 0.061 41 HA HIS 6 HA HIS 6 24.850 87.503 -2.794 42 HB2 HIS 6 HB2 HIS 6 24.743 89.635 -1.483 43 HB3 HIS 6 HB3 HIS 6 26.148 89.112 -0.555 44 HD2 HIS 6 HD2 HIS 6 25.278 89.588 -4.358 45 HE1 HIS 6 HE1 HIS 6 29.294 90.903 -3.770 46 HE2 HIS 6 HE2 HIS 6 27.430 90.620 -5.479 47 H HIS 7 H HIS 7 27.102 87.279 -3.606 48 HA HIS 7 HA HIS 7 28.827 85.416 -2.081 49 HB2 HIS 7 HB2 HIS 7 28.833 83.753 -3.829 50 HB3 HIS 7 HB3 HIS 7 27.185 83.998 -3.275 51 HD2 HIS 7 HD2 HIS 7 25.450 85.187 -4.999 52 HE1 HIS 7 HE1 HIS 7 27.949 84.991 -8.453 53 HE2 HIS 7 HE2 HIS 7 25.586 85.452 -7.621 54 H HIS 8 H HIS 8 30.876 84.955 -3.142 55 HA HIS 8 HA HIS 8 31.905 87.192 -4.834 56 HB2 HIS 8 HB2 HIS 8 33.158 86.170 -2.254 57 HB3 HIS 8 HB3 HIS 8 33.803 87.432 -3.298 58 HD2 HIS 8 HD2 HIS 8 32.538 89.846 -3.282 59 HE1 HIS 8 HE1 HIS 8 30.203 89.140 0.221 60 HE2 HIS 8 HE2 HIS 8 31.000 90.913 -1.420 61 H HIS 9 H HIS 9 33.852 86.800 -5.938 62 HA HIS 9 HA HIS 9 35.133 84.153 -5.831 63 HB2 HIS 9 HB2 HIS 9 33.336 83.848 -7.507 64 HB3 HIS 9 HB3 HIS 9 33.912 85.258 -8.397 65 HD2 HIS 9 HD2 HIS 9 35.036 81.659 -7.433 66 HE1 HIS 9 HE1 HIS 9 37.373 82.832 -10.807 67 HE2 HIS 9 HE2 HIS 9 36.826 80.914 -9.221 68 H HIS 10 H HIS 10 37.263 84.161 -6.566 69 HA HIS 10 HA HIS 10 38.406 86.519 -7.883 70 HB2 HIS 10 HB2 HIS 10 38.521 87.101 -5.471 71 HB3 HIS 10 HB3 HIS 10 39.386 85.599 -5.148 72 HD2 HIS 10 HD2 HIS 10 39.875 88.712 -7.496 73 HE1 HIS 10 HE1 HIS 10 43.714 87.590 -6.007 74 HE2 HIS 10 HE2 HIS 10 42.455 89.259 -7.461 75 H GLY 11 H GLY 11 40.087 85.981 -9.202 76 HA2 GLY 11 HA2 GLY 11 40.716 83.122 -9.555 77 HA3 GLY 11 HA3 GLY 11 41.114 84.437 -10.649 78 H SER 28 H SER 28 42.739 82.210 -9.538 79 HA SER 28 HA SER 28 45.093 83.782 -8.572 80 HB2 SER 28 HB2 SER 28 44.191 81.068 -7.532 81 HB3 SER 28 HB3 SER 28 45.727 81.862 -7.144 82 HG SER 28 HG SER 28 44.106 82.224 -5.532 83 H VAL 29 H VAL 29 47.084 83.147 -9.344 84 HA VAL 29 HA VAL 29 47.402 80.744 -10.996 85 HB VAL 29 HB VAL 29 46.430 82.355 -12.573 86 HG11 VAL 29 HG11 VAL 29 48.897 84.086 -12.148 87 HG12 VAL 29 HG12 VAL 29 47.609 84.333 -13.341 88 HG13 VAL 29 HG13 VAL 29 47.248 84.487 -11.619 89 HG21 VAL 29 HG21 VAL 29 48.044 80.649 -13.370 90 HG22 VAL 29 HG22 VAL 29 47.998 82.108 -14.369 91 HG23 VAL 29 HG23 VAL 29 49.349 81.858 -13.252 92 H SER 30 H SER 30 49.508 80.075 -11.238 93 HA SER 30 HA SER 30 51.765 81.823 -10.578 94 HB2 SER 30 HB2 SER 30 52.787 80.228 -9.007 95 HB3 SER 30 HB3 SER 30 51.282 80.913 -8.380 96 HG SER 30 HG SER 30 51.391 78.639 -8.041 97 H PHE 31 H PHE 31 53.765 81.078 -11.425 98 HA PHE 31 HA PHE 31 53.849 78.663 -13.096 99 HB2 PHE 31 HB2 PHE 31 52.611 80.422 -14.435 100 HB3 PHE 31 HB3 PHE 31 54.040 81.436 -14.348 101 HD1 PHE 31 HD2 PHE 31 52.896 78.010 -15.415 102 HD2 PHE 31 HD1 PHE 31 55.675 81.245 -16.076 103 HE1 PHE 31 HE2 PHE 31 53.794 76.835 -17.413 104 HE2 PHE 31 HE1 PHE 31 56.565 80.068 -18.074 105 HZ PHE 31 HZ PHE 31 55.630 77.860 -18.742 106 H GLY 32 H GLY 32 55.935 78.403 -14.204 107 HA2 GLY 32 HA2 GLY 32 58.177 78.969 -14.648 108 HA3 GLY 32 HA3 GLY 32 58.244 80.009 -13.237 109 H ALA 33 H ALA 33 59.741 77.539 -14.365 110 HA ALA 33 HA ALA 33 60.496 76.386 -11.790 111 HB1 ALA 33 HB1 ALA 33 59.326 74.667 -14.036 112 HB2 ALA 33 HB2 ALA 33 60.114 74.038 -12.577 113 HB3 ALA 33 HB3 ALA 33 58.595 74.939 -12.438 114 HA PRO 34 HA PRO 34 64.385 76.184 -14.060 115 HB2 PRO 34 HB2 PRO 34 65.810 74.299 -12.692 116 HB3 PRO 34 HB3 PRO 34 65.418 75.907 -12.009 117 HG2 PRO 34 HG2 PRO 34 63.932 73.294 -11.574 118 HG3 PRO 34 HG3 PRO 34 64.501 74.459 -10.336 119 HD2 PRO 34 HD2 PRO 34 61.942 74.484 -11.256 120 HD3 PRO 34 HD3 PRO 34 62.799 76.005 -10.875 121 H SER 35 H SER 35 65.509 74.950 -15.601 122 HA SER 35 HA SER 35 64.325 72.328 -16.445 123 HB2 SER 35 HB2 SER 35 64.809 74.744 -18.218 124 HB3 SER 35 HB3 SER 35 64.342 73.126 -18.776 125 HG SER 35 HG SER 35 62.532 74.546 -18.541 126 HA PRO 36 HA PRO 36 69.008 72.123 -16.601 127 HB2 PRO 36 HB2 PRO 36 69.366 69.907 -15.042 128 HB3 PRO 36 HB3 PRO 36 69.242 71.563 -14.373 129 HG2 PRO 36 HG2 PRO 36 67.043 69.480 -14.601 130 HG3 PRO 36 HG3 PRO 36 67.489 70.466 -13.173 131 HD2 PRO 36 HD2 PRO 36 65.447 71.172 -14.832 132 HD3 PRO 36 HD3 PRO 36 66.507 72.402 -14.085 133 H LEU 37 H LEU 37 69.946 70.972 -18.213 134 HA LEU 37 HA LEU 37 68.748 68.466 -19.273 135 HB2 LEU 37 HB2 LEU 37 69.187 71.052 -20.825 136 HB3 LEU 37 HB3 LEU 37 68.950 69.494 -21.601 137 HG LEU 37 HG LEU 37 66.882 70.828 -19.800 138 HD11 LEU 37 HD11 LEU 37 67.029 70.617 -22.833 139 HD12 LEU 37 HD12 LEU 37 65.684 71.298 -21.889 140 HD13 LEU 37 HD13 LEU 37 67.264 72.095 -21.872 141 HD21 LEU 37 HD21 LEU 37 66.607 68.372 -19.875 142 HD22 LEU 37 HD22 LEU 37 65.334 69.166 -20.801 143 HD23 LEU 37 HD23 LEU 37 66.697 68.404 -21.649 144 H SER 38 H SER 38 70.102 67.231 -20.583 145 HA SER 38 HA SER 38 73.011 67.595 -20.318 146 HB2 SER 38 HB2 SER 38 73.085 65.411 -21.510 147 HB3 SER 38 HB3 SER 38 72.158 65.376 -20.000 148 HG SER 38 HG SER 38 71.039 64.309 -21.708 149 H SER 39 H SER 39 74.414 67.448 -22.180 150 HA SER 39 HA SER 39 73.338 68.358 -24.802 151 HB2 SER 39 HB2 SER 39 74.900 70.241 -24.903 152 HB3 SER 39 HB3 SER 39 73.769 70.417 -23.554 153 HG SER 39 HG SER 39 75.942 70.889 -22.931 154 H GLU 40 H GLU 40 75.492 66.409 -23.130 155 HA GLU 40 HA GLU 40 77.376 66.103 -25.420 156 HB2 GLU 40 HB2 GLU 40 79.025 65.504 -23.765 157 HB3 GLU 40 HB3 GLU 40 78.345 67.079 -23.395 158 HG2 GLU 40 HG2 GLU 40 77.375 64.531 -22.022 159 HG3 GLU 40 HG3 GLU 40 78.774 65.426 -21.466 160 H SER 41 H SER 41 74.820 64.413 -24.086 161 HA SER 41 HA SER 41 75.945 61.797 -23.818 162 HB2 SER 41 HB2 SER 41 73.043 62.592 -24.224 163 HB3 SER 41 HB3 SER 41 73.634 61.021 -23.651 164 HG SER 41 HG SER 41 73.058 62.343 -21.882 165 H GLU 42 H GLU 42 76.001 60.044 -25.099 166 HA GLU 42 HA GLU 42 76.064 58.702 -26.886 167 HB2 GLU 42 HB2 GLU 42 73.456 59.978 -27.713 168 HB3 GLU 42 HB3 GLU 42 74.026 58.361 -28.108 169 HG2 GLU 42 HG2 GLU 42 73.283 59.317 -25.312 170 HG3 GLU 42 HG3 GLU 42 72.267 58.388 -26.392 171 H ASP 43 H ASP 43 77.022 61.694 -27.498 172 HA ASP 43 HA ASP 43 76.691 61.935 -30.311 173 HB2 ASP 43 HB2 ASP 43 78.665 63.175 -28.369 174 HB3 ASP 43 HB3 ASP 43 78.663 63.575 -30.081 175 H GLU 44 H GLU 44 78.924 60.006 -28.621 176 HA GLU 44 HA GLU 44 80.121 59.074 -31.181 177 HB2 GLU 44 HB2 GLU 44 82.392 59.234 -30.389 178 HB3 GLU 44 HB3 GLU 44 81.622 60.811 -30.337 179 HG2 GLU 44 HG2 GLU 44 81.264 60.540 -27.868 180 HG3 GLU 44 HG3 GLU 44 82.100 58.987 -27.940 181 H ILE 45 H ILE 45 78.291 57.960 -28.895 182 HA ILE 45 HA ILE 45 79.667 55.332 -28.600 183 HB ILE 45 HB ILE 45 78.292 56.699 -26.258 184 HG12 ILE 45 HG12 ILE 45 81.290 56.516 -26.781 185 HG13 ILE 45 HG13 ILE 45 80.313 57.990 -26.744 186 HG21 ILE 45 HG21 ILE 45 80.067 54.216 -26.449 187 HG22 ILE 45 HG22 ILE 45 79.317 54.852 -24.974 188 HG23 ILE 45 HG23 ILE 45 78.298 54.211 -26.242 189 HD11 ILE 45 HD11 ILE 45 80.975 56.228 -24.372 190 HD12 ILE 45 HD12 ILE 45 81.476 57.893 -24.688 191 HD13 ILE 45 HD13 ILE 45 79.770 57.545 -24.339 192 H ASN 46 H ASN 46 78.381 53.726 -29.161 193 HA ASN 46 HA ASN 46 76.520 52.533 -29.793 194 HB2 ASN 46 HB2 ASN 46 77.115 52.090 -27.419 195 HB3 ASN 46 HB3 ASN 46 75.912 53.273 -26.905 196 HD21 ASN 46 HD22 ASN 46 76.106 50.306 -29.015 197 HD22 ASN 46 HD21 ASN 46 74.581 49.679 -28.436 198 H TYR 47 H TYR 47 76.023 54.700 -31.139 199 HA TYR 47 HA TYR 47 74.184 56.543 -30.311 200 HB2 TYR 47 HB2 TYR 47 75.671 56.726 -32.269 201 HB3 TYR 47 HB3 TYR 47 74.653 55.611 -33.168 202 HD1 TYR 47 HD2 TYR 47 74.926 59.012 -31.740 203 HD2 TYR 47 HD1 TYR 47 72.499 56.347 -34.111 204 HE1 TYR 47 HE2 TYR 47 73.538 60.941 -32.489 205 HE2 TYR 47 HE1 TYR 47 71.110 58.272 -34.853 206 HH TYR 47 HH TYR 47 70.759 60.548 -34.726 207 H MET 48 H MET 48 73.307 53.739 -32.379 208 HA MET 48 HA MET 48 70.720 53.470 -31.086 209 HB2 MET 48 HB2 MET 48 70.397 55.353 -32.800 210 HB3 MET 48 HB3 MET 48 70.644 54.148 -34.060 211 HG2 MET 48 HG2 MET 48 68.675 52.883 -33.196 212 HG3 MET 48 HG3 MET 48 68.544 54.010 -31.848 213 HE1 MET 48 HE1 MET 48 67.994 53.380 -35.655 214 HE2 MET 48 HE2 MET 48 67.450 54.963 -36.252 215 HE3 MET 48 HE3 MET 48 69.142 54.735 -35.769 216 H THR 49 H THR 49 72.649 51.691 -30.945 217 HA THR 49 HA THR 49 72.158 49.578 -33.009 218 HB THR 49 HB THR 49 74.604 49.000 -32.667 219 HG1 THR 49 HG1 THR 49 75.889 50.686 -31.889 220 HG21 THR 49 HG21 THR 49 74.020 51.756 -33.826 221 HG22 THR 49 HG22 THR 49 75.390 50.693 -34.213 222 HG23 THR 49 HG23 THR 49 73.747 50.210 -34.662 223 HA PRO 50 HA PRO 50 71.574 47.310 -28.968 224 HB2 PRO 50 HB2 PRO 50 68.890 46.950 -28.878 225 HB3 PRO 50 HB3 PRO 50 69.650 48.454 -28.272 226 HG2 PRO 50 HG2 PRO 50 68.398 47.969 -31.001 227 HG3 PRO 50 HG3 PRO 50 68.073 49.316 -29.863 228 HD2 PRO 50 HD2 PRO 50 69.855 49.528 -31.933 229 HD3 PRO 50 HD3 PRO 50 70.103 50.366 -30.368 230 HA PRO 51 HA PRO 51 71.015 43.570 -31.517 231 HB2 PRO 51 HB2 PRO 51 70.429 41.662 -29.675 232 HB3 PRO 51 HB3 PRO 51 72.038 42.446 -29.747 233 HG2 PRO 51 HG2 PRO 51 69.695 43.174 -27.954 234 HG3 PRO 51 HG3 PRO 51 71.392 42.861 -27.469 235 HD2 PRO 51 HD2 PRO 51 70.453 45.389 -27.890 236 HD3 PRO 51 HD3 PRO 51 72.120 44.933 -28.349 237 H GLU 52 H GLU 52 69.339 41.916 -32.091 238 HA GLU 52 HA GLU 52 66.559 42.499 -31.259 239 HB2 GLU 52 HB2 GLU 52 65.746 42.616 -33.529 240 HB3 GLU 52 HB3 GLU 52 66.899 43.909 -33.218 241 HG2 GLU 52 HG2 GLU 52 68.663 42.611 -34.428 242 HG3 GLU 52 HG3 GLU 52 67.487 41.336 -34.754 243 H GLN 53 H GLN 53 65.074 40.831 -31.551 244 HA GLN 53 HA GLN 53 65.565 38.391 -32.943 245 HB2 GLN 53 HB2 GLN 53 66.413 38.512 -30.102 246 HB3 GLN 53 HB3 GLN 53 65.205 37.274 -30.359 247 HG2 GLN 53 HG2 GLN 53 66.596 35.905 -31.491 248 HG3 GLN 53 HG3 GLN 53 67.297 37.202 -32.451 249 HE21 GLN 53 HE22 GLN 53 68.886 38.646 -31.353 250 HE22 GLN 53 HE21 GLN 53 69.973 37.908 -30.170 251 H GLU 54 H GLU 54 63.802 36.766 -32.505 252 HA GLU 54 HA GLU 54 61.277 37.873 -31.417 253 HB2 GLU 54 HB2 GLU 54 61.616 36.593 -34.168 254 HB3 GLU 54 HB3 GLU 54 60.069 36.900 -33.375 255 HG2 GLU 54 HG2 GLU 54 60.596 39.344 -33.326 256 HG3 GLU 54 HG3 GLU 54 62.079 39.021 -34.233 257 H ALA 55 H ALA 55 59.695 36.185 -31.058 258 HA ALA 55 HA ALA 55 59.026 34.309 -29.970 259 HB1 ALA 55 HB1 ALA 55 60.583 33.000 -32.223 260 HB2 ALA 55 HB2 ALA 55 59.248 32.280 -31.299 261 HB3 ALA 55 HB3 ALA 55 58.947 33.686 -32.336 262 H GLN 56 H GLN 56 60.663 35.213 -28.275 263 HA GLN 56 HA GLN 56 62.111 32.866 -27.194 264 HB2 GLN 56 HB2 GLN 56 64.049 34.230 -26.544 265 HB3 GLN 56 HB3 GLN 56 63.871 34.060 -28.286 266 HG2 GLN 56 HG2 GLN 56 63.050 36.332 -28.524 267 HG3 GLN 56 HG3 GLN 56 62.923 36.536 -26.779 268 HE21 GLN 56 HE22 GLN 56 64.249 38.529 -27.371 269 HE22 GLN 56 HE21 GLN 56 65.991 38.311 -27.377 270 HA PRO 57 HA PRO 57 59.494 35.473 -24.242 271 HB2 PRO 57 HB2 PRO 57 57.250 34.031 -23.873 272 HB3 PRO 57 HB3 PRO 57 57.527 34.978 -25.380 273 HG2 PRO 57 HG2 PRO 57 58.092 32.013 -24.961 274 HG3 PRO 57 HG3 PRO 57 57.069 32.767 -26.229 275 HD2 PRO 57 HD2 PRO 57 59.692 32.200 -26.688 276 HD3 PRO 57 HD3 PRO 57 58.920 33.685 -27.327 277 H GLY 58 H GLY 58 59.047 35.136 -21.973 278 HA2 GLY 58 HA2 GLY 58 59.354 34.238 -19.877 279 HA3 GLY 58 HA3 GLY 58 59.444 32.638 -20.612 280 H ALA 59 H ALA 59 61.757 35.133 -21.553 281 HA ALA 59 HA ALA 59 64.003 33.500 -20.923 282 HB1 ALA 59 HB1 ALA 59 63.834 36.439 -21.703 283 HB2 ALA 59 HB2 ALA 59 65.301 35.436 -21.721 284 HB3 ALA 59 HB3 ALA 59 63.957 35.052 -22.812 285 H LEU 60 H LEU 60 64.722 33.091 -19.021 286 HA LEU 60 HA LEU 60 65.144 35.178 -16.922 287 HB2 LEU 60 HB2 LEU 60 64.021 32.356 -16.618 288 HB3 LEU 60 HB3 LEU 60 64.558 33.337 -15.266 289 HG LEU 60 HG LEU 60 62.265 34.104 -17.128 290 HD11 LEU 60 HD11 LEU 60 62.235 32.965 -14.303 291 HD12 LEU 60 HD12 LEU 60 60.819 33.501 -15.237 292 HD13 LEU 60 HD13 LEU 60 61.757 32.103 -15.783 293 HD21 LEU 60 HD21 LEU 60 63.285 36.086 -16.080 294 HD22 LEU 60 HD22 LEU 60 61.719 35.743 -15.346 295 HD23 LEU 60 HD23 LEU 60 63.209 35.304 -14.483 296 H ALA 61 H ALA 61 66.774 34.469 -15.273 297 HA ALA 61 HA ALA 61 68.828 32.657 -16.403 298 HB1 ALA 61 HB1 ALA 61 69.293 35.271 -14.935 299 HB2 ALA 61 HB2 ALA 61 70.550 34.125 -15.450 300 HB3 ALA 61 HB3 ALA 61 69.563 34.959 -16.664 301 H ALA 62 H ALA 62 69.208 30.933 -15.198 302 HA ALA 62 HA ALA 62 68.604 30.872 -12.302 303 HB1 ALA 62 HB1 ALA 62 69.702 28.732 -14.163 304 HB2 ALA 62 HB2 ALA 62 69.234 28.507 -12.467 305 HB3 ALA 62 HB3 ALA 62 68.003 28.926 -13.675 306 H LEU 63 H LEU 63 70.186 30.542 -10.703 307 HA LEU 63 HA LEU 63 72.932 31.478 -11.423 308 HB2 LEU 63 HB2 LEU 63 71.264 32.394 -9.057 309 HB3 LEU 63 HB3 LEU 63 72.868 32.968 -9.497 310 HG LEU 63 HG LEU 63 70.310 33.433 -11.096 311 HD11 LEU 63 HD11 LEU 63 72.014 35.337 -9.440 312 HD12 LEU 63 HD12 LEU 63 70.562 35.758 -10.375 313 HD13 LEU 63 HD13 LEU 63 70.427 34.688 -8.970 314 HD21 LEU 63 HD21 LEU 63 72.310 33.379 -12.578 315 HD22 LEU 63 HD22 LEU 63 71.633 34.996 -12.426 316 HD23 LEU 63 HD23 LEU 63 73.109 34.563 -11.530 317 H HIS 64 H HIS 64 74.591 31.093 -9.887 318 HA HIS 64 HA HIS 64 74.330 28.642 -8.237 319 HB2 HIS 64 HB2 HIS 64 76.597 30.511 -8.946 320 HB3 HIS 64 HB3 HIS 64 76.778 29.231 -7.752 321 HD2 HIS 64 HD2 HIS 64 77.136 29.890 -11.397 322 HE1 HIS 64 HE1 HIS 64 77.020 25.634 -11.056 323 HE2 HIS 64 HE2 HIS 64 77.595 27.579 -12.585 324 H ALA 65 H ALA 65 74.307 28.635 -5.994 325 HA ALA 65 HA ALA 65 73.480 31.195 -4.761 326 HB1 ALA 65 HB1 ALA 65 73.177 28.314 -3.833 327 HB2 ALA 65 HB2 ALA 65 72.407 29.744 -3.115 328 HB3 ALA 65 HB3 ALA 65 71.975 29.245 -4.761 329 H GLU 66 H GLU 66 76.338 29.293 -4.714 330 HA GLU 66 HA GLU 66 77.354 30.638 -2.282 331 HB2 GLU 66 HB2 GLU 66 77.979 28.560 -1.198 332 HB3 GLU 66 HB3 GLU 66 76.239 28.630 -1.432 333 HG2 GLU 66 HG2 GLU 66 76.442 27.117 -3.406 334 HG3 GLU 66 HG3 GLU 66 78.188 27.045 -3.164 335 H GLY 67 H GLY 67 79.675 30.085 -1.842 336 HA2 GLY 67 HA2 GLY 67 81.890 29.887 -2.480 337 HA3 GLY 67 HA3 GLY 67 81.352 28.999 -3.900 338 HA PRO 68 HA PRO 68 83.205 33.073 -5.217 339 HB2 PRO 68 HB2 PRO 68 84.698 32.162 -7.332 340 HB3 PRO 68 HB3 PRO 68 85.236 32.073 -5.628 341 HG2 PRO 68 HG2 PRO 68 83.889 29.896 -7.262 342 HG3 PRO 68 HG3 PRO 68 85.390 29.777 -6.285 343 HD2 PRO 68 HD2 PRO 68 83.004 28.991 -5.290 344 HD3 PRO 68 HD3 PRO 68 84.175 29.854 -4.249 345 H LEU 69 H LEU 69 81.205 30.724 -6.829 346 HA LEU 69 HA LEU 69 80.501 32.572 -9.032 347 HB2 LEU 69 HB2 LEU 69 79.634 29.724 -8.454 348 HB3 LEU 69 HB3 LEU 69 79.137 30.666 -9.854 349 HG LEU 69 HG LEU 69 82.002 29.837 -9.261 350 HD11 LEU 69 HD11 LEU 69 80.012 28.825 -11.322 351 HD12 LEU 69 HD12 LEU 69 81.694 28.279 -11.115 352 HD13 LEU 69 HD13 LEU 69 80.499 27.962 -9.849 353 HD21 LEU 69 HD21 LEU 69 82.021 31.890 -10.569 354 HD22 LEU 69 HD22 LEU 69 82.411 30.536 -11.627 355 HD23 LEU 69 HD23 LEU 69 80.783 31.240 -11.680 356 H ALA 70 H ALA 70 79.505 32.557 -5.865 357 HA ALA 70 HA ALA 70 76.727 32.323 -6.023 358 HB1 ALA 70 HB1 ALA 70 78.371 34.198 -4.261 359 HB2 ALA 70 HB2 ALA 70 76.690 33.698 -3.968 360 HB3 ALA 70 HB3 ALA 70 77.993 32.497 -3.912 361 H GLY 71 H GLY 71 75.219 33.335 -7.028 362 HA2 GLY 71 HA2 GLY 71 73.907 35.055 -7.915 363 HA3 GLY 71 HA3 GLY 71 75.187 36.228 -7.605 364 H LEU 72 H LEU 72 76.533 33.583 -9.269 365 HA LEU 72 HA LEU 72 76.433 35.024 -11.871 366 HB2 LEU 72 HB2 LEU 72 78.435 32.955 -10.896 367 HB3 LEU 72 HB3 LEU 72 78.557 33.900 -12.336 368 HG LEU 72 HG LEU 72 78.891 34.861 -9.493 369 HD11 LEU 72 HD11 LEU 72 80.641 35.148 -11.975 370 HD12 LEU 72 HD12 LEU 72 81.071 35.554 -10.299 371 HD13 LEU 72 HD13 LEU 72 80.818 33.868 -10.766 372 HD21 LEU 72 HD21 LEU 72 77.579 36.648 -10.541 373 HD22 LEU 72 HD22 LEU 72 79.259 37.150 -10.394 374 HD23 LEU 72 HD23 LEU 72 78.629 36.627 -11.968 375 HA PRO 73 HA PRO 73 73.925 32.214 -13.812 376 HB2 PRO 73 HB2 PRO 73 74.842 31.938 -16.386 377 HB3 PRO 73 HB3 PRO 73 74.239 33.481 -15.717 378 HG2 PRO 73 HG2 PRO 73 77.090 32.502 -16.028 379 HG3 PRO 73 HG3 PRO 73 76.443 34.127 -16.402 380 HD2 PRO 73 HD2 PRO 73 77.762 33.487 -14.125 381 HD3 PRO 73 HD3 PRO 73 76.520 34.779 -14.170 382 H VAL 74 H VAL 74 73.388 30.096 -14.686 383 HA VAL 74 HA VAL 74 75.508 28.058 -14.193 384 HB VAL 74 HB VAL 74 72.515 27.673 -14.349 385 HG11 VAL 74 HG11 VAL 74 74.753 25.833 -13.407 386 HG12 VAL 74 HG12 VAL 74 73.012 25.521 -13.222 387 HG13 VAL 74 HG13 VAL 74 73.717 25.595 -14.835 388 HG21 VAL 74 HG21 VAL 74 73.104 29.055 -12.387 389 HG22 VAL 74 HG22 VAL 74 72.626 27.435 -11.892 390 HG23 VAL 74 HG23 VAL 74 74.346 27.881 -11.919 391 H THR 75 H THR 75 73.247 29.065 -16.800 392 HA THR 75 HA THR 75 74.807 27.340 -18.697 393 HB THR 75 HB THR 75 72.883 27.046 -20.025 394 HG1 THR 75 HG1 THR 75 70.861 28.034 -19.244 395 HG21 THR 75 HG21 THR 75 71.908 26.745 -17.167 396 HG22 THR 75 HG22 THR 75 71.416 25.811 -18.600 397 HG23 THR 75 HG23 THR 75 73.066 25.652 -17.956 398 H ARG 76 H ARG 76 74.654 28.050 -21.055 399 HA ARG 76 HA ARG 76 75.800 30.694 -21.289 400 HB2 ARG 76 HB2 ARG 76 76.272 28.660 -22.731 401 HB3 ARG 76 HB3 ARG 76 74.711 28.911 -23.520 402 HG2 ARG 76 HG2 ARG 76 75.452 31.158 -24.275 403 HG3 ARG 76 HG3 ARG 76 76.994 30.951 -23.437 404 HD2 ARG 76 HD2 ARG 76 75.971 29.194 -25.699 405 HD3 ARG 76 HD3 ARG 76 77.120 30.529 -25.891 406 HE ARG 76 HE ARG 76 78.362 28.951 -24.000 407 HH11 ARG 76 HH11 ARG 76 77.191 28.235 -27.236 408 HH12 ARG 76 HH12 ARG 76 78.343 26.946 -27.448 409 HH21 ARG 76 HH21 ARG 76 79.747 27.337 -24.307 410 HH22 ARG 76 HH22 ARG 76 79.759 26.429 -25.809 411 H SER 77 H SER 77 72.530 29.450 -21.865 412 HA SER 77 HA SER 77 71.311 31.893 -22.721 413 HB2 SER 77 HB2 SER 77 70.108 29.663 -21.032 414 HB3 SER 77 HB3 SER 77 69.221 30.902 -21.941 415 HG SER 77 HG SER 77 69.399 28.915 -23.118 416 H ASP 78 H ASP 78 71.810 30.561 -19.352 417 HA ASP 78 HA ASP 78 70.629 32.793 -18.022 418 HB2 ASP 78 HB2 ASP 78 72.949 31.077 -17.085 419 HB3 ASP 78 HB3 ASP 78 71.981 32.139 -16.075 420 H ALA 79 H ALA 79 74.070 32.270 -19.001 421 HA ALA 79 HA ALA 79 75.017 34.754 -17.982 422 HB1 ALA 79 HB1 ALA 79 76.118 33.011 -20.240 423 HB2 ALA 79 HB2 ALA 79 77.010 34.267 -19.358 424 HB3 ALA 79 HB3 ALA 79 76.477 32.808 -18.507 425 H ARG 80 H ARG 80 73.747 34.004 -21.290 426 HA ARG 80 HA ARG 80 74.206 36.684 -22.266 427 HB2 ARG 80 HB2 ARG 80 73.773 34.536 -23.622 428 HB3 ARG 80 HB3 ARG 80 72.054 34.788 -23.291 429 HG2 ARG 80 HG2 ARG 80 72.343 37.148 -24.309 430 HG3 ARG 80 HG3 ARG 80 73.995 36.677 -24.709 431 HD2 ARG 80 HD2 ARG 80 72.813 36.347 -26.679 432 HD3 ARG 80 HD3 ARG 80 72.964 34.708 -26.019 433 HE ARG 80 HE ARG 80 70.531 35.557 -25.021 434 HH11 ARG 80 HH11 ARG 80 71.752 35.349 -28.321 435 HH12 ARG 80 HH12 ARG 80 70.120 35.421 -28.976 436 HH21 ARG 80 HH21 ARG 80 68.495 35.573 -26.019 437 HH22 ARG 80 HH22 ARG 80 68.415 35.533 -27.760 438 H VAL 81 H VAL 81 71.342 35.221 -20.694 439 HA VAL 81 HA VAL 81 69.646 37.550 -20.869 440 HB VAL 81 HB VAL 81 69.715 35.254 -18.879 441 HG11 VAL 81 HG11 VAL 81 67.629 37.471 -19.187 442 HG12 VAL 81 HG12 VAL 81 67.365 35.961 -18.296 443 HG13 VAL 81 HG13 VAL 81 68.579 37.106 -17.727 444 HG21 VAL 81 HG21 VAL 81 69.119 34.756 -21.261 445 HG22 VAL 81 HG22 VAL 81 67.816 34.438 -20.110 446 HG23 VAL 81 HG23 VAL 81 67.776 35.903 -21.132 447 H LEU 82 H LEU 82 71.912 36.486 -18.283 448 HA LEU 82 HA LEU 82 71.595 38.807 -16.644 449 HB2 LEU 82 HB2 LEU 82 73.970 36.961 -17.109 450 HB3 LEU 82 HB3 LEU 82 74.068 38.336 -16.018 451 HG LEU 82 HG LEU 82 72.183 35.975 -15.687 452 HD11 LEU 82 HD11 LEU 82 74.568 36.914 -14.037 453 HD12 LEU 82 HD12 LEU 82 73.654 35.400 -13.855 454 HD13 LEU 82 HD13 LEU 82 74.659 35.668 -15.291 455 HD21 LEU 82 HD21 LEU 82 71.070 37.916 -14.733 456 HD22 LEU 82 HD22 LEU 82 71.795 37.010 -13.408 457 HD23 LEU 82 HD23 LEU 82 72.590 38.480 -13.992 458 H ILE 83 H ILE 83 74.006 38.324 -19.305 459 HA ILE 83 HA ILE 83 75.168 40.899 -19.197 460 HB ILE 83 HB ILE 83 74.677 38.999 -21.506 461 HG12 ILE 83 HG12 ILE 83 77.276 39.927 -20.202 462 HG13 ILE 83 HG13 ILE 83 76.361 38.549 -19.606 463 HG21 ILE 83 HG21 ILE 83 76.147 41.676 -21.661 464 HG22 ILE 83 HG22 ILE 83 76.190 40.411 -22.903 465 HG23 ILE 83 HG23 ILE 83 74.685 41.235 -22.564 466 HD11 ILE 83 HD11 ILE 83 77.638 38.767 -22.358 467 HD12 ILE 83 HD12 ILE 83 78.132 37.733 -21.011 468 HD13 ILE 83 HD13 ILE 83 76.587 37.432 -21.824 469 H PHE 84 H PHE 84 72.264 39.918 -21.125 470 HA PHE 84 HA PHE 84 71.827 42.544 -22.088 471 HB2 PHE 84 HB2 PHE 84 70.913 40.347 -23.010 472 HB3 PHE 84 HB3 PHE 84 69.716 40.386 -21.733 473 HD1 PHE 84 HD1 PHE 84 71.106 43.050 -24.059 474 HD2 PHE 84 HD2 PHE 84 67.612 40.932 -22.668 475 HE1 PHE 84 HE1 PHE 84 69.737 44.291 -25.660 476 HE2 PHE 84 HE2 PHE 84 66.211 42.251 -24.238 477 HZ PHE 84 HZ PHE 84 67.262 43.923 -25.750 478 H ASN 85 H ASN 85 70.164 40.899 -19.323 479 HA ASN 85 HA ASN 85 68.436 43.125 -18.824 480 HB2 ASN 85 HB2 ASN 85 67.979 40.766 -18.155 481 HB3 ASN 85 HB3 ASN 85 69.305 40.837 -16.994 482 HD21 ASN 85 HD22 ASN 85 66.148 42.380 -17.812 483 HD22 ASN 85 HD21 ASN 85 65.800 42.824 -16.151 484 H GLU 86 H GLU 86 71.570 42.176 -17.315 485 HA GLU 86 HA GLU 86 71.595 44.334 -15.398 486 HB2 GLU 86 HB2 GLU 86 72.990 42.267 -15.219 487 HB3 GLU 86 HB3 GLU 86 73.960 42.834 -16.594 488 HG2 GLU 86 HG2 GLU 86 74.618 44.841 -15.328 489 HG3 GLU 86 HG3 GLU 86 73.581 44.358 -13.984 490 H TRP 87 H TRP 87 73.031 44.011 -18.769 491 HA TRP 87 HA TRP 87 74.051 46.669 -18.801 492 HB2 TRP 87 HB2 TRP 87 74.728 45.112 -20.488 493 HB3 TRP 87 HB3 TRP 87 73.063 44.852 -20.996 494 HD1 TRP 87 HD1 TRP 87 75.749 47.625 -21.164 495 HE1 TRP 87 HE1 TRP 87 75.288 49.038 -23.253 496 HE3 TRP 87 HE3 TRP 87 71.366 45.463 -22.620 497 HZ2 TRP 87 HZ2 TRP 87 73.371 49.069 -25.406 498 HZ3 TRP 87 HZ3 TRP 87 70.338 46.091 -24.754 499 HH2 TRP 87 HH2 TRP 87 71.290 47.913 -26.162 500 H GLU 88 H GLU 88 70.740 45.487 -19.832 501 HA GLU 88 HA GLU 88 69.773 47.984 -20.675 502 HB2 GLU 88 HB2 GLU 88 68.421 45.575 -19.422 503 HB3 GLU 88 HB3 GLU 88 67.520 47.033 -19.799 504 HG2 GLU 88 HG2 GLU 88 68.253 46.904 -22.163 505 HG3 GLU 88 HG3 GLU 88 69.020 45.354 -21.837 506 H GLU 89 H GLU 89 69.556 46.681 -17.248 507 HA GLU 89 HA GLU 89 68.269 48.999 -16.237 508 HB2 GLU 89 HB2 GLU 89 68.379 46.699 -15.241 509 HB3 GLU 89 HB3 GLU 89 70.084 46.976 -14.838 510 HG2 GLU 89 HG2 GLU 89 69.437 48.907 -13.463 511 HG3 GLU 89 HG3 GLU 89 67.748 48.681 -13.944 512 H ARG 90 H ARG 90 71.741 48.067 -16.182 513 HA ARG 90 HA ARG 90 72.728 50.440 -14.885 514 HB2 ARG 90 HB2 ARG 90 74.040 48.542 -16.881 515 HB3 ARG 90 HB3 ARG 90 74.903 49.799 -15.993 516 HG2 ARG 90 HG2 ARG 90 73.370 47.537 -14.705 517 HG3 ARG 90 HG3 ARG 90 75.096 47.485 -15.062 518 HD2 ARG 90 HD2 ARG 90 73.692 49.384 -13.126 519 HD3 ARG 90 HD3 ARG 90 74.697 48.001 -12.700 520 HE ARG 90 HE ARG 90 75.792 50.357 -14.240 521 HH11 ARG 90 HH11 ARG 90 76.197 48.283 -11.411 522 HH12 ARG 90 HH12 ARG 90 77.721 49.037 -11.028 523 HH21 ARG 90 HH21 ARG 90 77.546 51.207 -13.732 524 HH22 ARG 90 HH22 ARG 90 78.510 50.709 -12.334 525 H LYS 91 H LYS 91 72.452 49.648 -18.310 526 HA LYS 91 HA LYS 91 73.356 52.130 -19.352 527 HB2 LYS 91 HB2 LYS 91 73.009 50.011 -20.701 528 HB3 LYS 91 HB3 LYS 91 71.273 50.190 -20.495 529 HG2 LYS 91 HG2 LYS 91 71.627 50.776 -22.669 530 HG3 LYS 91 HG3 LYS 91 71.443 52.346 -21.892 531 HD2 LYS 91 HD2 LYS 91 73.829 52.765 -22.039 532 HD3 LYS 91 HD3 LYS 91 74.149 51.066 -22.344 533 HE2 LYS 91 HE2 LYS 91 74.484 51.977 -24.419 534 HE3 LYS 91 HE3 LYS 91 72.895 51.225 -24.523 535 HZ1 LYS 91 HZ1 LYS 91 73.492 54.122 -24.223 536 HZ2 LYS 91 HZ2 LYS 91 72.892 53.402 -25.545 537 HZ3 LYS 91 HZ3 LYS 91 71.947 53.517 -24.211 538 H LYS 92 H LYS 92 69.997 51.246 -18.396 539 HA LYS 92 HA LYS 92 68.855 53.808 -19.112 540 HB2 LYS 92 HB2 LYS 92 68.051 51.661 -17.120 541 HB3 LYS 92 HB3 LYS 92 67.166 53.183 -17.274 542 HG2 LYS 92 HG2 LYS 92 66.666 52.768 -19.611 543 HG3 LYS 92 HG3 LYS 92 67.713 51.355 -19.649 544 HD2 LYS 92 HD2 LYS 92 65.430 50.616 -19.555 545 HD3 LYS 92 HD3 LYS 92 66.219 50.193 -18.029 546 HE2 LYS 92 HE2 LYS 92 65.172 52.162 -16.930 547 HE3 LYS 92 HE3 LYS 92 64.456 52.655 -18.469 548 HZ1 LYS 92 HZ1 LYS 92 63.816 50.122 -17.032 549 HZ2 LYS 92 HZ2 LYS 92 62.856 51.439 -17.098 550 HZ3 LYS 92 HZ3 LYS 92 63.153 50.586 -18.455 551 H SER 93 H SER 93 70.668 52.783 -16.190 552 HA SER 93 HA SER 93 70.606 55.553 -15.154 553 HB2 SER 93 HB2 SER 93 72.270 53.162 -14.320 554 HB3 SER 93 HB3 SER 93 72.251 54.738 -13.512 555 HG SER 93 HG SER 93 70.783 53.248 -12.533 556 H GLU 94 H GLU 94 72.652 53.906 -17.419 557 HA GLU 94 HA GLU 94 74.778 56.006 -17.396 558 HB2 GLU 94 HB2 GLU 94 75.204 52.986 -17.474 559 HB3 GLU 94 HB3 GLU 94 76.433 54.242 -17.468 560 HG2 GLU 94 HG2 GLU 94 75.548 54.938 -15.188 561 HG3 GLU 94 HG3 GLU 94 74.524 53.494 -15.257 562 HA PRO 95 HA PRO 95 73.019 55.076 -21.597 563 HB2 PRO 95 HB2 PRO 95 73.643 57.547 -22.784 564 HB3 PRO 95 HB3 PRO 95 72.131 57.119 -21.937 565 HG2 PRO 95 HG2 PRO 95 74.570 58.533 -20.835 566 HG3 PRO 95 HG3 PRO 95 72.841 58.956 -20.613 567 HD2 PRO 95 HD2 PRO 95 74.161 57.620 -18.693 568 HD3 PRO 95 HD3 PRO 95 72.499 57.124 -19.122 569 H TRP 96 H TRP 96 76.283 56.122 -20.806 570 HA TRP 96 HA TRP 96 77.496 55.581 -23.366 571 HB2 TRP 96 HB2 TRP 96 79.598 55.813 -22.043 572 HB3 TRP 96 HB3 TRP 96 78.477 57.146 -21.850 573 HD1 TRP 96 HD1 TRP 96 79.944 54.188 -19.920 574 HE1 TRP 96 HE1 TRP 96 79.547 54.504 -17.402 575 HE3 TRP 96 HE3 TRP 96 76.948 58.345 -20.086 576 HZ2 TRP 96 HZ2 TRP 96 78.054 56.280 -15.686 577 HZ3 TRP 96 HZ3 TRP 96 76.027 59.307 -17.988 578 HH2 TRP 96 HH2 TRP 96 76.564 58.283 -15.791 579 H LEU 97 H LEU 97 76.277 53.220 -21.135 580 HA LEU 97 HA LEU 97 78.501 51.519 -21.072 581 HB2 LEU 97 HB2 LEU 97 76.389 51.628 -19.563 582 HB3 LEU 97 HB3 LEU 97 75.615 50.637 -20.769 583 HG LEU 97 HG LEU 97 77.394 48.941 -20.464 584 HD11 LEU 97 HD11 LEU 97 78.251 50.705 -18.129 585 HD12 LEU 97 HD12 LEU 97 78.751 49.016 -18.352 586 HD13 LEU 97 HD13 LEU 97 79.257 50.234 -19.518 587 HD21 LEU 97 HD21 LEU 97 75.196 48.876 -19.243 588 HD22 LEU 97 HD22 LEU 97 76.504 48.118 -18.309 589 HD23 LEU 97 HD23 LEU 97 75.966 49.768 -17.919 590 H ARG 98 H ARG 98 79.303 49.951 -22.322 591 HA ARG 98 HA ARG 98 78.043 49.316 -24.914 592 HB2 ARG 98 HB2 ARG 98 80.158 48.342 -25.525 593 HB3 ARG 98 HB3 ARG 98 80.381 49.957 -24.856 594 HG2 ARG 98 HG2 ARG 98 81.094 48.941 -22.676 595 HG3 ARG 98 HG3 ARG 98 80.911 47.326 -23.389 596 HD2 ARG 98 HD2 ARG 98 82.616 47.869 -25.085 597 HD3 ARG 98 HD3 ARG 98 82.767 49.510 -24.418 598 HE ARG 98 HE ARG 98 83.212 47.601 -22.333 599 HH11 ARG 98 HH11 ARG 98 84.877 48.803 -25.175 600 HH12 ARG 98 HH12 ARG 98 86.451 48.462 -24.512 601 HH21 ARG 98 HH21 ARG 98 85.252 47.196 -21.542 602 HH22 ARG 98 HH22 ARG 98 86.650 47.570 -22.505 603 H LEU 99 H LEU 99 78.029 47.153 -25.768 604 HA LEU 99 HA LEU 99 77.125 45.055 -23.851 605 HB2 LEU 99 HB2 LEU 99 75.329 46.552 -24.518 606 HB3 LEU 99 HB3 LEU 99 75.641 46.314 -26.205 607 HG LEU 99 HG LEU 99 73.594 45.221 -25.290 608 HD11 LEU 99 HD11 LEU 99 75.436 43.071 -26.344 609 HD12 LEU 99 HD12 LEU 99 73.725 43.384 -26.716 610 HD13 LEU 99 HD13 LEU 99 74.955 44.449 -27.349 611 HD21 LEU 99 HD21 LEU 99 74.740 44.562 -23.099 612 HD22 LEU 99 HD22 LEU 99 73.475 43.575 -23.793 613 HD23 LEU 99 HD23 LEU 99 75.201 43.088 -23.971 614 H ASP 100 H ASP 100 77.887 43.046 -24.441 615 HA ASP 100 HA ASP 100 78.373 42.373 -27.275 616 HB2 ASP 100 HB2 ASP 100 80.507 43.347 -26.453 617 HB3 ASP 100 HB3 ASP 100 80.533 42.167 -25.142 618 H MET 101 H MET 101 77.952 40.261 -27.720 619 HA MET 101 HA MET 101 77.187 38.448 -25.452 620 HB2 MET 101 HB2 MET 101 75.619 39.124 -27.972 621 HB3 MET 101 HB3 MET 101 75.187 37.840 -26.838 622 HG2 MET 101 HG2 MET 101 74.949 39.466 -25.019 623 HG3 MET 101 HG3 MET 101 75.374 40.784 -26.120 624 HE1 MET 101 HE1 MET 101 72.996 42.058 -25.337 625 HE2 MET 101 HE2 MET 101 71.492 41.115 -25.332 626 HE3 MET 101 HE3 MET 101 72.836 40.640 -24.269 627 H SER 102 H SER 102 79.294 38.576 -28.026 628 HA SER 102 HA SER 102 78.977 35.995 -29.237 629 HB2 SER 102 HB2 SER 102 81.465 37.698 -28.817 630 HB3 SER 102 HB3 SER 102 81.377 36.255 -29.849 631 HG SER 102 HG SER 102 81.034 38.227 -31.032 632 H ASP 103 H ASP 103 80.131 34.028 -28.859 633 HA ASP 103 HA ASP 103 79.972 33.059 -26.276 634 HB2 ASP 103 HB2 ASP 103 81.091 31.084 -27.050 635 HB3 ASP 103 HB3 ASP 103 79.951 31.660 -28.244 636 H LYS 104 H LYS 104 82.962 34.278 -27.766 637 HA LYS 104 HA LYS 104 84.820 33.828 -25.739 638 HB2 LYS 104 HB2 LYS 104 85.172 34.854 -28.010 639 HB3 LYS 104 HB3 LYS 104 84.589 36.394 -27.372 640 HG2 LYS 104 HG2 LYS 104 86.423 36.398 -25.693 641 HG3 LYS 104 HG3 LYS 104 86.995 34.838 -26.293 642 HD2 LYS 104 HD2 LYS 104 86.881 37.417 -27.925 643 HD3 LYS 104 HD3 LYS 104 88.315 36.797 -27.095 644 HE2 LYS 104 HE2 LYS 104 88.199 34.709 -28.464 645 HE3 LYS 104 HE3 LYS 104 86.816 35.371 -29.343 646 HZ1 LYS 104 HZ1 LYS 104 89.541 36.577 -29.294 647 HZ2 LYS 104 HZ2 LYS 104 88.892 35.760 -30.547 648 HZ3 LYS 104 HZ3 LYS 104 88.261 37.197 -30.104 649 H ALA 105 H ALA 105 82.363 36.411 -25.739 650 HA ALA 105 HA ALA 105 83.311 37.780 -23.384 651 HB1 ALA 105 HB1 ALA 105 80.484 37.640 -24.503 652 HB2 ALA 105 HB2 ALA 105 81.129 38.844 -23.376 653 HB3 ALA 105 HB3 ALA 105 81.748 38.770 -25.035 654 H ILE 106 H ILE 106 81.147 34.998 -23.831 655 HA ILE 106 HA ILE 106 80.414 34.879 -21.006 656 HB ILE 106 HB ILE 106 79.966 32.994 -23.349 657 HG12 ILE 106 HG12 ILE 106 77.602 33.540 -22.965 658 HG13 ILE 106 HG13 ILE 106 78.031 34.599 -21.621 659 HG21 ILE 106 HG21 ILE 106 79.123 32.624 -20.433 660 HG22 ILE 106 HG22 ILE 106 78.473 31.696 -21.798 661 HG23 ILE 106 HG23 ILE 106 80.175 31.551 -21.386 662 HD11 ILE 106 HD11 ILE 106 78.868 35.094 -24.506 663 HD12 ILE 106 HD12 ILE 106 77.414 35.776 -23.748 664 HD13 ILE 106 HD13 ILE 106 79.012 36.229 -23.141 665 H PHE 107 H PHE 107 82.683 33.025 -23.106 666 HA PHE 107 HA PHE 107 83.794 31.355 -21.107 667 HB2 PHE 107 HB2 PHE 107 85.401 32.754 -23.270 668 HB3 PHE 107 HB3 PHE 107 85.794 31.247 -22.467 669 HD1 PHE 107 HD1 PHE 107 82.730 30.168 -22.861 670 HD2 PHE 107 HD2 PHE 107 85.819 31.803 -25.388 671 HE1 PHE 107 HE1 PHE 107 81.813 28.915 -24.795 672 HE2 PHE 107 HE2 PHE 107 84.890 30.536 -27.330 673 HZ PHE 107 HZ PHE 107 82.900 29.080 -27.021 674 H ARG 108 H ARG 108 84.801 34.689 -21.990 675 HA ARG 108 HA ARG 108 86.944 34.806 -20.106 676 HB2 ARG 108 HB2 ARG 108 86.648 35.889 -22.348 677 HB3 ARG 108 HB3 ARG 108 85.538 37.053 -21.635 678 HG2 ARG 108 HG2 ARG 108 88.345 36.692 -20.518 679 HG3 ARG 108 HG3 ARG 108 88.100 37.512 -22.049 680 HD2 ARG 108 HD2 ARG 108 88.228 39.259 -20.535 681 HD3 ARG 108 HD3 ARG 108 86.499 39.104 -20.884 682 HE ARG 108 HE ARG 108 87.224 37.553 -18.551 683 HH11 ARG 108 HH11 ARG 108 86.761 40.919 -19.421 684 HH12 ARG 108 HH12 ARG 108 86.331 41.369 -17.796 685 HH21 ARG 108 HH21 ARG 108 86.676 38.177 -16.527 686 HH22 ARG 108 HH22 ARG 108 86.298 39.841 -16.184 687 H ARG 109 H ARG 109 83.592 36.084 -19.935 688 HA ARG 109 HA ARG 109 83.975 37.294 -17.281 689 HB2 ARG 109 HB2 ARG 109 81.496 36.579 -18.905 690 HB3 ARG 109 HB3 ARG 109 81.440 37.372 -17.329 691 HG2 ARG 109 HG2 ARG 109 82.694 39.289 -18.150 692 HG3 ARG 109 HG3 ARG 109 82.933 38.529 -19.728 693 HD2 ARG 109 HD2 ARG 109 80.510 38.516 -20.133 694 HD3 ARG 109 HD3 ARG 109 80.201 39.220 -18.548 695 HE ARG 109 HE ARG 109 81.243 40.561 -20.961 696 HH11 ARG 109 HH11 ARG 109 80.785 40.964 -17.500 697 HH12 ARG 109 HH12 ARG 109 80.951 42.693 -17.593 698 HH21 ARG 109 HH21 ARG 109 81.454 42.768 -20.996 699 HH22 ARG 109 HH22 ARG 109 81.319 43.682 -19.526 700 H TYR 110 H TYR 110 82.798 34.178 -18.444 701 HA TYR 110 HA TYR 110 82.466 33.173 -15.648 702 HB2 TYR 110 HB2 TYR 110 80.696 32.597 -18.045 703 HB3 TYR 110 HB3 TYR 110 80.470 32.062 -16.394 704 HD1 TYR 110 HD2 TYR 110 80.388 34.033 -14.564 705 HD2 TYR 110 HD1 TYR 110 79.497 34.462 -18.766 706 HE1 TYR 110 HE2 TYR 110 79.102 36.123 -14.100 707 HE2 TYR 110 HE1 TYR 110 78.172 36.516 -18.287 708 HH TYR 110 HH TYR 110 77.452 37.999 -16.662 709 HA PRO 111 HA PRO 111 85.423 30.531 -18.090 710 HB2 PRO 111 HB2 PRO 111 87.240 30.003 -16.093 711 HB3 PRO 111 HB3 PRO 111 87.245 31.494 -17.082 712 HG2 PRO 111 HG2 PRO 111 86.008 31.090 -14.338 713 HG3 PRO 111 HG3 PRO 111 87.110 32.402 -14.871 714 HD2 PRO 111 HD2 PRO 111 84.438 32.770 -14.822 715 HD3 PRO 111 HD3 PRO 111 85.410 33.419 -16.179 716 H HIS 112 H HIS 112 83.499 29.915 -15.257 717 HA HIS 112 HA HIS 112 83.907 27.033 -15.143 718 HB2 HIS 112 HB2 HIS 112 82.220 27.071 -13.526 719 HB3 HIS 112 HB3 HIS 112 83.024 28.617 -13.296 720 HD2 HIS 112 HD2 HIS 112 79.693 27.079 -13.806 721 HE1 HIS 112 HE1 HIS 112 78.997 31.094 -15.015 722 HE2 HIS 112 HE2 HIS 112 77.902 28.979 -14.353 723 H LEU 113 H LEU 113 81.991 29.174 -17.151 724 HA LEU 113 HA LEU 113 79.777 27.436 -17.493 725 HB2 LEU 113 HB2 LEU 113 80.060 30.026 -17.444 726 HB3 LEU 113 HB3 LEU 113 80.504 29.894 -19.128 727 HG LEU 113 HG LEU 113 78.261 30.571 -18.943 728 HD11 LEU 113 HD11 LEU 113 78.031 27.633 -19.660 729 HD12 LEU 113 HD12 LEU 113 77.150 29.012 -20.323 730 HD13 LEU 113 HD13 LEU 113 78.853 28.827 -20.698 731 HD21 LEU 113 HD21 LEU 113 77.746 29.843 -16.700 732 HD22 LEU 113 HD22 LEU 113 76.506 29.332 -17.817 733 HD23 LEU 113 HD23 LEU 113 77.682 28.140 -17.225 734 H ARG 114 H ARG 114 82.275 28.546 -19.777 735 HA ARG 114 HA ARG 114 82.823 27.977 -21.919 736 HB2 ARG 114 HB2 ARG 114 83.942 26.302 -20.395 737 HB3 ARG 114 HB3 ARG 114 82.699 25.139 -20.863 738 HG2 ARG 114 HG2 ARG 114 83.433 25.397 -23.263 739 HG3 ARG 114 HG3 ARG 114 84.671 26.547 -22.735 740 HD2 ARG 114 HD2 ARG 114 85.718 24.814 -21.336 741 HD3 ARG 114 HD3 ARG 114 84.467 23.654 -21.775 742 HE ARG 114 HE ARG 114 86.739 24.575 -23.406 743 HH11 ARG 114 HH11 ARG 114 83.712 22.802 -23.532 744 HH12 ARG 114 HH12 ARG 114 84.162 21.969 -24.994 745 HH21 ARG 114 HH21 ARG 114 87.235 23.486 -25.265 746 HH22 ARG 114 HH22 ARG 114 86.105 22.356 -25.950 Start of MODEL 7 1 H1 MET 1 H1 MET 1 93.349 70.560-107.755 2 H2 MET 1 H2 MET 1 93.841 71.884-106.932 3 H3 MET 1 H3 MET 1 92.310 71.797-107.514 4 HA MET 1 HA MET 1 93.431 70.054-105.399 5 HB2 MET 1 HB2 MET 1 91.429 72.358-105.171 6 HB3 MET 1 HB3 MET 1 91.672 71.138-103.929 7 HG2 MET 1 HG2 MET 1 92.911 72.998-103.250 8 HG3 MET 1 HG3 MET 1 94.076 71.786-103.763 9 HE1 MET 1 HE1 MET 1 95.976 73.631-103.669 10 HE2 MET 1 HE2 MET 1 95.875 75.201-104.496 11 HE3 MET 1 HE3 MET 1 94.773 74.836-103.150 12 H ARG 2 H ARG 2 91.933 68.557-104.427 13 HA ARG 2 HA ARG 2 89.391 67.990-105.833 14 HB2 ARG 2 HB2 ARG 2 89.952 65.666-106.300 15 HB3 ARG 2 HB3 ARG 2 91.044 66.751-107.153 16 HG2 ARG 2 HG2 ARG 2 92.808 66.334-105.442 17 HG3 ARG 2 HG3 ARG 2 91.709 65.244-104.577 18 HD2 ARG 2 HD2 ARG 2 91.594 63.779-106.593 19 HD3 ARG 2 HD3 ARG 2 92.673 64.882-107.443 20 HE ARG 2 HE ARG 2 94.503 64.122-106.230 21 HH11 ARG 2 HH11 ARG 2 91.650 62.616-104.834 22 HH12 ARG 2 HH12 ARG 2 92.599 61.500-103.893 23 HH21 ARG 2 HH21 ARG 2 95.636 62.670-105.007 24 HH22 ARG 2 HH22 ARG 2 94.798 61.533-103.994 25 H GLY 3 H GLY 3 88.062 66.432-104.796 26 HA2 GLY 3 HA2 GLY 3 88.087 64.837-102.748 27 HA3 GLY 3 HA3 GLY 3 88.364 66.306-101.818 28 H SER 4 H SER 4 86.064 64.250-102.225 29 HA SER 4 HA SER 4 83.808 66.191-102.141 30 HB2 SER 4 HB2 SER 4 83.881 63.709-103.909 31 HB3 SER 4 HB3 SER 4 82.460 64.724-103.612 32 HG SER 4 HG SER 4 83.534 65.264-105.584 33 H HIS 5 H HIS 5 82.065 65.542-100.897 34 HA HIS 5 HA HIS 5 81.821 62.804 -99.889 35 HB2 HIS 5 HB2 HIS 5 81.846 63.376 -97.538 36 HB3 HIS 5 HB3 HIS 5 83.391 63.800 -98.257 37 HD2 HIS 5 HD2 HIS 5 83.926 66.475 -98.574 38 HE1 HIS 5 HE1 HIS 5 80.859 67.859 -95.949 39 HE2 HIS 5 HE2 HIS 5 82.959 68.527 -97.226 40 H HIS 6 H HIS 6 79.787 62.339 -98.964 41 HA HIS 6 HA HIS 6 77.728 64.376 -98.647 42 HB2 HIS 6 HB2 HIS 6 77.623 64.026-101.100 43 HB3 HIS 6 HB3 HIS 6 77.465 62.287-100.857 44 HD2 HIS 6 HD2 HIS 6 75.514 65.587-100.144 45 HE1 HIS 6 HE1 HIS 6 72.651 62.422-100.203 46 HE2 HIS 6 HE2 HIS 6 72.960 64.946-100.022 47 H HIS 7 H HIS 7 76.047 63.681 -97.357 48 HA HIS 7 HA HIS 7 75.425 60.862 -97.041 49 HB2 HIS 7 HB2 HIS 7 75.570 60.793 -94.609 50 HB3 HIS 7 HB3 HIS 7 77.152 61.062 -95.316 51 HD2 HIS 7 HD2 HIS 7 74.587 62.651 -92.987 52 HE1 HIS 7 HE1 HIS 7 77.890 65.350 -93.088 53 HE2 HIS 7 HE2 HIS 7 75.687 64.803 -91.933 54 H HIS 8 H HIS 8 73.318 60.498 -96.424 55 HA HIS 8 HA HIS 8 71.641 62.567 -95.249 56 HB2 HIS 8 HB2 HIS 8 71.658 63.112 -97.736 57 HB3 HIS 8 HB3 HIS 8 70.910 61.542 -98.026 58 HD2 HIS 8 HD2 HIS 8 70.238 64.828 -96.019 59 HE1 HIS 8 HE1 HIS 8 66.439 63.153 -96.983 60 HE2 HIS 8 HE2 HIS 8 67.622 65.131 -95.905 61 H HIS 9 H HIS 9 69.596 61.722 -94.493 62 HA HIS 9 HA HIS 9 68.991 58.873 -94.786 63 HB2 HIS 9 HB2 HIS 9 69.246 58.284 -92.460 64 HB3 HIS 9 HB3 HIS 9 70.784 58.881 -93.051 65 HD2 HIS 9 HD2 HIS 9 71.652 61.273 -92.087 66 HE1 HIS 9 HE1 HIS 9 68.769 61.630 -88.961 67 HE2 HIS 9 HE2 HIS 9 70.945 62.565 -89.897 68 H HIS 10 H HIS 10 67.097 58.211 -93.514 69 HA HIS 10 HA HIS 10 65.241 60.367 -92.646 70 HB2 HIS 10 HB2 HIS 10 64.536 58.056 -94.505 71 HB3 HIS 10 HB3 HIS 10 63.365 59.100 -93.714 72 HD2 HIS 10 HD2 HIS 10 63.323 61.747 -94.484 73 HE1 HIS 10 HE1 HIS 10 65.044 60.999 -98.317 74 HE2 HIS 10 HE2 HIS 10 63.743 62.682 -96.912 75 H GLY 11 H GLY 11 63.820 59.771 -90.998 76 HA2 GLY 11 HA2 GLY 11 62.880 57.370 -90.184 77 HA3 GLY 11 HA3 GLY 11 64.459 57.368 -89.405 78 H SER 28 H SER 28 61.348 57.883 -88.754 79 HA SER 28 HA SER 28 61.917 59.274 -86.260 80 HB2 SER 28 HB2 SER 28 61.508 61.172 -87.858 81 HB3 SER 28 HB3 SER 28 59.891 60.514 -88.171 82 HG SER 28 HG SER 28 59.923 62.155 -86.515 83 H VAL 29 H VAL 29 60.354 58.863 -84.687 84 HA VAL 29 HA VAL 29 57.878 57.381 -85.378 85 HB VAL 29 HB VAL 29 59.852 56.362 -83.290 86 HG11 VAL 29 HG11 VAL 29 57.151 55.271 -84.208 87 HG12 VAL 29 HG12 VAL 29 58.272 54.451 -83.100 88 HG13 VAL 29 HG13 VAL 29 57.516 55.963 -82.609 89 HG21 VAL 29 HG21 VAL 29 60.652 55.740 -85.522 90 HG22 VAL 29 HG22 VAL 29 59.993 54.325 -84.704 91 HG23 VAL 29 HG23 VAL 29 59.036 55.140 -85.961 92 H SER 30 H SER 30 56.201 58.152 -84.265 93 HA SER 30 HA SER 30 56.557 59.436 -81.601 94 HB2 SER 30 HB2 SER 30 55.069 60.683 -83.947 95 HB3 SER 30 HB3 SER 30 55.020 61.264 -82.273 96 HG SER 30 HG SER 30 56.566 62.404 -83.559 97 H PHE 31 H PHE 31 54.980 58.963 -80.183 98 HA PHE 31 HA PHE 31 52.274 58.211 -81.003 99 HB2 PHE 31 HB2 PHE 31 53.503 56.057 -81.170 100 HB3 PHE 31 HB3 PHE 31 54.065 56.241 -79.515 101 HD1 PHE 31 HD1 PHE 31 50.954 55.943 -81.601 102 HD2 PHE 31 HD2 PHE 31 52.728 55.429 -77.701 103 HE1 PHE 31 HE1 PHE 31 48.867 54.865 -80.788 104 HE2 PHE 31 HE2 PHE 31 50.639 54.354 -76.895 105 HZ PHE 31 HZ PHE 31 48.707 54.072 -78.436 106 H GLY 32 H GLY 32 50.772 58.205 -79.245 107 HA2 GLY 32 HA2 GLY 32 51.505 58.406 -76.505 108 HA3 GLY 32 HA3 GLY 32 51.099 60.021 -77.090 109 H ALA 33 H ALA 33 49.824 57.674 -75.369 110 HA ALA 33 HA ALA 33 47.031 58.355 -76.057 111 HB1 ALA 33 HB1 ALA 33 48.060 55.486 -75.951 112 HB2 ALA 33 HB2 ALA 33 46.358 55.979 -76.102 113 HB3 ALA 33 HB3 ALA 33 47.505 56.352 -77.399 114 HA PRO 34 HA PRO 34 48.174 58.096 -71.489 115 HB2 PRO 34 HB2 PRO 34 47.587 60.646 -70.708 116 HB3 PRO 34 HB3 PRO 34 49.150 60.190 -71.455 117 HG2 PRO 34 HG2 PRO 34 46.712 61.376 -72.830 118 HG3 PRO 34 HG3 PRO 34 48.415 61.929 -72.932 119 HD2 PRO 34 HD2 PRO 34 47.336 60.302 -74.822 120 HD3 PRO 34 HD3 PRO 34 49.029 60.092 -74.280 121 H SER 35 H SER 35 46.772 57.839 -69.757 122 HA SER 35 HA SER 35 43.951 58.628 -69.898 123 HB2 SER 35 HB2 SER 35 43.131 56.308 -69.563 124 HB3 SER 35 HB3 SER 35 43.890 56.544 -71.141 125 HG SER 35 HG SER 35 44.580 54.590 -70.142 126 HA PRO 36 HA PRO 36 44.533 58.677 -65.462 127 HB2 PRO 36 HB2 PRO 36 41.987 58.459 -64.496 128 HB3 PRO 36 HB3 PRO 36 42.584 59.915 -65.351 129 HG2 PRO 36 HG2 PRO 36 41.002 57.595 -66.512 130 HG3 PRO 36 HG3 PRO 36 40.673 59.350 -66.681 131 HD2 PRO 36 HD2 PRO 36 42.004 57.956 -68.594 132 HD3 PRO 36 HD3 PRO 36 42.467 59.636 -68.191 133 H LEU 37 H LEU 37 44.646 57.322 -63.642 134 HA LEU 37 HA LEU 37 43.666 54.535 -63.800 135 HB2 LEU 37 HB2 LEU 37 45.857 54.540 -64.952 136 HB3 LEU 37 HB3 LEU 37 46.598 55.318 -63.557 137 HG LEU 37 HG LEU 37 46.124 53.289 -62.177 138 HD11 LEU 37 HD11 LEU 37 45.188 52.090 -64.823 139 HD12 LEU 37 HD12 LEU 37 45.500 51.181 -63.328 140 HD13 LEU 37 HD13 LEU 37 44.180 52.349 -63.383 141 HD21 LEU 37 HD21 LEU 37 48.285 53.569 -63.327 142 HD22 LEU 37 HD22 LEU 37 47.821 51.864 -63.229 143 HD23 LEU 37 HD23 LEU 37 47.636 52.746 -64.764 144 H SER 38 H SER 38 43.062 53.766 -61.870 145 HA SER 38 HA SER 38 44.480 54.476 -59.416 146 HB2 SER 38 HB2 SER 38 42.691 56.213 -59.539 147 HB3 SER 38 HB3 SER 38 41.472 54.923 -59.578 148 HG SER 38 HG SER 38 41.882 55.751 -57.435 149 H SER 39 H SER 39 44.347 52.877 -57.873 150 HA SER 39 HA SER 39 42.638 50.482 -58.333 151 HB2 SER 39 HB2 SER 39 44.611 49.017 -58.108 152 HB3 SER 39 HB3 SER 39 44.712 50.066 -59.528 153 HG SER 39 HG SER 39 46.696 50.004 -58.333 154 H GLU 40 H GLU 40 43.155 52.755 -56.153 155 HA GLU 40 HA GLU 40 43.551 50.954 -53.798 156 HB2 GLU 40 HB2 GLU 40 45.317 52.618 -54.195 157 HB3 GLU 40 HB3 GLU 40 44.130 53.921 -54.067 158 HG2 GLU 40 HG2 GLU 40 43.636 53.229 -51.725 159 HG3 GLU 40 HG3 GLU 40 44.787 51.902 -51.877 160 H SER 41 H SER 41 41.774 50.495 -52.718 161 HA SER 41 HA SER 41 39.708 52.614 -52.226 162 HB2 SER 41 HB2 SER 41 39.285 49.614 -52.434 163 HB3 SER 41 HB3 SER 41 38.039 50.835 -52.118 164 HG SER 41 HG SER 41 38.113 50.226 -54.339 165 H GLU 42 H GLU 42 42.177 51.264 -50.641 166 HA GLU 42 HA GLU 42 42.764 50.748 -48.522 167 HB2 GLU 42 HB2 GLU 42 40.530 52.650 -47.767 168 HB3 GLU 42 HB3 GLU 42 41.894 52.172 -46.756 169 HG2 GLU 42 HG2 GLU 42 43.470 53.151 -48.416 170 HG3 GLU 42 HG3 GLU 42 42.096 53.714 -49.374 171 H ASP 43 H ASP 43 40.487 49.023 -49.679 172 HA ASP 43 HA ASP 43 38.990 48.135 -47.396 173 HB2 ASP 43 HB2 ASP 43 38.217 48.058 -49.759 174 HB3 ASP 43 HB3 ASP 43 39.420 46.811 -50.097 175 H GLU 44 H GLU 44 42.016 47.176 -48.656 176 HA GLU 44 HA GLU 44 42.235 44.902 -46.714 177 HB2 GLU 44 HB2 GLU 44 43.726 43.794 -48.240 178 HB3 GLU 44 HB3 GLU 44 42.217 44.186 -49.057 179 HG2 GLU 44 HG2 GLU 44 43.298 46.127 -50.164 180 HG3 GLU 44 HG3 GLU 44 44.805 45.787 -49.315 181 H ILE 45 H ILE 45 43.221 47.995 -46.878 182 HA ILE 45 HA ILE 45 46.072 47.548 -46.206 183 HB ILE 45 HB ILE 45 44.719 50.229 -46.593 184 HG12 ILE 45 HG12 ILE 45 46.102 48.440 -48.651 185 HG13 ILE 45 HG13 ILE 45 44.405 48.909 -48.653 186 HG21 ILE 45 HG21 ILE 45 47.649 49.368 -46.839 187 HG22 ILE 45 HG22 ILE 45 47.014 51.026 -46.922 188 HG23 ILE 45 HG23 ILE 45 46.973 50.154 -45.404 189 HD11 ILE 45 HD11 ILE 45 46.769 50.729 -49.185 190 HD12 ILE 45 HD12 ILE 45 45.497 50.218 -50.299 191 HD13 ILE 45 HD13 ILE 45 45.100 51.307 -48.954 192 H ASN 46 H ASN 46 44.902 46.350 -44.366 193 HA ASN 46 HA ASN 46 44.146 48.044 -42.066 194 HB2 ASN 46 HB2 ASN 46 42.826 46.052 -42.756 195 HB3 ASN 46 HB3 ASN 46 44.222 45.017 -42.442 196 HD21 ASN 46 HD22 ASN 46 41.953 47.316 -40.844 197 HD22 ASN 46 HD21 ASN 46 42.093 46.550 -39.269 198 H TYR 47 H TYR 47 46.967 46.211 -43.093 199 HA TYR 47 HA TYR 47 48.023 45.982 -40.357 200 HB2 TYR 47 HB2 TYR 47 49.080 44.940 -42.999 201 HB3 TYR 47 HB3 TYR 47 49.773 44.612 -41.419 202 HD1 TYR 47 HD2 TYR 47 48.424 43.358 -39.677 203 HD2 TYR 47 HD1 TYR 47 47.194 43.655 -43.806 204 HE1 TYR 47 HE2 TYR 47 46.880 41.423 -39.363 205 HE2 TYR 47 HE1 TYR 47 45.652 41.730 -43.486 206 HH TYR 47 HH TYR 47 44.834 40.148 -42.020 207 H MET 48 H MET 48 49.561 47.114 -39.469 208 HA MET 48 HA MET 48 51.698 48.392 -41.008 209 HB2 MET 48 HB2 MET 48 49.766 50.086 -40.775 210 HB3 MET 48 HB3 MET 48 50.092 50.094 -39.051 211 HG2 MET 48 HG2 MET 48 51.144 51.986 -40.198 212 HG3 MET 48 HG3 MET 48 52.354 50.959 -39.456 213 HE1 MET 48 HE1 MET 48 50.719 52.224 -42.778 214 HE2 MET 48 HE2 MET 48 51.600 51.322 -44.029 215 HE3 MET 48 HE3 MET 48 50.444 50.477 -42.981 216 H THR 49 H THR 49 51.604 46.116 -39.412 217 HA THR 49 HA THR 49 52.719 46.795 -36.721 218 HB THR 49 HB THR 49 51.052 44.976 -35.940 219 HG1 THR 49 HG1 THR 49 49.227 44.775 -37.203 220 HG21 THR 49 HG21 THR 49 49.945 47.656 -36.873 221 HG22 THR 49 HG22 THR 49 49.286 46.610 -35.598 222 HG23 THR 49 HG23 THR 49 50.862 47.383 -35.375 223 HA PRO 50 HA PRO 50 55.186 43.228 -38.434 224 HB2 PRO 50 HB2 PRO 50 57.680 44.265 -37.982 225 HB3 PRO 50 HB3 PRO 50 56.737 44.603 -39.465 226 HG2 PRO 50 HG2 PRO 50 56.937 46.306 -36.956 227 HG3 PRO 50 HG3 PRO 50 57.160 46.821 -38.660 228 HD2 PRO 50 HD2 PRO 50 54.797 47.152 -37.368 229 HD3 PRO 50 HD3 PRO 50 54.841 46.695 -39.096 230 HA PRO 51 HA PRO 51 55.715 41.686 -34.308 231 HB2 PRO 51 HB2 PRO 51 57.621 39.737 -34.546 232 HB3 PRO 51 HB3 PRO 51 55.985 39.603 -35.259 233 HG2 PRO 51 HG2 PRO 51 58.540 40.512 -36.628 234 HG3 PRO 51 HG3 PRO 51 57.356 39.290 -37.196 235 HD2 PRO 51 HD2 PRO 51 57.282 41.861 -38.073 236 HD3 PRO 51 HD3 PRO 51 55.773 40.952 -37.762 237 H GLU 52 H GLU 52 56.918 41.816 -32.430 238 HA GLU 52 HA GLU 52 59.539 43.272 -32.513 239 HB2 GLU 52 HB2 GLU 52 57.154 43.730 -30.687 240 HB3 GLU 52 HB3 GLU 52 58.721 44.494 -30.472 241 HG2 GLU 52 HG2 GLU 52 56.888 44.857 -32.871 242 HG3 GLU 52 HG3 GLU 52 57.105 45.987 -31.544 243 H GLN 53 H GLN 53 58.899 40.344 -32.171 244 HA GLN 53 HA GLN 53 60.494 39.864 -29.703 245 HB2 GLN 53 HB2 GLN 53 57.934 38.419 -30.504 246 HB3 GLN 53 HB3 GLN 53 59.038 37.843 -29.261 247 HG2 GLN 53 HG2 GLN 53 57.576 40.518 -29.117 248 HG3 GLN 53 HG3 GLN 53 57.007 39.021 -28.398 249 HE21 GLN 53 HE22 GLN 53 59.620 41.476 -28.206 250 HE22 GLN 53 HE21 GLN 53 60.076 41.038 -26.557 251 H GLU 54 H GLU 54 61.622 37.870 -29.657 252 HA GLU 54 HA GLU 54 62.320 36.818 -32.369 253 HB2 GLU 54 HB2 GLU 54 63.909 38.396 -31.126 254 HB3 GLU 54 HB3 GLU 54 64.217 37.054 -30.026 255 HG2 GLU 54 HG2 GLU 54 64.950 35.678 -32.031 256 HG3 GLU 54 HG3 GLU 54 64.632 37.071 -33.057 257 H ALA 55 H ALA 55 60.255 35.663 -30.957 258 HA ALA 55 HA ALA 55 59.401 33.707 -30.196 259 HB1 ALA 55 HB1 ALA 55 61.582 32.592 -31.991 260 HB2 ALA 55 HB2 ALA 55 60.058 31.792 -31.550 261 HB3 ALA 55 HB3 ALA 55 60.030 33.268 -32.532 262 H GLN 56 H GLN 56 60.951 34.701 -28.173 263 HA GLN 56 HA GLN 56 61.714 32.257 -26.718 264 HB2 GLN 56 HB2 GLN 56 63.919 33.079 -26.066 265 HB3 GLN 56 HB3 GLN 56 63.773 32.855 -27.801 266 HG2 GLN 56 HG2 GLN 56 63.315 35.424 -27.923 267 HG3 GLN 56 HG3 GLN 56 63.921 35.475 -26.269 268 HE21 GLN 56 HE22 GLN 56 64.759 34.615 -29.632 269 HE22 GLN 56 HE21 GLN 56 66.490 34.860 -29.411 270 HA PRO 57 HA PRO 57 59.582 35.777 -24.397 271 HB2 PRO 57 HB2 PRO 57 57.064 34.869 -24.059 272 HB3 PRO 57 HB3 PRO 57 57.629 35.534 -25.633 273 HG2 PRO 57 HG2 PRO 57 57.529 32.600 -24.819 274 HG3 PRO 57 HG3 PRO 57 56.785 33.366 -26.262 275 HD2 PRO 57 HD2 PRO 57 59.249 32.221 -26.390 276 HD3 PRO 57 HD3 PRO 57 58.868 33.730 -27.274 277 H GLY 58 H GLY 58 58.888 35.863 -22.155 278 HA2 GLY 58 HA2 GLY 58 58.901 35.241 -19.937 279 HA3 GLY 58 HA3 GLY 58 58.724 33.559 -20.441 280 H ALA 59 H ALA 59 61.484 35.560 -21.430 281 HA ALA 59 HA ALA 59 63.391 33.632 -20.657 282 HB1 ALA 59 HB1 ALA 59 63.750 36.560 -21.413 283 HB2 ALA 59 HB2 ALA 59 65.029 35.327 -21.373 284 HB3 ALA 59 HB3 ALA 59 63.694 35.175 -22.530 285 H LEU 60 H LEU 60 64.129 33.151 -18.813 286 HA LEU 60 HA LEU 60 64.752 35.120 -16.657 287 HB2 LEU 60 HB2 LEU 60 63.356 32.417 -16.421 288 HB3 LEU 60 HB3 LEU 60 64.020 33.281 -15.046 289 HG LEU 60 HG LEU 60 61.786 34.357 -16.825 290 HD11 LEU 60 HD11 LEU 60 61.692 33.126 -14.040 291 HD12 LEU 60 HD12 LEU 60 60.322 33.843 -14.922 292 HD13 LEU 60 HD13 LEU 60 61.095 32.374 -15.538 293 HD21 LEU 60 HD21 LEU 60 63.028 36.184 -15.734 294 HD22 LEU 60 HD22 LEU 60 61.452 35.977 -14.973 295 HD23 LEU 60 HD23 LEU 60 62.907 35.354 -14.165 296 H ALA 61 H ALA 61 66.275 34.096 -14.999 297 HA ALA 61 HA ALA 61 68.151 32.187 -16.252 298 HB1 ALA 61 HB1 ALA 61 68.892 34.761 -14.814 299 HB2 ALA 61 HB2 ALA 61 70.037 33.519 -15.357 300 HB3 ALA 61 HB3 ALA 61 69.084 34.423 -16.548 301 H ALA 62 H ALA 62 69.103 30.710 -14.989 302 HA ALA 62 HA ALA 62 68.443 30.561 -12.090 303 HB1 ALA 62 HB1 ALA 62 69.819 28.568 -13.932 304 HB2 ALA 62 HB2 ALA 62 69.415 28.308 -12.224 305 HB3 ALA 62 HB3 ALA 62 68.118 28.516 -13.417 306 H LEU 63 H LEU 63 70.162 30.265 -10.552 307 HA LEU 63 HA LEU 63 72.786 31.488 -11.286 308 HB2 LEU 63 HB2 LEU 63 71.049 32.191 -8.886 309 HB3 LEU 63 HB3 LEU 63 72.667 32.809 -9.192 310 HG LEU 63 HG LEU 63 70.217 33.381 -10.919 311 HD11 LEU 63 HD11 LEU 63 71.757 35.132 -8.955 312 HD12 LEU 63 HD12 LEU 63 70.379 35.637 -9.960 313 HD13 LEU 63 HD13 LEU 63 70.144 34.434 -8.683 314 HD21 LEU 63 HD21 LEU 63 72.268 33.513 -12.276 315 HD22 LEU 63 HD22 LEU 63 71.661 35.133 -11.923 316 HD23 LEU 63 HD23 LEU 63 73.055 34.494 -11.028 317 H HIS 64 H HIS 64 74.507 31.077 -9.833 318 HA HIS 64 HA HIS 64 74.333 28.625 -8.159 319 HB2 HIS 64 HB2 HIS 64 76.553 30.534 -8.899 320 HB3 HIS 64 HB3 HIS 64 76.765 29.257 -7.707 321 HD2 HIS 64 HD2 HIS 64 77.117 29.934 -11.336 322 HE1 HIS 64 HE1 HIS 64 77.055 25.675 -11.031 323 HE2 HIS 64 HE2 HIS 64 77.609 27.644 -12.543 324 H ALA 65 H ALA 65 74.203 28.669 -5.931 325 HA ALA 65 HA ALA 65 73.506 31.274 -4.716 326 HB1 ALA 65 HB1 ALA 65 73.173 28.419 -3.718 327 HB2 ALA 65 HB2 ALA 65 72.477 29.882 -2.989 328 HB3 ALA 65 HB3 ALA 65 71.953 29.367 -4.603 329 H GLU 66 H GLU 66 76.211 29.085 -4.615 330 HA GLU 66 HA GLU 66 77.388 30.454 -2.236 331 HB2 GLU 66 HB2 GLU 66 77.115 27.442 -2.632 332 HB3 GLU 66 HB3 GLU 66 78.101 28.217 -1.391 333 HG2 GLU 66 HG2 GLU 66 76.045 29.311 -0.471 334 HG3 GLU 66 HG3 GLU 66 75.072 28.399 -1.631 335 H GLY 67 H GLY 67 79.706 29.928 -1.926 336 HA2 GLY 67 HA2 GLY 67 81.887 29.619 -2.632 337 HA3 GLY 67 HA3 GLY 67 81.271 28.760 -4.039 338 HA PRO 68 HA PRO 68 83.295 32.761 -5.318 339 HB2 PRO 68 HB2 PRO 68 84.719 31.826 -7.473 340 HB3 PRO 68 HB3 PRO 68 85.269 31.673 -5.777 341 HG2 PRO 68 HG2 PRO 68 83.799 29.603 -7.445 342 HG3 PRO 68 HG3 PRO 68 85.299 29.386 -6.484 343 HD2 PRO 68 HD2 PRO 68 82.888 28.699 -5.483 344 HD3 PRO 68 HD3 PRO 68 84.108 29.484 -4.435 345 H LEU 69 H LEU 69 81.175 30.562 -7.002 346 HA LEU 69 HA LEU 69 80.536 32.558 -9.099 347 HB2 LEU 69 HB2 LEU 69 79.584 29.705 -8.718 348 HB3 LEU 69 HB3 LEU 69 79.121 30.757 -10.048 349 HG LEU 69 HG LEU 69 81.949 29.775 -9.514 350 HD11 LEU 69 HD11 LEU 69 79.956 29.040 -11.691 351 HD12 LEU 69 HD12 LEU 69 81.598 28.390 -11.486 352 HD13 LEU 69 HD13 LEU 69 80.352 28.031 -10.281 353 HD21 LEU 69 HD21 LEU 69 82.068 31.927 -10.654 354 HD22 LEU 69 HD22 LEU 69 82.411 30.643 -11.813 355 HD23 LEU 69 HD23 LEU 69 80.815 31.420 -11.821 356 H ALA 70 H ALA 70 79.568 32.427 -5.948 357 HA ALA 70 HA ALA 70 76.786 32.258 -6.055 358 HB1 ALA 70 HB1 ALA 70 78.509 34.042 -4.278 359 HB2 ALA 70 HB2 ALA 70 76.818 33.588 -3.969 360 HB3 ALA 70 HB3 ALA 70 78.083 32.345 -3.967 361 H GLY 71 H GLY 71 75.277 33.329 -7.004 362 HA2 GLY 71 HA2 GLY 71 73.981 35.109 -7.800 363 HA3 GLY 71 HA3 GLY 71 75.300 36.239 -7.502 364 H LEU 72 H LEU 72 76.501 33.591 -9.273 365 HA LEU 72 HA LEU 72 76.343 35.078 -11.850 366 HB2 LEU 72 HB2 LEU 72 78.360 32.986 -10.951 367 HB3 LEU 72 HB3 LEU 72 78.457 33.938 -12.381 368 HG LEU 72 HG LEU 72 78.842 34.912 -9.550 369 HD11 LEU 72 HD11 LEU 72 80.579 35.120 -12.048 370 HD12 LEU 72 HD12 LEU 72 81.029 35.552 -10.385 371 HD13 LEU 72 HD13 LEU 72 80.743 33.862 -10.817 372 HD21 LEU 72 HD21 LEU 72 77.553 36.700 -10.641 373 HD22 LEU 72 HD22 LEU 72 79.242 37.177 -10.495 374 HD23 LEU 72 HD23 LEU 72 78.611 36.632 -12.062 375 HA PRO 73 HA PRO 73 73.785 32.246 -13.804 376 HB2 PRO 73 HB2 PRO 73 74.794 31.868 -16.347 377 HB3 PRO 73 HB3 PRO 73 74.128 33.426 -15.771 378 HG2 PRO 73 HG2 PRO 73 77.002 32.509 -15.948 379 HG3 PRO 73 HG3 PRO 73 76.313 34.088 -16.434 380 HD2 PRO 73 HD2 PRO 73 77.584 33.657 -14.111 381 HD3 PRO 73 HD3 PRO 73 76.259 34.853 -14.229 382 H VAL 74 H VAL 74 73.346 30.062 -14.764 383 HA VAL 74 HA VAL 74 75.522 28.104 -14.140 384 HB VAL 74 HB VAL 74 72.566 27.512 -14.336 385 HG11 VAL 74 HG11 VAL 74 74.912 25.958 -13.172 386 HG12 VAL 74 HG12 VAL 74 73.203 25.490 -13.060 387 HG13 VAL 74 HG13 VAL 74 73.991 25.539 -14.635 388 HG21 VAL 74 HG21 VAL 74 72.894 29.051 -12.448 389 HG22 VAL 74 HG22 VAL 74 72.608 27.419 -11.850 390 HG23 VAL 74 HG23 VAL 74 74.258 28.077 -11.862 391 H THR 75 H THR 75 73.275 29.095 -16.724 392 HA THR 75 HA THR 75 74.761 27.327 -18.638 393 HB THR 75 HB THR 75 72.781 27.073 -19.912 394 HG1 THR 75 HG1 THR 75 70.810 28.089 -19.000 395 HG21 THR 75 HG21 THR 75 71.917 26.775 -17.020 396 HG22 THR 75 HG22 THR 75 71.365 25.849 -18.436 397 HG23 THR 75 HG23 THR 75 73.034 25.670 -17.853 398 H ARG 76 H ARG 76 74.563 28.007 -20.993 399 HA ARG 76 HA ARG 76 75.613 30.663 -21.383 400 HB2 ARG 76 HB2 ARG 76 75.547 30.201 -23.737 401 HB3 ARG 76 HB3 ARG 76 76.117 28.772 -22.885 402 HG2 ARG 76 HG2 ARG 76 73.821 27.754 -23.129 403 HG3 ARG 76 HG3 ARG 76 73.321 29.184 -24.048 404 HD2 ARG 76 HD2 ARG 76 75.085 28.730 -25.722 405 HD3 ARG 76 HD3 ARG 76 75.567 27.282 -24.844 406 HE ARG 76 HE ARG 76 73.122 27.710 -26.461 407 HH11 ARG 76 HH11 ARG 76 74.753 25.440 -24.325 408 HH12 ARG 76 HH12 ARG 76 73.721 24.124 -24.806 409 HH21 ARG 76 HH21 ARG 76 71.862 25.987 -27.022 410 HH22 ARG 76 HH22 ARG 76 72.133 24.428 -26.299 411 H SER 77 H SER 77 72.320 29.390 -21.641 412 HA SER 77 HA SER 77 71.067 31.804 -22.563 413 HB2 SER 77 HB2 SER 77 69.912 29.584 -20.829 414 HB3 SER 77 HB3 SER 77 68.998 30.801 -21.741 415 HG SER 77 HG SER 77 69.189 28.807 -22.901 416 H ASP 78 H ASP 78 71.700 30.533 -19.211 417 HA ASP 78 HA ASP 78 70.549 32.767 -17.846 418 HB2 ASP 78 HB2 ASP 78 72.931 31.073 -17.053 419 HB3 ASP 78 HB3 ASP 78 72.050 32.159 -15.983 420 H ALA 79 H ALA 79 73.957 32.242 -18.956 421 HA ALA 79 HA ALA 79 74.960 34.727 -18.036 422 HB1 ALA 79 HB1 ALA 79 75.881 32.930 -20.329 423 HB2 ALA 79 HB2 ALA 79 76.833 34.239 -19.618 424 HB3 ALA 79 HB3 ALA 79 76.405 32.828 -18.629 425 H ARG 80 H ARG 80 73.538 33.970 -21.266 426 HA ARG 80 HA ARG 80 73.894 36.623 -22.321 427 HB2 ARG 80 HB2 ARG 80 73.441 34.578 -23.660 428 HB3 ARG 80 HB3 ARG 80 71.784 34.533 -23.036 429 HG2 ARG 80 HG2 ARG 80 71.286 36.695 -24.114 430 HG3 ARG 80 HG3 ARG 80 72.984 36.883 -24.576 431 HD2 ARG 80 HD2 ARG 80 71.740 36.172 -26.521 432 HD3 ARG 80 HD3 ARG 80 72.822 34.882 -26.025 433 HE ARG 80 HE ARG 80 71.015 33.538 -25.383 434 HH11 ARG 80 HH11 ARG 80 69.705 36.644 -26.451 435 HH12 ARG 80 HH12 ARG 80 68.101 35.947 -26.622 436 HH21 ARG 80 HH21 ARG 80 68.893 32.825 -25.615 437 HH22 ARG 80 HH22 ARG 80 67.686 33.967 -26.181 438 H VAL 81 H VAL 81 71.135 35.200 -20.526 439 HA VAL 81 HA VAL 81 69.455 37.538 -20.604 440 HB VAL 81 HB VAL 81 69.630 35.224 -18.643 441 HG11 VAL 81 HG11 VAL 81 67.536 37.446 -18.762 442 HG12 VAL 81 HG12 VAL 81 67.346 35.919 -17.875 443 HG13 VAL 81 HG13 VAL 81 68.596 37.061 -17.386 444 HG21 VAL 81 HG21 VAL 81 68.880 34.777 -20.994 445 HG22 VAL 81 HG22 VAL 81 67.635 34.453 -19.780 446 HG23 VAL 81 HG23 VAL 81 67.564 35.939 -20.764 447 H LEU 82 H LEU 82 71.783 36.459 -18.058 448 HA LEU 82 HA LEU 82 71.567 38.782 -16.452 449 HB2 LEU 82 HB2 LEU 82 73.603 36.602 -16.829 450 HB3 LEU 82 HB3 LEU 82 74.168 38.088 -16.077 451 HG LEU 82 HG LEU 82 72.448 37.984 -14.363 452 HD11 LEU 82 HD11 LEU 82 71.661 35.293 -15.533 453 HD12 LEU 82 HD12 LEU 82 71.081 35.985 -14.006 454 HD13 LEU 82 HD13 LEU 82 70.644 36.755 -15.530 455 HD21 LEU 82 HD21 LEU 82 74.675 36.860 -14.100 456 HD22 LEU 82 HD22 LEU 82 73.398 36.100 -13.139 457 HD23 LEU 82 HD23 LEU 82 73.919 35.349 -14.664 458 H ILE 83 H ILE 83 73.917 38.254 -19.158 459 HA ILE 83 HA ILE 83 75.160 40.810 -18.995 460 HB ILE 83 HB ILE 83 74.686 38.907 -21.308 461 HG12 ILE 83 HG12 ILE 83 77.263 39.783 -19.919 462 HG13 ILE 83 HG13 ILE 83 76.302 38.420 -19.363 463 HG21 ILE 83 HG21 ILE 83 76.235 41.543 -21.431 464 HG22 ILE 83 HG22 ILE 83 76.276 40.276 -22.671 465 HG23 ILE 83 HG23 ILE 83 74.785 41.141 -22.370 466 HD11 ILE 83 HD11 ILE 83 77.676 38.625 -22.068 467 HD12 ILE 83 HD12 ILE 83 78.114 37.585 -20.707 468 HD13 ILE 83 HD13 ILE 83 76.590 37.304 -21.570 469 H PHE 84 H PHE 84 72.276 39.868 -20.957 470 HA PHE 84 HA PHE 84 71.876 42.483 -21.964 471 HB2 PHE 84 HB2 PHE 84 70.958 40.261 -22.830 472 HB3 PHE 84 HB3 PHE 84 69.733 40.365 -21.581 473 HD1 PHE 84 HD1 PHE 84 71.255 42.798 -24.071 474 HD2 PHE 84 HD2 PHE 84 67.649 41.031 -22.485 475 HE1 PHE 84 HE1 PHE 84 69.949 43.981 -25.768 476 HE2 PHE 84 HE2 PHE 84 66.315 42.309 -24.145 477 HZ PHE 84 HZ PHE 84 67.452 43.774 -25.804 478 H ASN 85 H ASN 85 70.214 40.898 -19.151 479 HA ASN 85 HA ASN 85 68.540 43.162 -18.657 480 HB2 ASN 85 HB2 ASN 85 68.011 40.891 -17.849 481 HB3 ASN 85 HB3 ASN 85 69.403 40.933 -16.757 482 HD21 ASN 85 HD22 ASN 85 69.293 42.330 -14.854 483 HD22 ASN 85 HD21 ASN 85 67.854 43.261 -14.489 484 H GLU 86 H GLU 86 71.708 42.223 -17.146 485 HA GLU 86 HA GLU 86 71.776 44.505 -15.371 486 HB2 GLU 86 HB2 GLU 86 73.983 42.751 -16.522 487 HB3 GLU 86 HB3 GLU 86 74.318 44.140 -15.508 488 HG2 GLU 86 HG2 GLU 86 72.589 41.787 -14.657 489 HG3 GLU 86 HG3 GLU 86 74.283 42.018 -14.229 490 H TRP 87 H TRP 87 73.169 44.037 -18.736 491 HA TRP 87 HA TRP 87 74.163 46.687 -18.891 492 HB2 TRP 87 HB2 TRP 87 74.789 45.060 -20.525 493 HB3 TRP 87 HB3 TRP 87 73.114 44.795 -20.992 494 HD1 TRP 87 HD1 TRP 87 75.769 47.604 -21.227 495 HE1 TRP 87 HE1 TRP 87 75.366 48.866 -23.422 496 HE3 TRP 87 HE3 TRP 87 71.438 45.311 -22.685 497 HZ2 TRP 87 HZ2 TRP 87 73.492 48.785 -25.600 498 HZ3 TRP 87 HZ3 TRP 87 70.466 45.822 -24.868 499 HH2 TRP 87 HH2 TRP 87 71.440 47.572 -26.348 500 H GLU 88 H GLU 88 70.823 45.511 -19.818 501 HA GLU 88 HA GLU 88 69.895 48.025 -20.703 502 HB2 GLU 88 HB2 GLU 88 68.491 45.636 -19.462 503 HB3 GLU 88 HB3 GLU 88 67.629 47.105 -19.898 504 HG2 GLU 88 HG2 GLU 88 68.488 46.923 -22.232 505 HG3 GLU 88 HG3 GLU 88 69.152 45.340 -21.842 506 H GLU 89 H GLU 89 69.712 46.744 -17.288 507 HA GLU 89 HA GLU 89 68.411 49.165 -16.339 508 HB2 GLU 89 HB2 GLU 89 69.926 46.975 -14.857 509 HB3 GLU 89 HB3 GLU 89 69.073 48.314 -14.078 510 HG2 GLU 89 HG2 GLU 89 66.964 47.603 -15.240 511 HG3 GLU 89 HG3 GLU 89 67.821 46.200 -15.875 512 H ARG 90 H ARG 90 71.812 48.078 -16.206 513 HA ARG 90 HA ARG 90 72.874 50.395 -14.845 514 HB2 ARG 90 HB2 ARG 90 74.220 48.544 -16.848 515 HB3 ARG 90 HB3 ARG 90 75.068 49.633 -15.746 516 HG2 ARG 90 HG2 ARG 90 73.220 47.456 -14.747 517 HG3 ARG 90 HG3 ARG 90 74.886 47.112 -15.204 518 HD2 ARG 90 HD2 ARG 90 75.677 48.646 -13.445 519 HD3 ARG 90 HD3 ARG 90 73.990 49.048 -13.031 520 HE ARG 90 HE ARG 90 74.237 46.212 -12.959 521 HH11 ARG 90 HH11 ARG 90 75.466 48.859 -10.994 522 HH12 ARG 90 HH12 ARG 90 75.565 47.835 -9.586 523 HH21 ARG 90 HH21 ARG 90 74.362 45.058 -11.300 524 HH22 ARG 90 HH22 ARG 90 74.940 45.655 -9.738 525 H LYS 91 H LYS 91 72.438 49.657 -18.281 526 HA LYS 91 HA LYS 91 73.464 52.200 -19.198 527 HB2 LYS 91 HB2 LYS 91 73.401 50.128 -20.585 528 HB3 LYS 91 HB3 LYS 91 71.651 50.236 -20.688 529 HG2 LYS 91 HG2 LYS 91 73.236 52.606 -21.640 530 HG3 LYS 91 HG3 LYS 91 73.357 51.120 -22.575 531 HD2 LYS 91 HD2 LYS 91 70.936 51.023 -22.901 532 HD3 LYS 91 HD3 LYS 91 70.698 52.422 -21.859 533 HE2 LYS 91 HE2 LYS 91 70.481 53.141 -24.130 534 HE3 LYS 91 HE3 LYS 91 71.931 53.865 -23.450 535 HZ1 LYS 91 HZ1 LYS 91 71.909 51.470 -25.236 536 HZ2 LYS 91 HZ2 LYS 91 72.292 52.986 -25.701 537 HZ3 LYS 91 HZ3 LYS 91 73.265 52.206 -24.657 538 H LYS 92 H LYS 92 70.121 51.235 -18.317 539 HA LYS 92 HA LYS 92 68.973 53.797 -19.064 540 HB2 LYS 92 HB2 LYS 92 68.207 51.698 -17.006 541 HB3 LYS 92 HB3 LYS 92 67.340 53.219 -17.120 542 HG2 LYS 92 HG2 LYS 92 67.674 51.348 -19.500 543 HG3 LYS 92 HG3 LYS 92 66.334 51.254 -18.353 544 HD2 LYS 92 HD2 LYS 92 65.697 53.612 -18.925 545 HD3 LYS 92 HD3 LYS 92 67.028 53.672 -20.080 546 HE2 LYS 92 HE2 LYS 92 65.101 53.246 -21.365 547 HE3 LYS 92 HE3 LYS 92 66.010 51.736 -21.321 548 HZ1 LYS 92 HZ1 LYS 92 63.635 52.356 -19.619 549 HZ2 LYS 92 HZ2 LYS 92 63.616 51.398 -20.935 550 HZ3 LYS 92 HZ3 LYS 92 64.441 50.929 -19.610 551 H SER 93 H SER 93 70.842 52.792 -16.172 552 HA SER 93 HA SER 93 70.850 55.558 -15.169 553 HB2 SER 93 HB2 SER 93 72.639 53.220 -14.447 554 HB3 SER 93 HB3 SER 93 72.603 54.793 -13.636 555 HG SER 93 HG SER 93 71.257 53.249 -12.572 556 H GLU 94 H GLU 94 72.896 53.825 -17.437 557 HA GLU 94 HA GLU 94 74.780 56.131 -17.736 558 HB2 GLU 94 HB2 GLU 94 75.455 53.157 -17.685 559 HB3 GLU 94 HB3 GLU 94 76.572 54.494 -17.916 560 HG2 GLU 94 HG2 GLU 94 75.932 55.319 -15.611 561 HG3 GLU 94 HG3 GLU 94 74.985 53.835 -15.423 562 HA PRO 95 HA PRO 95 72.683 54.853 -21.659 563 HB2 PRO 95 HB2 PRO 95 72.852 57.299 -23.029 564 HB3 PRO 95 HB3 PRO 95 71.540 56.763 -21.939 565 HG2 PRO 95 HG2 PRO 95 73.952 58.468 -21.269 566 HG3 PRO 95 HG3 PRO 95 72.238 58.736 -20.813 567 HD2 PRO 95 HD2 PRO 95 73.937 57.638 -19.053 568 HD3 PRO 95 HD3 PRO 95 72.297 56.950 -19.228 569 H TRP 96 H TRP 96 75.924 55.815 -21.284 570 HA TRP 96 HA TRP 96 76.808 55.380 -24.054 571 HB2 TRP 96 HB2 TRP 96 79.036 55.865 -23.021 572 HB3 TRP 96 HB3 TRP 96 77.840 57.128 -22.802 573 HD1 TRP 96 HD1 TRP 96 79.725 54.446 -20.817 574 HE1 TRP 96 HE1 TRP 96 79.585 54.966 -18.304 575 HE3 TRP 96 HE3 TRP 96 76.459 58.393 -20.984 576 HZ2 TRP 96 HZ2 TRP 96 78.199 56.822 -16.586 577 HZ3 TRP 96 HZ3 TRP 96 75.732 59.507 -18.884 578 HH2 TRP 96 HH2 TRP 96 76.585 58.728 -16.685 579 H LEU 97 H LEU 97 76.075 53.196 -21.491 580 HA LEU 97 HA LEU 97 78.345 51.674 -21.314 581 HB2 LEU 97 HB2 LEU 97 76.174 51.727 -19.901 582 HB3 LEU 97 HB3 LEU 97 75.521 50.603 -21.069 583 HG LEU 97 HG LEU 97 77.337 49.027 -20.512 584 HD11 LEU 97 HD11 LEU 97 78.049 51.042 -18.341 585 HD12 LEU 97 HD12 LEU 97 78.630 49.366 -18.397 586 HD13 LEU 97 HD13 LEU 97 79.110 50.496 -19.659 587 HD21 LEU 97 HD21 LEU 97 75.123 48.950 -19.358 588 HD22 LEU 97 HD22 LEU 97 76.433 48.387 -18.302 589 HD23 LEU 97 HD23 LEU 97 75.770 50.028 -18.104 590 H ARG 98 H ARG 98 79.241 49.906 -22.236 591 HA ARG 98 HA ARG 98 78.415 49.114 -24.949 592 HB2 ARG 98 HB2 ARG 98 80.750 48.203 -23.224 593 HB3 ARG 98 HB3 ARG 98 80.546 47.868 -24.936 594 HG2 ARG 98 HG2 ARG 98 81.005 50.613 -23.679 595 HG3 ARG 98 HG3 ARG 98 82.194 49.658 -24.546 596 HD2 ARG 98 HD2 ARG 98 79.651 50.813 -25.761 597 HD3 ARG 98 HD3 ARG 98 81.270 51.508 -25.894 598 HE ARG 98 HE ARG 98 81.537 48.882 -26.818 599 HH11 ARG 98 HH11 ARG 98 79.806 51.737 -27.880 600 HH12 ARG 98 HH12 ARG 98 79.851 51.254 -29.554 601 HH21 ARG 98 HH21 ARG 98 81.537 48.311 -28.967 602 HH22 ARG 98 HH22 ARG 98 80.815 49.363 -30.147 603 H LEU 99 H LEU 99 78.204 46.983 -25.671 604 HA LEU 99 HA LEU 99 77.233 44.925 -23.747 605 HB2 LEU 99 HB2 LEU 99 75.434 46.365 -24.567 606 HB3 LEU 99 HB3 LEU 99 75.828 46.039 -26.221 607 HG LEU 99 HG LEU 99 73.771 44.941 -25.326 608 HD11 LEU 99 HD11 LEU 99 75.720 42.790 -26.174 609 HD12 LEU 99 HD12 LEU 99 74.012 43.014 -26.620 610 HD13 LEU 99 HD13 LEU 99 75.226 44.085 -27.280 611 HD21 LEU 99 HD21 LEU 99 74.849 44.438 -23.059 612 HD22 LEU 99 HD22 LEU 99 73.626 43.387 -23.741 613 HD23 LEU 99 HD23 LEU 99 75.367 42.926 -23.825 614 H ASP 100 H ASP 100 78.063 42.922 -24.251 615 HA ASP 100 HA ASP 100 78.728 42.240 -27.054 616 HB2 ASP 100 HB2 ASP 100 80.790 43.177 -25.992 617 HB3 ASP 100 HB3 ASP 100 80.713 41.904 -24.776 618 H MET 101 H MET 101 78.087 40.257 -27.552 619 HA MET 101 HA MET 101 77.532 38.239 -25.416 620 HB2 MET 101 HB2 MET 101 75.782 38.899 -27.815 621 HB3 MET 101 HB3 MET 101 75.512 37.567 -26.682 622 HG2 MET 101 HG2 MET 101 75.251 39.153 -24.823 623 HG3 MET 101 HG3 MET 101 75.531 40.510 -25.923 624 HE1 MET 101 HE1 MET 101 73.211 41.758 -25.202 625 HE2 MET 101 HE2 MET 101 71.722 40.805 -25.059 626 HE3 MET 101 HE3 MET 101 73.107 40.431 -24.014 627 H SER 102 H SER 102 79.740 38.751 -27.629 628 HA SER 102 HA SER 102 79.783 36.376 -29.268 629 HB2 SER 102 HB2 SER 102 81.237 38.329 -29.655 630 HB3 SER 102 HB3 SER 102 82.060 38.032 -28.108 631 HG SER 102 HG SER 102 83.124 37.142 -30.036 632 H ASP 103 H ASP 103 80.852 34.361 -28.884 633 HA ASP 103 HA ASP 103 80.441 33.162 -26.372 634 HB2 ASP 103 HB2 ASP 103 82.384 32.355 -28.575 635 HB3 ASP 103 HB3 ASP 103 81.874 31.329 -27.236 636 H LYS 104 H LYS 104 83.376 34.749 -27.596 637 HA LYS 104 HA LYS 104 85.172 34.051 -25.475 638 HB2 LYS 104 HB2 LYS 104 85.066 36.498 -27.295 639 HB3 LYS 104 HB3 LYS 104 86.403 36.114 -26.202 640 HG2 LYS 104 HG2 LYS 104 86.748 33.945 -27.369 641 HG3 LYS 104 HG3 LYS 104 85.456 34.362 -28.511 642 HD2 LYS 104 HD2 LYS 104 86.747 36.363 -29.245 643 HD3 LYS 104 HD3 LYS 104 87.997 35.988 -28.056 644 HE2 LYS 104 HE2 LYS 104 88.830 35.237 -30.141 645 HE3 LYS 104 HE3 LYS 104 88.419 33.799 -29.206 646 HZ1 LYS 104 HZ1 LYS 104 86.719 34.984 -31.357 647 HZ2 LYS 104 HZ2 LYS 104 87.650 33.658 -31.526 648 HZ3 LYS 104 HZ3 LYS 104 86.361 33.614 -30.531 649 H ALA 105 H ALA 105 82.695 36.612 -25.608 650 HA ALA 105 HA ALA 105 83.524 37.975 -23.193 651 HB1 ALA 105 HB1 ALA 105 80.757 37.829 -24.448 652 HB2 ALA 105 HB2 ALA 105 81.345 39.021 -23.281 653 HB3 ALA 105 HB3 ALA 105 82.035 38.973 -24.914 654 H ILE 106 H ILE 106 81.344 35.250 -23.843 655 HA ILE 106 HA ILE 106 80.496 34.974 -21.080 656 HB ILE 106 HB ILE 106 80.171 33.307 -23.588 657 HG12 ILE 106 HG12 ILE 106 77.791 33.746 -23.186 658 HG13 ILE 106 HG13 ILE 106 78.166 34.606 -21.692 659 HG21 ILE 106 HG21 ILE 106 79.277 32.515 -20.776 660 HG22 ILE 106 HG22 ILE 106 78.696 31.772 -22.283 661 HG23 ILE 106 HG23 ILE 106 80.392 31.619 -21.839 662 HD11 ILE 106 HD11 ILE 106 79.005 35.522 -24.471 663 HD12 ILE 106 HD12 ILE 106 77.575 36.097 -23.596 664 HD13 ILE 106 HD13 ILE 106 79.191 36.445 -22.961 665 H PHE 107 H PHE 107 82.877 33.157 -23.094 666 HA PHE 107 HA PHE 107 83.878 31.440 -21.090 667 HB2 PHE 107 HB2 PHE 107 85.538 32.932 -23.159 668 HB3 PHE 107 HB3 PHE 107 85.999 31.462 -22.326 669 HD1 PHE 107 HD2 PHE 107 82.984 30.238 -22.831 670 HD2 PHE 107 HD1 PHE 107 86.144 31.929 -25.228 671 HE1 PHE 107 HE2 PHE 107 82.247 28.869 -24.760 672 HE2 PHE 107 HE1 PHE 107 85.393 30.557 -27.175 673 HZ PHE 107 HZ PHE 107 83.451 29.020 -26.932 674 H ARG 108 H ARG 108 84.992 34.789 -21.811 675 HA ARG 108 HA ARG 108 87.028 34.759 -19.805 676 HB2 ARG 108 HB2 ARG 108 86.924 35.906 -22.035 677 HB3 ARG 108 HB3 ARG 108 85.830 37.107 -21.350 678 HG2 ARG 108 HG2 ARG 108 88.593 36.506 -20.217 679 HG3 ARG 108 HG3 ARG 108 88.341 37.609 -21.572 680 HD2 ARG 108 HD2 ARG 108 86.879 39.036 -20.171 681 HD3 ARG 108 HD3 ARG 108 87.205 37.985 -18.776 682 HE ARG 108 HE ARG 108 89.695 38.796 -19.873 683 HH11 ARG 108 HH11 ARG 108 87.051 40.285 -18.110 684 HH12 ARG 108 HH12 ARG 108 88.084 41.499 -17.410 685 HH21 ARG 108 HH21 ARG 108 90.951 40.372 -18.947 686 HH22 ARG 108 HH22 ARG 108 90.239 41.543 -17.878 687 H ARG 109 H ARG 109 83.725 36.154 -19.805 688 HA ARG 109 HA ARG 109 84.007 37.289 -17.122 689 HB2 ARG 109 HB2 ARG 109 82.475 38.121 -18.939 690 HB3 ARG 109 HB3 ARG 109 81.464 36.688 -18.694 691 HG2 ARG 109 HG2 ARG 109 81.066 37.355 -16.348 692 HG3 ARG 109 HG3 ARG 109 82.133 38.751 -16.533 693 HD2 ARG 109 HD2 ARG 109 79.583 38.312 -18.146 694 HD3 ARG 109 HD3 ARG 109 79.687 39.247 -16.644 695 HE ARG 109 HE ARG 109 81.533 40.052 -18.810 696 HH11 ARG 109 HH11 ARG 109 78.492 40.788 -17.228 697 HH12 ARG 109 HH12 ARG 109 78.432 42.395 -17.895 698 HH21 ARG 109 HH21 ARG 109 81.398 42.112 -19.620 699 HH22 ARG 109 HH22 ARG 109 80.039 43.115 -19.227 700 H TYR 110 H TYR 110 82.732 34.250 -18.412 701 HA TYR 110 HA TYR 110 82.255 33.200 -15.654 702 HB2 TYR 110 HB2 TYR 110 80.652 32.646 -18.165 703 HB3 TYR 110 HB3 TYR 110 80.336 32.051 -16.557 704 HD1 TYR 110 HD2 TYR 110 80.289 34.157 -14.706 705 HD2 TYR 110 HD1 TYR 110 79.201 34.288 -18.880 706 HE1 TYR 110 HE2 TYR 110 78.867 36.166 -14.289 707 HE2 TYR 110 HE1 TYR 110 77.746 36.265 -18.444 708 HH TYR 110 HH TYR 110 76.929 37.737 -16.855 709 HA PRO 111 HA PRO 111 85.453 30.703 -17.866 710 HB2 PRO 111 HB2 PRO 111 86.936 29.893 -15.691 711 HB3 PRO 111 HB3 PRO 111 87.095 31.490 -16.482 712 HG2 PRO 111 HG2 PRO 111 85.456 30.790 -14.024 713 HG3 PRO 111 HG3 PRO 111 86.617 32.144 -14.233 714 HD2 PRO 111 HD2 PRO 111 83.964 32.528 -14.537 715 HD3 PRO 111 HD3 PRO 111 85.120 33.323 -15.650 716 H HIS 112 H HIS 112 83.201 29.701 -15.364 717 HA HIS 112 HA HIS 112 83.637 26.837 -15.649 718 HB2 HIS 112 HB2 HIS 112 81.741 26.619 -14.265 719 HB3 HIS 112 HB3 HIS 112 82.620 28.012 -13.657 720 HD2 HIS 112 HD2 HIS 112 79.252 26.997 -14.060 721 HE1 HIS 112 HE1 HIS 112 78.913 31.067 -15.238 722 HE2 HIS 112 HE2 HIS 112 77.653 29.106 -14.391 723 H LEU 113 H LEU 113 81.924 29.239 -17.517 724 HA LEU 113 HA LEU 113 80.234 27.338 -18.915 725 HB2 LEU 113 HB2 LEU 113 80.127 30.054 -18.098 726 HB3 LEU 113 HB3 LEU 113 80.320 30.144 -19.827 727 HG LEU 113 HG LEU 113 78.004 30.246 -19.093 728 HD11 LEU 113 HD11 LEU 113 78.606 27.638 -20.563 729 HD12 LEU 113 HD12 LEU 113 77.077 28.515 -20.608 730 HD13 LEU 113 HD13 LEU 113 78.531 29.250 -21.304 731 HD21 LEU 113 HD21 LEU 113 78.222 28.783 -17.084 732 HD22 LEU 113 HD22 LEU 113 76.811 28.449 -18.083 733 HD23 LEU 113 HD23 LEU 113 78.207 27.361 -18.140 734 H ARG 114 H ARG 114 83.425 28.047 -19.281 735 HA ARG 114 HA ARG 114 83.564 28.056 -22.217 736 HB2 ARG 114 HB2 ARG 114 85.225 29.178 -20.655 737 HB3 ARG 114 HB3 ARG 114 85.828 27.580 -20.240 738 HG2 ARG 114 HG2 ARG 114 85.694 28.347 -23.172 739 HG3 ARG 114 HG3 ARG 114 86.866 29.165 -22.152 740 HD2 ARG 114 HD2 ARG 114 88.025 27.397 -23.169 741 HD3 ARG 114 HD3 ARG 114 87.811 26.953 -21.466 742 HE ARG 114 HE ARG 114 85.643 25.869 -22.944 743 HH11 ARG 114 HH11 ARG 114 89.095 25.251 -22.721 744 HH12 ARG 114 HH12 ARG 114 88.886 23.567 -23.121 745 HH21 ARG 114 HH21 ARG 114 85.449 23.815 -23.395 746 HH22 ARG 114 HH22 ARG 114 86.836 22.760 -23.520 Start of MODEL 8 1 H1 MET 1 H1 MET 1 148.036 51.897 -10.584 2 H2 MET 1 H2 MET 1 149.647 51.860 -10.309 3 H3 MET 1 H3 MET 1 148.607 51.461 -9.113 4 HA MET 1 HA MET 1 149.629 49.477 -10.014 5 HB2 MET 1 HB2 MET 1 147.303 49.377 -9.113 6 HB3 MET 1 HB3 MET 1 146.665 49.661 -10.734 7 HG2 MET 1 HG2 MET 1 147.676 47.543 -11.508 8 HG3 MET 1 HG3 MET 1 148.393 47.289 -9.910 9 HE1 MET 1 HE1 MET 1 147.390 44.839 -9.890 10 HE2 MET 1 HE2 MET 1 145.674 44.473 -10.168 11 HE3 MET 1 HE3 MET 1 146.667 45.123 -11.491 12 H ARG 2 H ARG 2 150.403 48.330 -11.773 13 HA ARG 2 HA ARG 2 150.298 49.690 -14.401 14 HB2 ARG 2 HB2 ARG 2 152.198 48.389 -15.002 15 HB3 ARG 2 HB3 ARG 2 152.468 49.081 -13.410 16 HG2 ARG 2 HG2 ARG 2 151.924 46.895 -12.353 17 HG3 ARG 2 HG3 ARG 2 151.639 46.180 -13.945 18 HD2 ARG 2 HD2 ARG 2 154.271 47.413 -13.038 19 HD3 ARG 2 HD3 ARG 2 153.891 45.684 -12.965 20 HE ARG 2 HE ARG 2 153.414 46.346 -15.614 21 HH11 ARG 2 HH11 ARG 2 156.250 46.494 -13.558 22 HH12 ARG 2 HH12 ARG 2 157.347 46.317 -14.901 23 HH21 ARG 2 HH21 ARG 2 154.869 46.143 -17.284 24 HH22 ARG 2 HH22 ARG 2 156.575 46.114 -16.954 25 H GLY 3 H GLY 3 150.180 48.481 -16.379 26 HA2 GLY 3 HA2 GLY 3 149.398 46.836 -17.821 27 HA3 GLY 3 HA3 GLY 3 148.741 45.916 -16.479 28 H SER 4 H SER 4 147.580 46.571 -19.070 29 HA SER 4 HA SER 4 144.889 47.308 -18.239 30 HB2 SER 4 HB2 SER 4 146.056 49.528 -18.713 31 HB3 SER 4 HB3 SER 4 146.214 49.000 -20.398 32 HG SER 4 HG SER 4 144.291 50.289 -19.911 33 H HIS 5 H HIS 5 143.372 47.121 -20.172 34 HA HIS 5 HA HIS 5 144.331 45.406 -22.379 35 HB2 HIS 5 HB2 HIS 5 142.673 43.688 -22.020 36 HB3 HIS 5 HB3 HIS 5 143.708 43.814 -20.605 37 HD2 HIS 5 HD2 HIS 5 140.083 44.179 -21.734 38 HE1 HIS 5 HE1 HIS 5 140.070 44.951 -17.538 39 HE2 HIS 5 HE2 HIS 5 138.605 44.552 -19.582 40 H HIS 6 H HIS 6 142.974 45.281 -24.173 41 HA HIS 6 HA HIS 6 140.709 47.199 -24.391 42 HB2 HIS 6 HB2 HIS 6 143.177 47.209 -26.182 43 HB3 HIS 6 HB3 HIS 6 141.746 48.211 -26.390 44 HD2 HIS 6 HD2 HIS 6 141.309 50.159 -24.469 45 HE1 HIS 6 HE1 HIS 6 145.339 50.250 -23.071 46 HE2 HIS 6 HE2 HIS 6 143.101 51.465 -23.044 47 H HIS 7 H HIS 7 139.449 46.947 -26.329 48 HA HIS 7 HA HIS 7 139.961 44.675 -28.111 49 HB2 HIS 7 HB2 HIS 7 137.842 43.594 -27.787 50 HB3 HIS 7 HB3 HIS 7 138.665 43.663 -26.238 51 HD2 HIS 7 HD2 HIS 7 137.637 45.373 -24.359 52 HE1 HIS 7 HE1 HIS 7 133.913 46.048 -26.334 53 HE2 HIS 7 HE2 HIS 7 135.189 46.339 -24.149 54 H HIS 8 H HIS 8 138.523 44.647 -29.978 55 HA HIS 8 HA HIS 8 137.219 47.232 -30.665 56 HB2 HIS 8 HB2 HIS 8 139.390 45.888 -32.327 57 HB3 HIS 8 HB3 HIS 8 138.461 47.307 -32.796 58 HD2 HIS 8 HD2 HIS 8 138.922 49.625 -31.362 59 HE1 HIS 8 HE1 HIS 8 142.715 48.409 -29.833 60 HE2 HIS 8 HE2 HIS 8 141.147 50.387 -30.170 61 H HIS 9 H HIS 9 135.772 47.139 -32.426 62 HA HIS 9 HA HIS 9 135.075 44.535 -33.632 63 HB2 HIS 9 HB2 HIS 9 132.790 44.580 -32.873 64 HB3 HIS 9 HB3 HIS 9 133.836 44.631 -31.465 65 HD2 HIS 9 HD2 HIS 9 131.104 46.565 -33.251 66 HE1 HIS 9 HE1 HIS 9 132.247 49.025 -29.957 67 HE2 HIS 9 HE2 HIS 9 130.533 48.700 -31.812 68 H HIS 10 H HIS 10 133.340 44.734 -35.249 69 HA HIS 10 HA HIS 10 132.864 47.395 -36.443 70 HB2 HIS 10 HB2 HIS 10 133.671 46.724 -38.630 71 HB3 HIS 10 HB3 HIS 10 134.976 46.598 -37.462 72 HD2 HIS 10 HD2 HIS 10 132.886 44.519 -39.877 73 HE1 HIS 10 HE1 HIS 10 135.604 41.777 -38.060 74 HE2 HIS 10 HE2 HIS 10 133.879 42.076 -39.908 75 H GLY 11 H GLY 11 131.257 47.297 -38.232 76 HA2 GLY 11 HA2 GLY 11 129.676 45.055 -38.884 77 HA3 GLY 11 HA3 GLY 11 128.928 45.810 -37.477 78 H SER 28 H SER 28 127.238 45.821 -39.261 79 HA SER 28 HA SER 28 127.163 48.475 -40.636 80 HB2 SER 28 HB2 SER 28 126.277 45.809 -41.808 81 HB3 SER 28 HB3 SER 28 126.011 47.399 -42.543 82 HG SER 28 HG SER 28 127.880 46.341 -43.393 83 H VAL 29 H VAL 29 124.970 49.189 -41.172 84 HA VAL 29 HA VAL 29 122.842 48.137 -39.353 85 HB VAL 29 HB VAL 29 122.102 50.430 -38.917 86 HG11 VAL 29 HG11 VAL 29 124.991 49.986 -38.072 87 HG12 VAL 29 HG12 VAL 29 123.784 51.004 -37.264 88 HG13 VAL 29 HG13 VAL 29 123.567 49.247 -37.310 89 HG21 VAL 29 HG21 VAL 29 123.095 51.615 -40.858 90 HG22 VAL 29 HG22 VAL 29 123.544 52.359 -39.319 91 HG23 VAL 29 HG23 VAL 29 124.719 51.353 -40.184 92 H SER 30 H SER 30 120.680 48.541 -39.937 93 HA SER 30 HA SER 30 120.073 49.488 -42.667 94 HB2 SER 30 HB2 SER 30 118.747 47.486 -43.186 95 HB3 SER 30 HB3 SER 30 120.465 47.109 -42.994 96 HG SER 30 HG SER 30 119.127 45.588 -41.898 97 H PHE 31 H PHE 31 117.819 49.910 -43.029 98 HA PHE 31 HA PHE 31 115.980 50.043 -40.742 99 HB2 PHE 31 HB2 PHE 31 115.759 52.501 -40.876 100 HB3 PHE 31 HB3 PHE 31 117.342 52.002 -40.332 101 HD1 PHE 31 HD2 PHE 31 115.450 53.529 -43.138 102 HD2 PHE 31 HD1 PHE 31 119.352 52.436 -41.656 103 HE1 PHE 31 HE2 PHE 31 116.512 54.915 -44.903 104 HE2 PHE 31 HE1 PHE 31 120.410 53.823 -43.425 105 HZ PHE 31 HZ PHE 31 118.992 55.061 -45.051 106 H GLY 32 H GLY 32 113.885 51.023 -41.335 107 HA2 GLY 32 HA2 GLY 32 112.106 51.492 -42.740 108 HA3 GLY 32 HA3 GLY 32 113.132 51.302 -44.153 109 H ALA 33 H ALA 33 110.552 50.412 -44.120 110 HA ALA 33 HA ALA 33 110.813 47.537 -44.644 111 HB1 ALA 33 HB1 ALA 33 108.817 48.663 -42.618 112 HB2 ALA 33 HB2 ALA 33 108.831 46.993 -43.216 113 HB3 ALA 33 HB3 ALA 33 110.190 47.595 -42.252 114 HA PRO 34 HA PRO 34 107.853 48.684 -47.831 115 HB2 PRO 34 HB2 PRO 34 106.669 46.312 -48.461 116 HB3 PRO 34 HB3 PRO 34 108.383 46.663 -48.828 117 HG2 PRO 34 HG2 PRO 34 107.273 45.170 -46.423 118 HG3 PRO 34 HG3 PRO 34 108.577 44.648 -47.540 119 HD2 PRO 34 HD2 PRO 34 109.134 45.851 -45.172 120 HD3 PRO 34 HD3 PRO 34 110.108 46.203 -46.630 121 H SER 35 H SER 35 105.572 48.912 -48.268 122 HA SER 35 HA SER 35 103.758 48.643 -45.909 123 HB2 SER 35 HB2 SER 35 102.997 50.966 -46.380 124 HB3 SER 35 HB3 SER 35 104.659 50.823 -45.802 125 HG SER 35 HG SER 35 104.479 52.283 -47.583 126 HA PRO 36 HA PRO 36 101.568 47.288 -49.858 127 HB2 PRO 36 HB2 PRO 36 101.041 44.683 -49.258 128 HB3 PRO 36 HB3 PRO 36 102.606 45.213 -49.951 129 HG2 PRO 36 HG2 PRO 36 101.939 44.744 -47.020 130 HG3 PRO 36 HG3 PRO 36 103.323 44.088 -47.955 131 HD2 PRO 36 HD2 PRO 36 103.571 46.324 -46.426 132 HD3 PRO 36 HD3 PRO 36 104.403 46.179 -48.005 133 H LEU 37 H LEU 37 99.329 46.868 -50.075 134 HA LEU 37 HA LEU 37 97.633 46.454 -47.728 135 HB2 LEU 37 HB2 LEU 37 96.241 48.416 -48.046 136 HB3 LEU 37 HB3 LEU 37 97.897 48.849 -47.700 137 HG LEU 37 HG LEU 37 98.139 49.155 -50.314 138 HD11 LEU 37 HD11 LEU 37 95.118 49.459 -49.942 139 HD12 LEU 37 HD12 LEU 37 96.046 50.001 -51.356 140 HD13 LEU 37 HD13 LEU 37 95.920 48.283 -51.005 141 HD21 LEU 37 HD21 LEU 37 98.289 50.958 -48.652 142 HD22 LEU 37 HD22 LEU 37 97.395 51.489 -50.083 143 HD23 LEU 37 HD23 LEU 37 96.515 51.072 -48.593 144 H SER 38 H SER 38 95.461 45.853 -48.242 145 HA SER 38 HA SER 38 95.013 44.908 -51.050 146 HB2 SER 38 HB2 SER 38 94.403 42.708 -50.148 147 HB3 SER 38 HB3 SER 38 96.077 43.137 -49.763 148 HG SER 38 HG SER 38 94.960 42.282 -47.929 149 H SER 39 H SER 39 93.515 46.454 -48.364 150 HA SER 39 HA SER 39 90.885 46.312 -49.677 151 HB2 SER 39 HB2 SER 39 90.972 44.305 -48.182 152 HB3 SER 39 HB3 SER 39 91.224 45.387 -46.798 153 HG SER 39 HG SER 39 88.992 44.803 -47.135 154 H GLU 40 H GLU 40 89.425 47.839 -48.988 155 HA GLU 40 HA GLU 40 90.326 50.023 -47.169 156 HB2 GLU 40 HB2 GLU 40 89.570 51.674 -48.720 157 HB3 GLU 40 HB3 GLU 40 90.724 50.637 -49.536 158 HG2 GLU 40 HG2 GLU 40 87.687 50.439 -49.837 159 HG3 GLU 40 HG3 GLU 40 88.753 51.313 -50.920 160 H SER 41 H SER 41 88.222 47.649 -47.183 161 HA SER 41 HA SER 41 85.944 49.190 -46.039 162 HB2 SER 41 HB2 SER 41 85.655 48.747 -48.537 163 HB3 SER 41 HB3 SER 41 85.552 47.023 -48.127 164 HG SER 41 HG SER 41 83.482 48.122 -48.237 165 H GLU 42 H GLU 42 84.179 47.391 -45.471 166 HA GLU 42 HA GLU 42 83.536 46.011 -43.776 167 HB2 GLU 42 HB2 GLU 42 84.254 44.508 -45.719 168 HB3 GLU 42 HB3 GLU 42 85.650 44.072 -44.733 169 HG2 GLU 42 HG2 GLU 42 84.074 43.307 -42.925 170 HG3 GLU 42 HG3 GLU 42 82.712 43.789 -43.932 171 H ASP 43 H ASP 43 84.900 47.941 -42.694 172 HA ASP 43 HA ASP 43 86.846 47.020 -40.734 173 HB2 ASP 43 HB2 ASP 43 85.292 49.619 -40.985 174 HB3 ASP 43 HB3 ASP 43 86.575 49.311 -39.812 175 H GLU 44 H GLU 44 85.134 45.203 -40.375 176 HA GLU 44 HA GLU 44 83.667 44.074 -39.078 177 HB2 GLU 44 HB2 GLU 44 84.543 45.975 -36.880 178 HB3 GLU 44 HB3 GLU 44 83.759 44.407 -36.669 179 HG2 GLU 44 HG2 GLU 44 85.678 43.298 -37.807 180 HG3 GLU 44 HG3 GLU 44 86.501 44.857 -37.918 181 H ILE 45 H ILE 45 82.458 46.224 -40.640 182 HA ILE 45 HA ILE 45 80.634 47.697 -39.066 183 HB ILE 45 HB ILE 45 79.582 48.267 -41.294 184 HG12 ILE 45 HG12 ILE 45 80.816 47.827 -43.327 185 HG13 ILE 45 HG13 ILE 45 81.969 46.805 -42.480 186 HG21 ILE 45 HG21 ILE 45 82.574 48.691 -40.925 187 HG22 ILE 45 HG22 ILE 45 81.482 49.686 -41.910 188 HG23 ILE 45 HG23 ILE 45 81.277 49.627 -40.156 189 HD11 ILE 45 HD11 ILE 45 79.002 46.169 -42.769 190 HD12 ILE 45 HD12 ILE 45 80.284 45.550 -43.829 191 HD13 ILE 45 HD13 ILE 45 80.271 45.093 -42.121 192 H ASN 46 H ASN 46 80.284 44.445 -39.545 193 HA ASN 46 HA ASN 46 77.333 44.414 -39.646 194 HB2 ASN 46 HB2 ASN 46 79.439 42.227 -39.415 195 HB3 ASN 46 HB3 ASN 46 77.708 41.917 -39.439 196 HD21 ASN 46 HD22 ASN 46 79.660 40.953 -41.372 197 HD22 ASN 46 HD21 ASN 46 79.127 41.603 -42.915 198 H TYR 47 H TYR 47 79.384 45.209 -37.182 199 HA TYR 47 HA TYR 47 78.805 43.658 -34.987 200 HB2 TYR 47 HB2 TYR 47 79.546 45.497 -33.658 201 HB3 TYR 47 HB3 TYR 47 80.456 45.536 -35.151 202 HD1 TYR 47 HD1 TYR 47 80.082 47.371 -36.806 203 HD2 TYR 47 HD2 TYR 47 77.927 47.244 -33.073 204 HE1 TYR 47 HE1 TYR 47 79.304 49.700 -37.183 205 HE2 TYR 47 HE2 TYR 47 77.154 49.583 -33.447 206 HH TYR 47 HH TYR 47 78.069 51.468 -36.360 207 H MET 48 H MET 48 76.588 45.983 -36.388 208 HA MET 48 HA MET 48 75.133 46.573 -34.015 209 HB2 MET 48 HB2 MET 48 73.727 47.919 -35.447 210 HB3 MET 48 HB3 MET 48 75.421 48.112 -35.885 211 HG2 MET 48 HG2 MET 48 75.077 46.509 -37.794 212 HG3 MET 48 HG3 MET 48 73.380 46.377 -37.339 213 HE1 MET 48 HE1 MET 48 76.182 48.526 -38.971 214 HE2 MET 48 HE2 MET 48 75.393 50.092 -39.251 215 HE3 MET 48 HE3 MET 48 75.807 49.596 -37.599 216 H THR 49 H THR 49 74.895 43.663 -35.632 217 HA THR 49 HA THR 49 72.130 43.205 -34.618 218 HB THR 49 HB THR 49 71.802 43.824 -36.847 219 HG1 THR 49 HG1 THR 49 70.669 42.011 -37.500 220 HG21 THR 49 HG21 THR 49 73.582 41.557 -37.820 221 HG22 THR 49 HG22 THR 49 72.578 42.636 -38.802 222 HG23 THR 49 HG23 THR 49 73.959 43.289 -37.917 223 HA PRO 50 HA PRO 50 74.740 39.666 -33.263 224 HB2 PRO 50 HB2 PRO 50 74.073 39.685 -30.614 225 HB3 PRO 50 HB3 PRO 50 75.359 40.725 -31.303 226 HG2 PRO 50 HG2 PRO 50 72.468 41.464 -30.738 227 HG3 PRO 50 HG3 PRO 50 73.949 42.364 -30.280 228 HD2 PRO 50 HD2 PRO 50 72.493 42.985 -32.502 229 HD3 PRO 50 HD3 PRO 50 74.275 43.133 -32.484 230 HA PRO 51 HA PRO 51 71.149 37.083 -33.611 231 HB2 PRO 51 HB2 PRO 51 72.084 34.612 -32.938 232 HB3 PRO 51 HB3 PRO 51 72.623 35.499 -34.397 233 HG2 PRO 51 HG2 PRO 51 74.003 35.347 -31.700 234 HG3 PRO 51 HG3 PRO 51 74.718 35.099 -33.323 235 HD2 PRO 51 HD2 PRO 51 74.880 37.497 -32.010 236 HD3 PRO 51 HD3 PRO 51 74.711 37.402 -33.788 237 H GLU 52 H GLU 52 69.367 36.574 -32.482 238 HA GLU 52 HA GLU 52 69.499 35.754 -29.620 239 HB2 GLU 52 HB2 GLU 52 67.939 37.497 -28.949 240 HB3 GLU 52 HB3 GLU 52 69.391 38.209 -29.636 241 HG2 GLU 52 HG2 GLU 52 68.222 38.655 -31.759 242 HG3 GLU 52 HG3 GLU 52 66.774 37.844 -31.167 243 H GLN 53 H GLN 53 68.294 34.876 -32.535 244 HA GLN 53 HA GLN 53 65.459 34.636 -31.720 245 HB2 GLN 53 HB2 GLN 53 66.332 35.975 -33.723 246 HB3 GLN 53 HB3 GLN 53 66.603 34.431 -34.517 247 HG2 GLN 53 HG2 GLN 53 63.886 34.494 -33.440 248 HG3 GLN 53 HG3 GLN 53 64.192 35.999 -34.289 249 HE21 GLN 53 HE22 GLN 53 64.469 32.434 -34.703 250 HE22 GLN 53 HE21 GLN 53 64.132 32.467 -36.441 251 H GLU 54 H GLU 54 67.859 32.499 -31.400 252 HA GLU 54 HA GLU 54 66.160 30.143 -32.093 253 HB2 GLU 54 HB2 GLU 54 69.128 30.441 -32.704 254 HB3 GLU 54 HB3 GLU 54 68.214 28.930 -32.785 255 HG2 GLU 54 HG2 GLU 54 66.712 29.954 -34.504 256 HG3 GLU 54 HG3 GLU 54 67.715 31.408 -34.488 257 H ALA 55 H ALA 55 66.037 28.644 -30.574 258 HA ALA 55 HA ALA 55 66.079 27.707 -28.518 259 HB1 ALA 55 HB1 ALA 55 69.073 27.801 -29.020 260 HB2 ALA 55 HB2 ALA 55 68.211 26.666 -27.959 261 HB3 ALA 55 HB3 ALA 55 67.934 26.624 -29.710 262 H GLN 56 H GLN 56 65.486 30.288 -28.088 263 HA GLN 56 HA GLN 56 66.796 30.953 -25.522 264 HB2 GLN 56 HB2 GLN 56 67.989 32.022 -27.591 265 HB3 GLN 56 HB3 GLN 56 66.585 33.056 -27.712 266 HG2 GLN 56 HG2 GLN 56 68.292 34.225 -26.483 267 HG3 GLN 56 HG3 GLN 56 67.035 33.807 -25.318 268 HE21 GLN 56 HE22 GLN 56 70.119 32.413 -26.683 269 HE22 GLN 56 HE21 GLN 56 70.641 31.757 -25.144 270 HA PRO 57 HA PRO 57 62.197 31.762 -26.054 271 HB2 PRO 57 HB2 PRO 57 61.023 29.847 -24.566 272 HB3 PRO 57 HB3 PRO 57 61.736 29.508 -26.184 273 HG2 PRO 57 HG2 PRO 57 63.049 29.057 -23.477 274 HG3 PRO 57 HG3 PRO 57 62.852 27.885 -24.820 275 HD2 PRO 57 HD2 PRO 57 65.132 29.371 -24.517 276 HD3 PRO 57 HD3 PRO 57 64.470 28.940 -26.123 277 H GLY 58 H GLY 58 61.256 33.343 -24.901 278 HA2 GLY 58 HA2 GLY 58 60.778 34.850 -23.213 279 HA3 GLY 58 HA3 GLY 58 61.062 33.556 -22.053 280 H ALA 59 H ALA 59 61.926 35.287 -20.701 281 HA ALA 59 HA ALA 59 64.871 35.415 -21.017 282 HB1 ALA 59 HB1 ALA 59 63.161 37.859 -20.427 283 HB2 ALA 59 HB2 ALA 59 64.938 37.768 -20.353 284 HB3 ALA 59 HB3 ALA 59 64.104 37.551 -21.905 285 H LEU 60 H LEU 60 65.090 33.886 -19.495 286 HA LEU 60 HA LEU 60 64.711 34.693 -16.658 287 HB2 LEU 60 HB2 LEU 60 64.134 31.921 -17.819 288 HB3 LEU 60 HB3 LEU 60 64.310 32.301 -16.123 289 HG LEU 60 HG LEU 60 62.340 34.056 -16.638 290 HD11 LEU 60 HD11 LEU 60 61.805 31.774 -18.604 291 HD12 LEU 60 HD12 LEU 60 60.686 33.087 -18.179 292 HD13 LEU 60 HD13 LEU 60 62.167 33.441 -19.074 293 HD21 LEU 60 HD21 LEU 60 62.254 32.264 -14.962 294 HD22 LEU 60 HD22 LEU 60 60.742 32.333 -15.879 295 HD23 LEU 60 HD23 LEU 60 61.936 31.063 -16.235 296 H ALA 61 H ALA 61 66.358 33.940 -15.254 297 HA ALA 61 HA ALA 61 68.520 32.314 -16.385 298 HB1 ALA 61 HB1 ALA 61 69.003 35.016 -15.077 299 HB2 ALA 61 HB2 ALA 61 70.260 33.842 -15.526 300 HB3 ALA 61 HB3 ALA 61 69.270 34.606 -16.785 301 H ALA 62 H ALA 62 69.192 30.790 -15.042 302 HA ALA 62 HA ALA 62 68.476 30.822 -12.163 303 HB1 ALA 62 HB1 ALA 62 69.799 28.690 -13.888 304 HB2 ALA 62 HB2 ALA 62 69.303 28.506 -12.194 305 HB3 ALA 62 HB3 ALA 62 68.078 28.761 -13.451 306 H LEU 63 H LEU 63 70.165 30.324 -10.575 307 HA LEU 63 HA LEU 63 72.837 31.493 -11.211 308 HB2 LEU 63 HB2 LEU 63 71.035 32.210 -8.864 309 HB3 LEU 63 HB3 LEU 63 72.688 32.772 -9.080 310 HG LEU 63 HG LEU 63 70.348 33.473 -10.912 311 HD11 LEU 63 HD11 LEU 63 71.855 35.124 -8.840 312 HD12 LEU 63 HD12 LEU 63 70.556 35.704 -9.905 313 HD13 LEU 63 HD13 LEU 63 70.203 34.492 -8.664 314 HD21 LEU 63 HD21 LEU 63 72.469 33.530 -12.153 315 HD22 LEU 63 HD22 LEU 63 71.930 35.181 -11.810 316 HD23 LEU 63 HD23 LEU 63 73.234 34.453 -10.853 317 H HIS 64 H HIS 64 74.512 31.015 -9.744 318 HA HIS 64 HA HIS 64 74.251 28.555 -8.092 319 HB2 HIS 64 HB2 HIS 64 76.539 30.394 -8.816 320 HB3 HIS 64 HB3 HIS 64 76.702 29.109 -7.625 321 HD2 HIS 64 HD2 HIS 64 77.088 29.779 -11.255 322 HE1 HIS 64 HE1 HIS 64 76.905 25.521 -10.946 323 HE2 HIS 64 HE2 HIS 64 77.510 27.465 -12.462 324 H ALA 65 H ALA 65 74.177 28.589 -5.853 325 HA ALA 65 HA ALA 65 73.503 31.201 -4.637 326 HB1 ALA 65 HB1 ALA 65 73.132 28.349 -3.645 327 HB2 ALA 65 HB2 ALA 65 72.452 29.818 -2.915 328 HB3 ALA 65 HB3 ALA 65 71.926 29.314 -4.532 329 H GLU 66 H GLU 66 76.189 28.989 -4.535 330 HA GLU 66 HA GLU 66 77.360 30.334 -2.139 331 HB2 GLU 66 HB2 GLU 66 77.068 27.327 -2.557 332 HB3 GLU 66 HB3 GLU 66 78.054 28.088 -1.304 333 HG2 GLU 66 HG2 GLU 66 76.002 29.194 -0.390 334 HG3 GLU 66 HG3 GLU 66 75.028 28.294 -1.558 335 H GLY 67 H GLY 67 79.670 29.805 -1.816 336 HA2 GLY 67 HA2 GLY 67 81.858 29.505 -2.506 337 HA3 GLY 67 HA3 GLY 67 81.254 28.649 -3.920 338 HA PRO 68 HA PRO 68 83.265 32.659 -5.195 339 HB2 PRO 68 HB2 PRO 68 84.691 31.727 -7.350 340 HB3 PRO 68 HB3 PRO 68 85.242 31.579 -5.655 341 HG2 PRO 68 HG2 PRO 68 83.780 29.501 -7.319 342 HG3 PRO 68 HG3 PRO 68 85.283 29.293 -6.360 343 HD2 PRO 68 HD2 PRO 68 82.875 28.594 -5.355 344 HD3 PRO 68 HD3 PRO 68 84.093 29.385 -4.310 345 H LEU 69 H LEU 69 81.153 30.446 -6.864 346 HA LEU 69 HA LEU 69 80.492 32.420 -8.974 347 HB2 LEU 69 HB2 LEU 69 79.580 29.564 -8.536 348 HB3 LEU 69 HB3 LEU 69 79.054 30.586 -9.866 349 HG LEU 69 HG LEU 69 81.935 29.725 -9.412 350 HD11 LEU 69 HD11 LEU 69 79.848 28.767 -11.396 351 HD12 LEU 69 HD12 LEU 69 81.543 28.231 -11.315 352 HD13 LEU 69 HD13 LEU 69 80.433 27.857 -9.988 353 HD21 LEU 69 HD21 LEU 69 81.924 31.800 -10.659 354 HD22 LEU 69 HD22 LEU 69 82.228 30.482 -11.787 355 HD23 LEU 69 HD23 LEU 69 80.614 31.212 -11.723 356 H ALA 70 H ALA 70 79.543 32.307 -5.809 357 HA ALA 70 HA ALA 70 76.752 32.159 -5.921 358 HB1 ALA 70 HB1 ALA 70 78.494 33.917 -4.135 359 HB2 ALA 70 HB2 ALA 70 76.797 33.482 -3.829 360 HB3 ALA 70 HB3 ALA 70 78.047 32.226 -3.827 361 H GLY 71 H GLY 71 75.271 33.248 -6.898 362 HA2 GLY 71 HA2 GLY 71 74.015 35.050 -7.708 363 HA3 GLY 71 HA3 GLY 71 75.344 36.160 -7.384 364 H LEU 72 H LEU 72 76.472 33.456 -9.160 365 HA LEU 72 HA LEU 72 76.388 34.958 -11.735 366 HB2 LEU 72 HB2 LEU 72 78.383 32.867 -10.785 367 HB3 LEU 72 HB3 LEU 72 78.502 33.784 -12.235 368 HG LEU 72 HG LEU 72 78.873 34.787 -9.409 369 HD11 LEU 72 HD11 LEU 72 80.614 34.992 -11.905 370 HD12 LEU 72 HD12 LEU 72 81.061 35.438 -10.243 371 HD13 LEU 72 HD13 LEU 72 80.779 33.745 -10.662 372 HD21 LEU 72 HD21 LEU 72 77.595 36.584 -10.502 373 HD22 LEU 72 HD22 LEU 72 79.281 37.051 -10.333 374 HD23 LEU 72 HD23 LEU 72 78.668 36.522 -11.911 375 HA PRO 73 HA PRO 73 73.853 32.098 -13.704 376 HB2 PRO 73 HB2 PRO 73 74.859 31.771 -16.257 377 HB3 PRO 73 HB3 PRO 73 74.145 33.293 -15.659 378 HG2 PRO 73 HG2 PRO 73 77.053 32.484 -15.854 379 HG3 PRO 73 HG3 PRO 73 76.309 34.046 -16.310 380 HD2 PRO 73 HD2 PRO 73 77.604 33.623 -13.987 381 HD3 PRO 73 HD3 PRO 73 76.234 34.769 -14.085 382 H VAL 74 H VAL 74 73.451 29.959 -14.762 383 HA VAL 74 HA VAL 74 75.613 27.984 -14.151 384 HB VAL 74 HB VAL 74 72.659 27.389 -14.335 385 HG11 VAL 74 HG11 VAL 74 74.994 25.907 -13.064 386 HG12 VAL 74 HG12 VAL 74 73.290 25.421 -12.980 387 HG13 VAL 74 HG13 VAL 74 74.116 25.430 -14.534 388 HG21 VAL 74 HG21 VAL 74 72.887 28.985 -12.490 389 HG22 VAL 74 HG22 VAL 74 72.646 27.368 -11.844 390 HG23 VAL 74 HG23 VAL 74 74.272 28.080 -11.840 391 H THR 75 H THR 75 73.379 29.064 -16.701 392 HA THR 75 HA THR 75 74.790 27.265 -18.647 393 HB THR 75 HB THR 75 72.770 27.085 -19.901 394 HG1 THR 75 HG1 THR 75 70.941 28.204 -19.321 395 HG21 THR 75 HG21 THR 75 71.984 26.701 -16.991 396 HG22 THR 75 HG22 THR 75 71.356 25.846 -18.417 397 HG23 THR 75 HG23 THR 75 73.038 25.591 -17.898 398 H ARG 76 H ARG 76 74.489 27.982 -21.015 399 HA ARG 76 HA ARG 76 75.663 30.637 -21.328 400 HB2 ARG 76 HB2 ARG 76 74.632 28.604 -23.378 401 HB3 ARG 76 HB3 ARG 76 75.404 30.142 -23.803 402 HG2 ARG 76 HG2 ARG 76 77.401 29.510 -22.489 403 HG3 ARG 76 HG3 ARG 76 76.662 27.926 -22.149 404 HD2 ARG 76 HD2 ARG 76 76.721 27.383 -24.539 405 HD3 ARG 76 HD3 ARG 76 77.472 28.959 -24.880 406 HE ARG 76 HE ARG 76 79.027 27.672 -22.868 407 HH11 ARG 76 HH11 ARG 76 78.375 27.139 -26.272 408 HH12 ARG 76 HH12 ARG 76 79.882 26.302 -26.512 409 HH21 ARG 76 HH21 ARG 76 80.915 26.616 -23.232 410 HH22 ARG 76 HH22 ARG 76 81.287 26.019 -24.812 411 H SER 77 H SER 77 72.367 29.356 -21.750 412 HA SER 77 HA SER 77 71.200 31.843 -22.638 413 HB2 SER 77 HB2 SER 77 69.073 30.799 -21.722 414 HB3 SER 77 HB3 SER 77 69.913 29.927 -23.017 415 HG SER 77 HG SER 77 69.271 28.522 -21.311 416 H ASP 78 H ASP 78 71.694 30.449 -19.298 417 HA ASP 78 HA ASP 78 70.551 32.651 -17.903 418 HB2 ASP 78 HB2 ASP 78 72.988 31.016 -17.126 419 HB3 ASP 78 HB3 ASP 78 72.119 32.116 -16.067 420 H ALA 79 H ALA 79 73.990 32.185 -18.918 421 HA ALA 79 HA ALA 79 74.914 34.686 -17.957 422 HB1 ALA 79 HB1 ALA 79 75.993 32.892 -20.187 423 HB2 ALA 79 HB2 ALA 79 76.887 34.205 -19.407 424 HB3 ALA 79 HB3 ALA 79 76.409 32.786 -18.457 425 H ARG 80 H ARG 80 73.651 33.887 -21.229 426 HA ARG 80 HA ARG 80 74.116 36.492 -22.360 427 HB2 ARG 80 HB2 ARG 80 73.632 34.249 -23.503 428 HB3 ARG 80 HB3 ARG 80 71.923 34.522 -23.157 429 HG2 ARG 80 HG2 ARG 80 72.035 36.633 -24.529 430 HG3 ARG 80 HG3 ARG 80 73.759 36.329 -24.804 431 HD2 ARG 80 HD2 ARG 80 72.961 33.989 -25.728 432 HD3 ARG 80 HD3 ARG 80 71.367 34.725 -25.774 433 HE ARG 80 HE ARG 80 71.984 35.967 -27.634 434 HH11 ARG 80 HH11 ARG 80 74.985 34.697 -26.277 435 HH12 ARG 80 HH12 ARG 80 75.931 35.377 -27.579 436 HH21 ARG 80 HH21 ARG 80 73.220 36.453 -29.397 437 HH22 ARG 80 HH22 ARG 80 74.952 36.197 -29.343 438 H VAL 81 H VAL 81 71.219 35.150 -20.723 439 HA VAL 81 HA VAL 81 69.601 37.534 -20.947 440 HB VAL 81 HB VAL 81 69.547 35.217 -18.979 441 HG11 VAL 81 HG11 VAL 81 67.532 37.489 -19.314 442 HG12 VAL 81 HG12 VAL 81 67.215 35.978 -18.437 443 HG13 VAL 81 HG13 VAL 81 68.443 37.087 -17.839 444 HG21 VAL 81 HG21 VAL 81 69.008 34.746 -21.372 445 HG22 VAL 81 HG22 VAL 81 67.640 34.492 -20.287 446 HG23 VAL 81 HG23 VAL 81 67.717 35.959 -21.301 447 H LEU 82 H LEU 82 71.753 36.387 -18.307 448 HA LEU 82 HA LEU 82 71.372 38.698 -16.646 449 HB2 LEU 82 HB2 LEU 82 73.768 36.843 -16.919 450 HB3 LEU 82 HB3 LEU 82 73.657 38.117 -15.709 451 HG LEU 82 HG LEU 82 71.817 35.706 -15.892 452 HD11 LEU 82 HD11 LEU 82 73.802 36.475 -13.726 453 HD12 LEU 82 HD12 LEU 82 72.978 34.915 -13.986 454 HD13 LEU 82 HD13 LEU 82 74.238 35.456 -15.106 455 HD21 LEU 82 HD21 LEU 82 70.515 37.548 -14.975 456 HD22 LEU 82 HD22 LEU 82 70.974 36.446 -13.677 457 HD23 LEU 82 HD23 LEU 82 71.848 37.982 -13.875 458 H ILE 83 H ILE 83 73.877 38.188 -19.216 459 HA ILE 83 HA ILE 83 75.115 40.745 -18.968 460 HB ILE 83 HB ILE 83 74.711 38.879 -21.323 461 HG12 ILE 83 HG12 ILE 83 77.252 39.789 -19.894 462 HG13 ILE 83 HG13 ILE 83 76.307 38.407 -19.358 463 HG21 ILE 83 HG21 ILE 83 76.193 41.556 -21.391 464 HG22 ILE 83 HG22 ILE 83 76.294 40.305 -22.642 465 HG23 ILE 83 HG23 ILE 83 74.774 41.125 -22.364 466 HD11 ILE 83 HD11 ILE 83 77.703 38.653 -22.050 467 HD12 ILE 83 HD12 ILE 83 78.146 37.609 -20.692 468 HD13 ILE 83 HD13 ILE 83 76.634 37.312 -21.571 469 H PHE 84 H PHE 84 72.287 39.826 -21.041 470 HA PHE 84 HA PHE 84 71.888 42.456 -21.984 471 HB2 PHE 84 HB2 PHE 84 70.925 40.285 -22.903 472 HB3 PHE 84 HB3 PHE 84 69.734 40.341 -21.615 473 HD1 PHE 84 HD1 PHE 84 71.197 42.878 -24.027 474 HD2 PHE 84 HD2 PHE 84 67.622 41.067 -22.419 475 HE1 PHE 84 HE1 PHE 84 69.857 44.186 -25.590 476 HE2 PHE 84 HE2 PHE 84 66.250 42.476 -23.936 477 HZ PHE 84 HZ PHE 84 67.352 44.029 -25.540 478 H ASN 85 H ASN 85 70.264 40.858 -19.195 479 HA ASN 85 HA ASN 85 68.570 43.086 -18.597 480 HB2 ASN 85 HB2 ASN 85 69.507 40.682 -16.964 481 HB3 ASN 85 HB3 ASN 85 68.349 41.861 -16.365 482 HD21 ASN 85 HD22 ASN 85 67.238 39.585 -16.233 483 HD22 ASN 85 HD21 ASN 85 66.180 39.258 -17.595 484 H GLU 86 H GLU 86 71.746 42.112 -17.167 485 HA GLU 86 HA GLU 86 71.830 44.264 -15.265 486 HB2 GLU 86 HB2 GLU 86 73.215 42.205 -15.121 487 HB3 GLU 86 HB3 GLU 86 74.139 42.738 -16.538 488 HG2 GLU 86 HG2 GLU 86 74.895 44.742 -15.318 489 HG3 GLU 86 HG3 GLU 86 73.891 44.302 -13.934 490 H TRP 87 H TRP 87 73.206 43.975 -18.647 491 HA TRP 87 HA TRP 87 74.220 46.646 -18.693 492 HB2 TRP 87 HB2 TRP 87 74.903 45.060 -20.359 493 HB3 TRP 87 HB3 TRP 87 73.239 44.779 -20.851 494 HD1 TRP 87 HD1 TRP 87 75.891 47.598 -21.073 495 HE1 TRP 87 HE1 TRP 87 75.443 48.892 -23.241 496 HE3 TRP 87 HE3 TRP 87 71.534 45.324 -22.508 497 HZ2 TRP 87 HZ2 TRP 87 73.507 48.904 -25.347 498 HZ3 TRP 87 HZ3 TRP 87 70.501 45.919 -24.638 499 HH2 TRP 87 HH2 TRP 87 71.433 47.721 -26.082 500 H GLU 88 H GLU 88 70.921 45.401 -19.681 501 HA GLU 88 HA GLU 88 69.927 47.872 -20.560 502 HB2 GLU 88 HB2 GLU 88 68.659 45.399 -19.385 503 HB3 GLU 88 HB3 GLU 88 67.675 46.826 -19.614 504 HG2 GLU 88 HG2 GLU 88 69.321 45.754 -21.917 505 HG3 GLU 88 HG3 GLU 88 67.757 45.063 -21.502 506 H GLU 89 H GLU 89 69.827 46.642 -17.136 507 HA GLU 89 HA GLU 89 68.513 49.038 -16.157 508 HB2 GLU 89 HB2 GLU 89 70.204 46.943 -14.730 509 HB3 GLU 89 HB3 GLU 89 69.345 48.262 -13.920 510 HG2 GLU 89 HG2 GLU 89 67.199 47.444 -14.895 511 HG3 GLU 89 HG3 GLU 89 68.054 46.073 -15.599 512 H ARG 90 H ARG 90 71.970 48.055 -16.083 513 HA ARG 90 HA ARG 90 72.987 50.449 -14.855 514 HB2 ARG 90 HB2 ARG 90 74.263 48.520 -16.849 515 HB3 ARG 90 HB3 ARG 90 75.146 49.804 -16.026 516 HG2 ARG 90 HG2 ARG 90 73.676 47.559 -14.636 517 HG3 ARG 90 HG3 ARG 90 75.398 47.540 -15.021 518 HD2 ARG 90 HD2 ARG 90 73.970 49.444 -13.108 519 HD3 ARG 90 HD3 ARG 90 75.043 48.126 -12.668 520 HE ARG 90 HE ARG 90 75.925 50.575 -14.216 521 HH11 ARG 90 HH11 ARG 90 76.759 48.265 -11.676 522 HH12 ARG 90 HH12 ARG 90 78.297 49.043 -11.422 523 HH21 ARG 90 HH21 ARG 90 77.713 51.424 -13.879 524 HH22 ARG 90 HH22 ARG 90 78.865 50.849 -12.664 525 H LYS 91 H LYS 91 72.691 49.608 -18.255 526 HA LYS 91 HA LYS 91 73.537 52.155 -19.259 527 HB2 LYS 91 HB2 LYS 91 73.555 49.984 -20.523 528 HB3 LYS 91 HB3 LYS 91 71.811 50.081 -20.699 529 HG2 LYS 91 HG2 LYS 91 73.461 52.400 -21.700 530 HG3 LYS 91 HG3 LYS 91 73.565 50.873 -22.567 531 HD2 LYS 91 HD2 LYS 91 71.098 50.825 -22.843 532 HD3 LYS 91 HD3 LYS 91 70.986 52.417 -22.064 533 HE2 LYS 91 HE2 LYS 91 72.460 53.377 -23.829 534 HE3 LYS 91 HE3 LYS 91 72.596 51.786 -24.584 535 HZ1 LYS 91 HZ1 LYS 91 70.048 53.316 -24.299 536 HZ2 LYS 91 HZ2 LYS 91 70.894 53.138 -25.682 537 HZ3 LYS 91 HZ3 LYS 91 70.182 51.841 -24.997 538 H LYS 92 H LYS 92 70.211 51.081 -18.371 539 HA LYS 92 HA LYS 92 68.924 53.486 -19.269 540 HB2 LYS 92 HB2 LYS 92 67.737 51.445 -18.517 541 HB3 LYS 92 HB3 LYS 92 68.260 51.747 -16.851 542 HG2 LYS 92 HG2 LYS 92 67.030 53.876 -16.834 543 HG3 LYS 92 HG3 LYS 92 66.572 53.638 -18.534 544 HD2 LYS 92 HD2 LYS 92 65.325 51.581 -17.905 545 HD3 LYS 92 HD3 LYS 92 65.790 51.822 -16.204 546 HE2 LYS 92 HE2 LYS 92 64.627 54.023 -16.203 547 HE3 LYS 92 HE3 LYS 92 64.171 53.790 -17.894 548 HZ1 LYS 92 HZ1 LYS 92 63.293 52.050 -15.638 549 HZ2 LYS 92 HZ2 LYS 92 62.363 53.155 -16.395 550 HZ3 LYS 92 HZ3 LYS 92 62.870 51.833 -17.204 551 H SER 93 H SER 93 70.772 52.779 -16.254 552 HA SER 93 HA SER 93 70.643 55.604 -15.430 553 HB2 SER 93 HB2 SER 93 72.421 53.348 -14.455 554 HB3 SER 93 HB3 SER 93 72.320 54.968 -13.748 555 HG SER 93 HG SER 93 70.933 53.464 -12.674 556 H GLU 94 H GLU 94 72.743 53.858 -17.573 557 HA GLU 94 HA GLU 94 74.731 56.085 -17.780 558 HB2 GLU 94 HB2 GLU 94 75.285 53.087 -17.662 559 HB3 GLU 94 HB3 GLU 94 76.471 54.365 -17.858 560 HG2 GLU 94 HG2 GLU 94 75.849 55.249 -15.604 561 HG3 GLU 94 HG3 GLU 94 74.725 53.897 -15.421 562 HA PRO 95 HA PRO 95 72.785 54.714 -21.785 563 HB2 PRO 95 HB2 PRO 95 72.803 57.163 -23.134 564 HB3 PRO 95 HB3 PRO 95 71.524 56.570 -22.034 565 HG2 PRO 95 HG2 PRO 95 73.866 58.380 -21.370 566 HG3 PRO 95 HG3 PRO 95 72.135 58.601 -20.946 567 HD2 PRO 95 HD2 PRO 95 73.832 57.575 -19.140 568 HD3 PRO 95 HD3 PRO 95 72.219 56.832 -19.344 569 H TRP 96 H TRP 96 75.936 55.778 -21.236 570 HA TRP 96 HA TRP 96 76.978 55.473 -23.973 571 HB2 TRP 96 HB2 TRP 96 79.136 55.942 -22.807 572 HB3 TRP 96 HB3 TRP 96 77.918 57.184 -22.592 573 HD1 TRP 96 HD1 TRP 96 79.732 54.430 -20.640 574 HE1 TRP 96 HE1 TRP 96 79.505 54.859 -18.119 575 HE3 TRP 96 HE3 TRP 96 76.427 58.346 -20.779 576 HZ2 TRP 96 HZ2 TRP 96 78.052 56.646 -16.384 577 HZ3 TRP 96 HZ3 TRP 96 75.622 59.379 -18.666 578 HH2 TRP 96 HH2 TRP 96 76.420 58.539 -16.470 579 H LEU 97 H LEU 97 76.188 53.222 -21.446 580 HA LEU 97 HA LEU 97 78.501 51.712 -21.344 581 HB2 LEU 97 HB2 LEU 97 76.429 51.762 -19.802 582 HB3 LEU 97 HB3 LEU 97 75.679 50.674 -20.945 583 HG LEU 97 HG LEU 97 77.498 49.052 -20.537 584 HD11 LEU 97 HD11 LEU 97 78.385 51.020 -18.384 585 HD12 LEU 97 HD12 LEU 97 78.931 49.335 -18.497 586 HD13 LEU 97 HD13 LEU 97 79.351 50.474 -19.773 587 HD21 LEU 97 HD21 LEU 97 75.362 48.992 -19.241 588 HD22 LEU 97 HD22 LEU 97 76.725 48.402 -18.270 589 HD23 LEU 97 HD23 LEU 97 76.104 50.054 -18.030 590 H ARG 98 H ARG 98 79.372 50.004 -22.382 591 HA ARG 98 HA ARG 98 78.317 49.204 -25.009 592 HB2 ARG 98 HB2 ARG 98 80.855 48.444 -23.516 593 HB3 ARG 98 HB3 ARG 98 80.462 47.953 -25.169 594 HG2 ARG 98 HG2 ARG 98 80.388 50.330 -25.881 595 HG3 ARG 98 HG3 ARG 98 80.816 50.839 -24.236 596 HD2 ARG 98 HD2 ARG 98 82.935 49.567 -24.391 597 HD3 ARG 98 HD3 ARG 98 82.520 49.090 -26.054 598 HE ARG 98 HE ARG 98 82.369 51.915 -25.917 599 HH11 ARG 98 HH11 ARG 98 84.899 49.495 -25.712 600 HH12 ARG 98 HH12 ARG 98 86.123 50.592 -26.290 601 HH21 ARG 98 HH21 ARG 98 83.979 53.263 -26.649 602 HH22 ARG 98 HH22 ARG 98 85.607 52.673 -26.808 603 H LEU 99 H LEU 99 78.137 47.059 -25.721 604 HA LEU 99 HA LEU 99 77.262 45.007 -23.746 605 HB2 LEU 99 HB2 LEU 99 75.436 46.438 -24.474 606 HB3 LEU 99 HB3 LEU 99 75.763 46.153 -26.148 607 HG LEU 99 HG LEU 99 73.732 45.042 -25.196 608 HD11 LEU 99 HD11 LEU 99 75.682 42.964 -26.224 609 HD12 LEU 99 HD12 LEU 99 73.942 43.127 -26.550 610 HD13 LEU 99 HD13 LEU 99 75.062 44.269 -27.247 611 HD21 LEU 99 HD21 LEU 99 74.875 44.461 -22.991 612 HD22 LEU 99 HD22 LEU 99 73.663 43.403 -23.676 613 HD23 LEU 99 HD23 LEU 99 75.410 42.988 -23.826 614 H ASP 100 H ASP 100 78.050 42.990 -24.295 615 HA ASP 100 HA ASP 100 78.770 42.385 -27.118 616 HB2 ASP 100 HB2 ASP 100 80.801 43.164 -25.902 617 HB3 ASP 100 HB3 ASP 100 80.590 41.850 -24.746 618 H MET 101 H MET 101 78.079 40.473 -27.760 619 HA MET 101 HA MET 101 77.247 38.395 -25.781 620 HB2 MET 101 HB2 MET 101 75.665 39.406 -28.176 621 HB3 MET 101 HB3 MET 101 75.262 37.973 -27.224 622 HG2 MET 101 HG2 MET 101 75.054 39.321 -25.189 623 HG3 MET 101 HG3 MET 101 75.399 40.783 -26.121 624 HE1 MET 101 HE1 MET 101 73.017 41.917 -25.186 625 HE2 MET 101 HE2 MET 101 71.553 40.909 -25.180 626 HE3 MET 101 HE3 MET 101 72.970 40.407 -24.234 627 H SER 102 H SER 102 79.620 38.801 -27.784 628 HA SER 102 HA SER 102 79.581 36.390 -29.423 629 HB2 SER 102 HB2 SER 102 81.184 38.211 -29.809 630 HB3 SER 102 HB3 SER 102 81.875 37.970 -28.190 631 HG SER 102 HG SER 102 83.000 36.897 -30.008 632 H ASP 103 H ASP 103 80.490 34.320 -28.882 633 HA ASP 103 HA ASP 103 79.949 33.304 -26.286 634 HB2 ASP 103 HB2 ASP 103 81.818 32.226 -28.434 635 HB3 ASP 103 HB3 ASP 103 81.253 31.327 -27.027 636 H LYS 104 H LYS 104 82.933 34.705 -27.589 637 HA LYS 104 HA LYS 104 84.723 34.019 -25.464 638 HB2 LYS 104 HB2 LYS 104 84.671 36.417 -27.349 639 HB3 LYS 104 HB3 LYS 104 86.000 36.028 -26.250 640 HG2 LYS 104 HG2 LYS 104 86.288 33.816 -27.361 641 HG3 LYS 104 HG3 LYS 104 84.972 34.206 -28.472 642 HD2 LYS 104 HD2 LYS 104 87.036 34.580 -29.615 643 HD3 LYS 104 HD3 LYS 104 86.280 36.153 -29.328 644 HE2 LYS 104 HE2 LYS 104 87.795 36.531 -27.388 645 HE3 LYS 104 HE3 LYS 104 88.503 34.926 -27.620 646 HZ1 LYS 104 HZ1 LYS 104 88.650 37.153 -29.597 647 HZ2 LYS 104 HZ2 LYS 104 89.876 36.659 -28.640 648 HZ3 LYS 104 HZ3 LYS 104 89.310 35.670 -29.806 649 H ALA 105 H ALA 105 82.257 36.578 -25.602 650 HA ALA 105 HA ALA 105 83.137 38.001 -23.243 651 HB1 ALA 105 HB1 ALA 105 80.336 37.786 -24.402 652 HB2 ALA 105 HB2 ALA 105 80.947 39.010 -23.277 653 HB3 ALA 105 HB3 ALA 105 81.584 38.937 -24.929 654 H ILE 106 H ILE 106 81.010 35.207 -23.760 655 HA ILE 106 HA ILE 106 80.245 34.982 -20.961 656 HB ILE 106 HB ILE 106 79.900 33.187 -23.389 657 HG12 ILE 106 HG12 ILE 106 77.509 33.625 -22.986 658 HG13 ILE 106 HG13 ILE 106 77.902 34.635 -21.595 659 HG21 ILE 106 HG21 ILE 106 79.023 32.601 -20.522 660 HG22 ILE 106 HG22 ILE 106 78.443 31.743 -21.965 661 HG23 ILE 106 HG23 ILE 106 80.140 31.636 -21.519 662 HD11 ILE 106 HD11 ILE 106 78.712 35.271 -24.460 663 HD12 ILE 106 HD12 ILE 106 77.264 35.903 -23.650 664 HD13 ILE 106 HD13 ILE 106 78.868 36.348 -23.051 665 H PHE 107 H PHE 107 82.593 33.194 -23.039 666 HA PHE 107 HA PHE 107 83.682 31.520 -21.042 667 HB2 PHE 107 HB2 PHE 107 85.281 32.962 -23.188 668 HB3 PHE 107 HB3 PHE 107 85.725 31.477 -22.373 669 HD1 PHE 107 HD2 PHE 107 82.659 30.346 -22.777 670 HD2 PHE 107 HD1 PHE 107 85.784 31.955 -25.275 671 HE1 PHE 107 HE2 PHE 107 81.805 29.026 -24.693 672 HE2 PHE 107 HE1 PHE 107 84.926 30.615 -27.202 673 HZ PHE 107 HZ PHE 107 82.943 29.141 -26.899 674 H ARG 108 H ARG 108 84.727 34.866 -21.870 675 HA ARG 108 HA ARG 108 86.840 34.897 -19.938 676 HB2 ARG 108 HB2 ARG 108 86.615 36.009 -22.186 677 HB3 ARG 108 HB3 ARG 108 85.567 37.224 -21.459 678 HG2 ARG 108 HG2 ARG 108 88.338 36.677 -20.329 679 HG3 ARG 108 HG3 ARG 108 88.157 37.536 -21.849 680 HD2 ARG 108 HD2 ARG 108 88.381 39.244 -20.307 681 HD3 ARG 108 HD3 ARG 108 86.648 39.206 -20.671 682 HE ARG 108 HE ARG 108 87.203 37.570 -18.367 683 HH11 ARG 108 HH11 ARG 108 87.115 40.985 -19.160 684 HH12 ARG 108 HH12 ARG 108 86.728 41.443 -17.526 685 HH21 ARG 108 HH21 ARG 108 86.709 38.203 -16.333 686 HH22 ARG 108 HH22 ARG 108 86.517 39.891 -15.951 687 H ARG 109 H ARG 109 83.515 36.245 -19.850 688 HA ARG 109 HA ARG 109 83.876 37.452 -17.209 689 HB2 ARG 109 HB2 ARG 109 82.285 38.227 -18.972 690 HB3 ARG 109 HB3 ARG 109 81.316 36.766 -18.714 691 HG2 ARG 109 HG2 ARG 109 80.880 37.437 -16.388 692 HG3 ARG 109 HG3 ARG 109 81.941 38.841 -16.559 693 HD2 ARG 109 HD2 ARG 109 79.421 38.364 -18.211 694 HD3 ARG 109 HD3 ARG 109 79.462 39.341 -16.750 695 HE ARG 109 HE ARG 109 80.524 40.033 -19.409 696 HH11 ARG 109 HH11 ARG 109 80.527 40.992 -16.034 697 HH12 ARG 109 HH12 ARG 109 81.099 42.595 -16.395 698 HH21 ARG 109 HH21 ARG 109 81.263 42.095 -19.796 699 HH22 ARG 109 HH22 ARG 109 81.499 43.198 -18.476 700 H TYR 110 H TYR 110 82.652 34.347 -18.369 701 HA TYR 110 HA TYR 110 82.319 33.353 -15.569 702 HB2 TYR 110 HB2 TYR 110 80.638 32.673 -17.997 703 HB3 TYR 110 HB3 TYR 110 80.414 32.114 -16.358 704 HD1 TYR 110 HD2 TYR 110 80.244 34.129 -14.528 705 HD2 TYR 110 HD1 TYR 110 79.255 34.378 -18.722 706 HE1 TYR 110 HE2 TYR 110 78.797 36.122 -14.091 707 HE2 TYR 110 HE1 TYR 110 77.759 36.322 -18.263 708 HH TYR 110 HH TYR 110 76.909 37.757 -16.649 709 HA PRO 111 HA PRO 111 85.520 30.908 -17.838 710 HB2 PRO 111 HB2 PRO 111 87.113 30.220 -15.700 711 HB3 PRO 111 HB3 PRO 111 87.183 31.797 -16.543 712 HG2 PRO 111 HG2 PRO 111 85.663 31.111 -14.006 713 HG3 PRO 111 HG3 PRO 111 86.768 32.496 -14.294 714 HD2 PRO 111 HD2 PRO 111 84.096 32.784 -14.509 715 HD3 PRO 111 HD3 PRO 111 85.181 33.584 -15.689 716 H HIS 112 H HIS 112 83.381 29.918 -15.246 717 HA HIS 112 HA HIS 112 83.911 27.060 -15.452 718 HB2 HIS 112 HB2 HIS 112 82.097 26.826 -13.971 719 HB3 HIS 112 HB3 HIS 112 82.934 28.282 -13.453 720 HD2 HIS 112 HD2 HIS 112 79.604 27.092 -13.690 721 HE1 HIS 112 HE1 HIS 112 79.014 31.073 -15.049 722 HE2 HIS 112 HE2 HIS 112 77.886 29.094 -14.081 723 H LEU 113 H LEU 113 82.022 29.347 -17.304 724 HA LEU 113 HA LEU 113 80.187 27.392 -18.377 725 HB2 LEU 113 HB2 LEU 113 80.207 30.136 -17.771 726 HB3 LEU 113 HB3 LEU 113 80.305 30.131 -19.513 727 HG LEU 113 HG LEU 113 78.068 30.354 -18.923 728 HD11 LEU 113 HD11 LEU 113 78.344 27.383 -19.557 729 HD12 LEU 113 HD12 LEU 113 76.967 28.428 -19.894 730 HD13 LEU 113 HD13 LEU 113 78.507 28.716 -20.726 731 HD21 LEU 113 HD21 LEU 113 77.906 29.735 -16.681 732 HD22 LEU 113 HD22 LEU 113 76.801 28.693 -17.548 733 HD23 LEU 113 HD23 LEU 113 78.362 28.035 -17.003 734 H ARG 114 H ARG 114 83.323 28.213 -19.256 735 HA ARG 114 HA ARG 114 83.117 28.048 -22.165 736 HB2 ARG 114 HB2 ARG 114 84.886 29.299 -20.930 737 HB3 ARG 114 HB3 ARG 114 85.555 27.779 -20.357 738 HG2 ARG 114 HG2 ARG 114 85.263 28.471 -23.319 739 HG3 ARG 114 HG3 ARG 114 86.672 28.907 -22.352 740 HD2 ARG 114 HD2 ARG 114 87.026 26.488 -21.825 741 HD3 ARG 114 HD3 ARG 114 85.720 26.089 -22.959 742 HE ARG 114 HE ARG 114 87.536 27.738 -24.343 743 HH11 ARG 114 HH11 ARG 114 87.544 24.515 -22.972 744 HH12 ARG 114 HH12 ARG 114 88.740 23.935 -24.099 745 HH21 ARG 114 HH21 ARG 114 89.061 26.938 -25.750 746 HH22 ARG 114 HH22 ARG 114 89.571 25.279 -25.634 Start of MODEL 9 1 H1 MET 1 H1 MET 1 139.547 43.473 -74.225 2 H2 MET 1 H2 MET 1 138.908 44.964 -74.409 3 H3 MET 1 H3 MET 1 139.330 44.100 -75.725 4 HA MET 1 HA MET 1 136.929 44.066 -75.475 5 HB2 MET 1 HB2 MET 1 138.202 41.359 -74.835 6 HB3 MET 1 HB3 MET 1 136.527 41.602 -75.335 7 HG2 MET 1 HG2 MET 1 137.293 42.565 -77.485 8 HG3 MET 1 HG3 MET 1 138.973 42.272 -77.013 9 HE1 MET 1 HE1 MET 1 139.493 40.972 -79.212 10 HE2 MET 1 HE2 MET 1 138.499 39.638 -79.835 11 HE3 MET 1 HE3 MET 1 137.831 41.285 -79.768 12 H ARG 2 H ARG 2 135.100 43.924 -74.173 13 HA ARG 2 HA ARG 2 135.320 43.126 -71.332 14 HB2 ARG 2 HB2 ARG 2 136.079 45.527 -71.502 15 HB3 ARG 2 HB3 ARG 2 134.494 45.956 -72.150 16 HG2 ARG 2 HG2 ARG 2 133.423 45.294 -70.034 17 HG3 ARG 2 HG3 ARG 2 134.974 44.681 -69.414 18 HD2 ARG 2 HD2 ARG 2 135.916 46.967 -69.543 19 HD3 ARG 2 HD3 ARG 2 134.360 47.574 -70.153 20 HE ARG 2 HE ARG 2 133.847 46.213 -67.721 21 HH11 ARG 2 HH11 ARG 2 135.529 49.134 -68.685 22 HH12 ARG 2 HH12 ARG 2 135.278 49.900 -67.140 23 HH21 ARG 2 HH21 ARG 2 133.558 47.245 -65.775 24 HH22 ARG 2 HH22 ARG 2 134.184 48.850 -65.537 25 H GLY 3 H GLY 3 133.351 42.741 -70.326 26 HA2 GLY 3 HA2 GLY 3 131.041 42.607 -70.049 27 HA3 GLY 3 HA3 GLY 3 130.769 43.195 -71.681 28 H SER 4 H SER 4 129.489 41.005 -70.316 29 HA SER 4 HA SER 4 129.721 38.866 -72.304 30 HB2 SER 4 HB2 SER 4 130.095 37.095 -70.615 31 HB3 SER 4 HB3 SER 4 131.469 38.198 -70.744 32 HG SER 4 HG SER 4 130.993 37.833 -68.554 33 H HIS 5 H HIS 5 128.051 37.173 -71.983 34 HA HIS 5 HA HIS 5 125.760 37.832 -70.233 35 HB2 HIS 5 HB2 HIS 5 125.341 39.080 -72.328 36 HB3 HIS 5 HB3 HIS 5 125.535 37.598 -73.261 37 HD2 HIS 5 HD2 HIS 5 123.030 39.494 -71.090 38 HE1 HIS 5 HE1 HIS 5 121.006 35.976 -72.413 39 HE2 HIS 5 HE2 HIS 5 120.724 38.229 -71.251 40 H HIS 6 H HIS 6 124.794 36.049 -69.460 41 HA HIS 6 HA HIS 6 125.241 33.381 -70.743 42 HB2 HIS 6 HB2 HIS 6 125.720 34.059 -67.812 43 HB3 HIS 6 HB3 HIS 6 125.840 32.457 -68.531 44 HD2 HIS 6 HD2 HIS 6 127.832 32.181 -70.514 45 HE1 HIS 6 HE1 HIS 6 130.338 35.165 -68.777 46 HE2 HIS 6 HE2 HIS 6 130.253 33.222 -70.423 47 H HIS 7 H HIS 7 122.895 35.457 -69.749 48 HA HIS 7 HA HIS 7 121.384 33.850 -67.923 49 HB2 HIS 7 HB2 HIS 7 120.515 36.293 -69.504 50 HB3 HIS 7 HB3 HIS 7 119.734 35.638 -68.071 51 HD2 HIS 7 HD2 HIS 7 120.660 36.381 -65.726 52 HE1 HIS 7 HE1 HIS 7 124.088 38.573 -67.011 53 HE2 HIS 7 HE2 HIS 7 122.637 37.970 -65.008 54 H HIS 8 H HIS 8 119.563 32.641 -68.138 55 HA HIS 8 HA HIS 8 118.274 32.178 -70.753 56 HB2 HIS 8 HB2 HIS 8 120.351 30.743 -70.667 57 HB3 HIS 8 HB3 HIS 8 119.695 29.948 -69.238 58 HD2 HIS 8 HD2 HIS 8 119.206 27.561 -70.177 59 HE1 HIS 8 HE1 HIS 8 116.790 28.604 -73.536 60 HE2 HIS 8 HE2 HIS 8 117.682 26.673 -72.138 61 H HIS 9 H HIS 9 116.488 30.521 -70.531 62 HA HIS 9 HA HIS 9 115.295 30.279 -67.834 63 HB2 HIS 9 HB2 HIS 9 113.170 31.198 -68.486 64 HB3 HIS 9 HB3 HIS 9 114.417 32.411 -68.732 65 HD2 HIS 9 HD2 HIS 9 115.094 32.987 -71.335 66 HE1 HIS 9 HE1 HIS 9 111.654 31.181 -73.101 67 HE2 HIS 9 HE2 HIS 9 113.638 32.722 -73.519 68 H HIS 10 H HIS 10 113.599 28.716 -67.677 69 HA HIS 10 HA HIS 10 113.215 26.803 -69.887 70 HB2 HIS 10 HB2 HIS 10 114.131 24.914 -68.658 71 HB3 HIS 10 HB3 HIS 10 115.374 26.128 -68.892 72 HD2 HIS 10 HD2 HIS 10 116.324 27.394 -66.709 73 HE1 HIS 10 HE1 HIS 10 114.323 25.015 -63.787 74 HE2 HIS 10 HE2 HIS 10 116.128 26.773 -64.153 75 H GLY 11 H GLY 11 111.814 24.965 -69.243 76 HA2 GLY 11 HA2 GLY 11 110.019 23.988 -68.153 77 HA3 GLY 11 HA3 GLY 11 110.042 25.244 -66.925 78 H SER 28 H SER 28 107.711 24.199 -67.988 79 HA SER 28 HA SER 28 106.329 26.591 -68.952 80 HB2 SER 28 HB2 SER 28 107.171 25.443 -71.044 81 HB3 SER 28 HB3 SER 28 106.185 24.035 -70.603 82 HG SER 28 HG SER 28 105.111 25.513 -72.055 83 H VAL 29 H VAL 29 103.977 26.323 -68.885 84 HA VAL 29 HA VAL 29 102.839 23.972 -67.576 85 HB VAL 29 HB VAL 29 103.724 25.281 -65.673 86 HG11 VAL 29 HG11 VAL 29 101.682 27.421 -66.392 87 HG12 VAL 29 HG12 VAL 29 102.719 27.367 -64.956 88 HG13 VAL 29 HG13 VAL 29 103.446 27.582 -66.554 89 HG21 VAL 29 HG21 VAL 29 101.753 23.811 -65.397 90 HG22 VAL 29 HG22 VAL 29 101.773 25.176 -64.273 91 HG23 VAL 29 HG23 VAL 29 100.686 25.211 -65.670 92 H SER 30 H SER 30 100.625 23.772 -67.829 93 HA SER 30 HA SER 30 99.142 25.902 -69.318 94 HB2 SER 30 HB2 SER 30 99.136 22.927 -69.953 95 HB3 SER 30 HB3 SER 30 98.066 24.144 -70.674 96 HG SER 30 HG SER 30 99.916 23.693 -71.991 97 H PHE 31 H PHE 31 97.155 26.315 -68.554 98 HA PHE 31 HA PHE 31 95.624 24.411 -66.930 99 HB2 PHE 31 HB2 PHE 31 95.526 25.867 -64.963 100 HB3 PHE 31 HB3 PHE 31 97.161 25.332 -65.266 101 HD1 PHE 31 HD1 PHE 31 98.913 26.917 -66.016 102 HD2 PHE 31 HD2 PHE 31 94.890 28.241 -65.197 103 HE1 PHE 31 HE1 PHE 31 99.697 29.273 -65.975 104 HE2 PHE 31 HE2 PHE 31 95.679 30.596 -65.155 105 HZ PHE 31 HZ PHE 31 98.080 31.116 -65.546 106 H GLY 32 H GLY 32 93.495 25.245 -66.320 107 HA2 GLY 32 HA2 GLY 32 92.399 27.730 -66.977 108 HA3 GLY 32 HA3 GLY 32 92.126 26.713 -68.394 109 H ALA 33 H ALA 33 90.216 27.901 -66.456 110 HA ALA 33 HA ALA 33 88.584 25.490 -65.936 111 HB1 ALA 33 HB1 ALA 33 89.361 27.467 -63.746 112 HB2 ALA 33 HB2 ALA 33 88.198 26.130 -63.584 113 HB3 ALA 33 HB3 ALA 33 89.909 25.782 -63.881 114 HA PRO 34 HA PRO 34 86.240 29.293 -67.457 115 HB2 PRO 34 HB2 PRO 34 85.256 28.325 -69.811 116 HB3 PRO 34 HB3 PRO 34 86.896 29.027 -69.661 117 HG2 PRO 34 HG2 PRO 34 86.117 26.089 -69.559 118 HG3 PRO 34 HG3 PRO 34 87.392 26.859 -70.559 119 HD2 PRO 34 HD2 PRO 34 87.973 25.664 -68.187 120 HD3 PRO 34 HD3 PRO 34 88.803 27.166 -68.695 121 H SER 35 H SER 35 83.992 29.594 -67.371 122 HA SER 35 HA SER 35 82.173 27.278 -67.069 123 HB2 SER 35 HB2 SER 35 83.145 27.752 -64.809 124 HB3 SER 35 HB3 SER 35 82.390 29.352 -64.862 125 HG SER 35 HG SER 35 81.067 27.755 -63.808 126 HA PRO 36 HA PRO 36 80.365 30.938 -69.305 127 HB2 PRO 36 HB2 PRO 36 79.603 29.716 -71.616 128 HB3 PRO 36 HB3 PRO 36 81.289 30.238 -71.311 129 HG2 PRO 36 HG2 PRO 36 80.101 27.468 -70.923 130 HG3 PRO 36 HG3 PRO 36 81.603 27.912 -71.795 131 HD2 PRO 36 HD2 PRO 36 81.630 27.053 -69.206 132 HD3 PRO 36 HD3 PRO 36 82.764 28.309 -69.785 133 H LEU 37 H LEU 37 78.184 31.447 -69.744 134 HA LEU 37 HA LEU 37 76.072 29.465 -69.478 135 HB2 LEU 37 HB2 LEU 37 74.939 30.325 -67.628 136 HB3 LEU 37 HB3 LEU 37 76.591 30.098 -67.098 137 HG LEU 37 HG LEU 37 75.301 32.776 -67.820 138 HD11 LEU 37 HD11 LEU 37 76.041 31.575 -65.125 139 HD12 LEU 37 HD12 LEU 37 75.359 33.192 -65.406 140 HD13 LEU 37 HD13 LEU 37 74.395 31.756 -65.773 141 HD21 LEU 37 HD21 LEU 37 77.705 32.973 -68.181 142 HD22 LEU 37 HD22 LEU 37 77.292 33.772 -66.667 143 HD23 LEU 37 HD23 LEU 37 78.044 32.160 -66.633 144 H SER 38 H SER 38 74.016 30.186 -70.160 145 HA SER 38 HA SER 38 74.048 32.686 -71.824 146 HB2 SER 38 HB2 SER 38 72.812 29.994 -72.489 147 HB3 SER 38 HB3 SER 38 72.820 31.437 -73.519 148 HG SER 38 HG SER 38 74.502 29.960 -74.077 149 H SER 39 H SER 39 72.402 31.404 -69.195 150 HA SER 39 HA SER 39 69.900 32.914 -69.796 151 HB2 SER 39 HB2 SER 39 70.000 30.031 -68.824 152 HB3 SER 39 HB3 SER 39 68.543 31.028 -68.980 153 HG SER 39 HG SER 39 68.860 29.645 -70.802 154 H GLU 40 H GLU 40 68.706 33.591 -68.000 155 HA GLU 40 HA GLU 40 69.592 32.969 -65.262 156 HB2 GLU 40 HB2 GLU 40 71.057 34.849 -66.032 157 HB3 GLU 40 HB3 GLU 40 69.620 35.828 -66.326 158 HG2 GLU 40 HG2 GLU 40 69.047 35.712 -63.916 159 HG3 GLU 40 HG3 GLU 40 70.441 34.667 -63.627 160 H SER 41 H SER 41 67.893 32.998 -63.845 161 HA SER 41 HA SER 41 65.234 33.982 -64.774 162 HB2 SER 41 HB2 SER 41 64.340 32.292 -63.222 163 HB3 SER 41 HB3 SER 41 65.395 31.598 -64.465 164 HG SER 41 HG SER 41 65.920 30.743 -62.407 165 H GLU 42 H GLU 42 67.623 34.919 -62.571 166 HA GLU 42 HA GLU 42 66.095 35.498 -60.247 167 HB2 GLU 42 HB2 GLU 42 68.710 36.696 -61.232 168 HB3 GLU 42 HB3 GLU 42 68.042 36.909 -59.609 169 HG2 GLU 42 HG2 GLU 42 68.073 34.424 -59.294 170 HG3 GLU 42 HG3 GLU 42 68.871 34.258 -60.860 171 H ASP 43 H ASP 43 66.057 37.198 -63.219 172 HA ASP 43 HA ASP 43 65.297 39.804 -62.261 173 HB2 ASP 43 HB2 ASP 43 66.185 39.296 -64.539 174 HB3 ASP 43 HB3 ASP 43 64.708 38.401 -64.897 175 H GLU 44 H GLU 44 63.594 36.851 -62.514 176 HA GLU 44 HA GLU 44 61.021 38.179 -61.747 177 HB2 GLU 44 HB2 GLU 44 61.105 37.116 -64.050 178 HB3 GLU 44 HB3 GLU 44 61.261 35.549 -63.248 179 HG2 GLU 44 HG2 GLU 44 59.059 35.833 -62.205 180 HG3 GLU 44 HG3 GLU 44 58.962 37.502 -62.777 181 H ILE 45 H ILE 45 63.398 36.026 -60.778 182 HA ILE 45 HA ILE 45 61.781 35.037 -58.452 183 HB ILE 45 HB ILE 45 64.117 33.589 -59.751 184 HG12 ILE 45 HG12 ILE 45 61.117 33.077 -60.023 185 HG13 ILE 45 HG13 ILE 45 62.203 33.613 -61.305 186 HG21 ILE 45 HG21 ILE 45 62.069 32.671 -57.665 187 HG22 ILE 45 HG22 ILE 45 63.458 31.741 -58.270 188 HG23 ILE 45 HG23 ILE 45 63.731 33.165 -57.286 189 HD11 ILE 45 HD11 ILE 45 62.197 30.889 -59.979 190 HD12 ILE 45 HD12 ILE 45 61.821 31.303 -61.657 191 HD13 ILE 45 HD13 ILE 45 63.488 31.465 -61.065 192 H ASN 46 H ASN 46 62.302 37.059 -57.469 193 HA ASN 46 HA ASN 46 65.169 37.509 -56.798 194 HB2 ASN 46 HB2 ASN 46 63.718 39.095 -58.231 195 HB3 ASN 46 HB3 ASN 46 62.921 39.546 -56.721 196 HD21 ASN 46 HD22 ASN 46 66.093 39.342 -58.369 197 HD22 ASN 46 HD21 ASN 46 66.826 40.657 -57.451 198 H TYR 47 H TYR 47 62.467 36.327 -55.183 199 HA TYR 47 HA TYR 47 63.589 37.029 -52.512 200 HB2 TYR 47 HB2 TYR 47 61.839 38.624 -52.766 201 HB3 TYR 47 HB3 TYR 47 60.754 37.446 -53.485 202 HD1 TYR 47 HD2 TYR 47 62.447 38.369 -50.264 203 HD2 TYR 47 HD1 TYR 47 59.296 36.108 -52.161 204 HE1 TYR 47 HE2 TYR 47 61.469 37.845 -48.035 205 HE2 TYR 47 HE1 TYR 47 58.326 35.583 -49.934 206 HH TYR 47 HH TYR 47 58.486 35.880 -47.660 207 H MET 48 H MET 48 63.718 35.376 -51.160 208 HA MET 48 HA MET 48 61.758 33.234 -51.095 209 HB2 MET 48 HB2 MET 48 63.505 32.578 -52.897 210 HB3 MET 48 HB3 MET 48 64.650 32.397 -51.578 211 HG2 MET 48 HG2 MET 48 63.693 30.256 -52.214 212 HG3 MET 48 HG3 MET 48 63.182 30.645 -50.580 213 HE1 MET 48 HE1 MET 48 61.369 28.762 -50.616 214 HE2 MET 48 HE2 MET 48 60.171 28.557 -51.914 215 HE3 MET 48 HE3 MET 48 61.898 28.314 -52.255 216 H THR 49 H THR 49 62.470 35.305 -49.273 217 HA THR 49 HA THR 49 63.968 33.924 -47.077 218 HB THR 49 HB THR 49 64.942 36.224 -46.615 219 HG1 THR 49 HG1 THR 49 65.022 37.614 -48.373 220 HG21 THR 49 HG21 THR 49 65.730 34.863 -49.225 221 HG22 THR 49 HG22 THR 49 66.744 35.924 -48.224 222 HG23 THR 49 HG23 THR 49 66.230 34.351 -47.599 223 HA PRO 50 HA PRO 50 60.086 35.514 -45.056 224 HB2 PRO 50 HB2 PRO 50 59.244 33.144 -43.978 225 HB3 PRO 50 HB3 PRO 50 58.819 33.659 -45.639 226 HG2 PRO 50 HG2 PRO 50 61.077 31.819 -44.776 227 HG3 PRO 50 HG3 PRO 50 59.843 31.530 -46.046 228 HD2 PRO 50 HD2 PRO 50 62.317 32.479 -46.640 229 HD3 PRO 50 HD3 PRO 50 60.871 33.059 -47.522 230 HA PRO 51 HA PRO 51 62.299 35.758 -41.209 231 HB2 PRO 51 HB2 PRO 51 60.351 35.945 -39.285 232 HB3 PRO 51 HB3 PRO 51 60.707 37.243 -40.466 233 HG2 PRO 51 HG2 PRO 51 58.557 35.104 -40.646 234 HG3 PRO 51 HG3 PRO 51 58.380 36.873 -40.883 235 HD2 PRO 51 HD2 PRO 51 58.672 35.194 -42.988 236 HD3 PRO 51 HD3 PRO 51 59.471 36.793 -42.985 237 H GLU 52 H GLU 52 63.121 34.576 -39.506 238 HA GLU 52 HA GLU 52 62.436 31.676 -39.526 239 HB2 GLU 52 HB2 GLU 52 64.969 33.229 -38.925 240 HB3 GLU 52 HB3 GLU 52 64.832 31.496 -38.661 241 HG2 GLU 52 HG2 GLU 52 64.348 32.786 -41.377 242 HG3 GLU 52 HG3 GLU 52 65.912 32.202 -40.831 243 H GLN 53 H GLN 53 61.870 34.230 -37.411 244 HA GLN 53 HA GLN 53 61.746 32.399 -35.060 245 HB2 GLN 53 HB2 GLN 53 63.881 33.673 -35.020 246 HB3 GLN 53 HB3 GLN 53 62.969 35.186 -35.036 247 HG2 GLN 53 HG2 GLN 53 61.911 34.558 -32.862 248 HG3 GLN 53 HG3 GLN 53 62.816 33.038 -32.867 249 HE21 GLN 53 HE22 GLN 53 65.263 33.212 -32.752 250 HE22 GLN 53 HE21 GLN 53 65.934 34.631 -31.963 251 H GLU 54 H GLU 54 59.891 32.475 -34.015 252 HA GLU 54 HA GLU 54 58.407 34.894 -33.493 253 HB2 GLU 54 HB2 GLU 54 56.292 34.197 -34.492 254 HB3 GLU 54 HB3 GLU 54 57.512 34.412 -35.735 255 HG2 GLU 54 HG2 GLU 54 57.838 31.941 -35.846 256 HG3 GLU 54 HG3 GLU 54 56.604 31.729 -34.600 257 H ALA 55 H ALA 55 56.530 34.436 -32.080 258 HA ALA 55 HA ALA 55 55.616 33.566 -30.193 259 HB1 ALA 55 HB1 ALA 55 55.627 31.102 -31.968 260 HB2 ALA 55 HB2 ALA 55 54.497 31.447 -30.639 261 HB3 ALA 55 HB3 ALA 55 54.500 32.473 -32.084 262 H GLN 56 H GLN 56 58.105 33.838 -29.422 263 HA GLN 56 HA GLN 56 58.544 31.539 -27.607 264 HB2 GLN 56 HB2 GLN 56 59.992 31.246 -29.654 265 HB3 GLN 56 HB3 GLN 56 60.800 32.755 -29.254 266 HG2 GLN 56 HG2 GLN 56 62.134 30.881 -28.487 267 HG3 GLN 56 HG3 GLN 56 61.541 31.741 -27.073 268 HE21 GLN 56 HE22 GLN 56 61.039 28.793 -29.087 269 HE22 GLN 56 HE21 GLN 56 60.227 27.900 -27.810 270 HA PRO 57 HA PRO 57 58.682 35.848 -25.915 271 HB2 PRO 57 HB2 PRO 57 56.503 35.948 -24.345 272 HB3 PRO 57 HB3 PRO 57 56.371 35.897 -26.138 273 HG2 PRO 57 HG2 PRO 57 56.163 33.546 -24.213 274 HG3 PRO 57 HG3 PRO 57 54.992 34.036 -25.482 275 HD2 PRO 57 HD2 PRO 57 56.937 32.157 -25.936 276 HD3 PRO 57 HD3 PRO 57 56.385 33.295 -27.200 277 H GLY 58 H GLY 58 59.217 36.787 -23.912 278 HA2 GLY 58 HA2 GLY 58 59.923 36.970 -21.732 279 HA3 GLY 58 HA3 GLY 58 59.365 35.337 -21.406 280 H ALA 59 H ALA 59 61.621 36.357 -20.239 281 HA ALA 59 HA ALA 59 63.634 34.381 -21.043 282 HB1 ALA 59 HB1 ALA 59 64.296 37.361 -20.910 283 HB2 ALA 59 HB2 ALA 59 65.475 36.042 -21.082 284 HB3 ALA 59 HB3 ALA 59 64.301 36.352 -22.374 285 H LEU 60 H LEU 60 64.830 33.635 -19.336 286 HA LEU 60 HA LEU 60 64.767 35.006 -16.700 287 HB2 LEU 60 HB2 LEU 60 64.076 32.067 -17.211 288 HB3 LEU 60 HB3 LEU 60 64.479 32.754 -15.657 289 HG LEU 60 HG LEU 60 62.448 34.418 -16.205 290 HD11 LEU 60 HD11 LEU 60 61.668 31.834 -17.648 291 HD12 LEU 60 HD12 LEU 60 60.594 33.202 -17.290 292 HD13 LEU 60 HD13 LEU 60 61.917 33.398 -18.441 293 HD21 LEU 60 HD21 LEU 60 62.611 32.956 -14.241 294 HD22 LEU 60 HD22 LEU 60 60.986 32.888 -14.933 295 HD23 LEU 60 HD23 LEU 60 62.126 31.553 -15.220 296 H ALA 61 H ALA 61 66.498 34.357 -15.290 297 HA ALA 61 HA ALA 61 68.598 32.641 -16.434 298 HB1 ALA 61 HB1 ALA 61 69.113 35.328 -15.110 299 HB2 ALA 61 HB2 ALA 61 70.352 34.145 -15.584 300 HB3 ALA 61 HB3 ALA 61 69.359 34.930 -16.824 301 H ALA 62 H ALA 62 69.194 31.068 -15.100 302 HA ALA 62 HA ALA 62 68.504 31.132 -12.219 303 HB1 ALA 62 HB1 ALA 62 69.750 28.949 -13.934 304 HB2 ALA 62 HB2 ALA 62 69.242 28.792 -12.242 305 HB3 ALA 62 HB3 ALA 62 68.031 29.088 -13.504 306 H LEU 63 H LEU 63 70.138 30.644 -10.613 307 HA LEU 63 HA LEU 63 72.875 31.664 -11.242 308 HB2 LEU 63 HB2 LEU 63 71.077 32.484 -8.924 309 HB3 LEU 63 HB3 LEU 63 72.764 32.947 -9.104 310 HG LEU 63 HG LEU 63 70.513 33.776 -10.992 311 HD11 LEU 63 HD11 LEU 63 72.073 35.348 -8.900 312 HD12 LEU 63 HD12 LEU 63 70.833 35.997 -9.996 313 HD13 LEU 63 HD13 LEU 63 70.383 34.819 -8.754 314 HD21 LEU 63 HD21 LEU 63 72.635 33.700 -12.202 315 HD22 LEU 63 HD22 LEU 63 72.235 35.386 -11.846 316 HD23 LEU 63 HD23 LEU 63 73.462 34.544 -10.882 317 H HIS 64 H HIS 64 74.515 31.111 -9.777 318 HA HIS 64 HA HIS 64 74.125 28.678 -8.108 319 HB2 HIS 64 HB2 HIS 64 76.491 30.345 -8.963 320 HB3 HIS 64 HB3 HIS 64 76.635 29.132 -7.699 321 HD2 HIS 64 HD2 HIS 64 76.937 29.586 -11.352 322 HE1 HIS 64 HE1 HIS 64 76.554 25.372 -10.856 323 HE2 HIS 64 HE2 HIS 64 77.210 27.209 -12.470 324 H ALA 65 H ALA 65 74.186 28.740 -5.862 325 HA ALA 65 HA ALA 65 73.622 31.404 -4.680 326 HB1 ALA 65 HB1 ALA 65 73.029 28.589 -3.693 327 HB2 ALA 65 HB2 ALA 65 72.438 30.106 -2.983 328 HB3 ALA 65 HB3 ALA 65 71.915 29.632 -4.610 329 H GLU 66 H GLU 66 76.178 29.062 -4.553 330 HA GLU 66 HA GLU 66 77.364 30.322 -2.119 331 HB2 GLU 66 HB2 GLU 66 76.973 27.335 -2.585 332 HB3 GLU 66 HB3 GLU 66 77.975 28.041 -1.315 333 HG2 GLU 66 HG2 GLU 66 75.957 29.211 -0.403 334 HG3 GLU 66 HG3 GLU 66 74.961 28.360 -1.590 335 H GLY 67 H GLY 67 79.647 29.773 -1.790 336 HA2 GLY 67 HA2 GLY 67 81.839 29.473 -2.464 337 HA3 GLY 67 HA3 GLY 67 81.241 28.566 -3.847 338 HA PRO 68 HA PRO 68 83.254 32.511 -5.293 339 HB2 PRO 68 HB2 PRO 68 84.622 31.496 -7.448 340 HB3 PRO 68 HB3 PRO 68 85.207 31.388 -5.760 341 HG2 PRO 68 HG2 PRO 68 83.680 29.285 -7.332 342 HG3 PRO 68 HG3 PRO 68 85.200 29.082 -6.400 343 HD2 PRO 68 HD2 PRO 68 82.805 28.449 -5.325 344 HD3 PRO 68 HD3 PRO 68 84.058 29.251 -4.328 345 H LEU 69 H LEU 69 81.062 30.287 -6.837 346 HA LEU 69 HA LEU 69 80.388 32.198 -8.999 347 HB2 LEU 69 HB2 LEU 69 79.472 29.371 -8.427 348 HB3 LEU 69 HB3 LEU 69 78.837 30.360 -9.737 349 HG LEU 69 HG LEU 69 81.766 29.592 -9.489 350 HD11 LEU 69 HD11 LEU 69 79.593 28.457 -11.283 351 HD12 LEU 69 HD12 LEU 69 81.307 27.984 -11.256 352 HD13 LEU 69 HD13 LEU 69 80.276 27.644 -9.860 353 HD21 LEU 69 HD21 LEU 69 81.501 31.631 -10.811 354 HD22 LEU 69 HD22 LEU 69 81.851 30.279 -11.886 355 HD23 LEU 69 HD23 LEU 69 80.190 30.884 -11.761 356 H ALA 70 H ALA 70 79.524 32.216 -5.789 357 HA ALA 70 HA ALA 70 76.707 32.208 -5.893 358 HB1 ALA 70 HB1 ALA 70 78.559 33.828 -4.086 359 HB2 ALA 70 HB2 ALA 70 76.840 33.496 -3.783 360 HB3 ALA 70 HB3 ALA 70 78.011 32.164 -3.801 361 H GLY 71 H GLY 71 75.395 33.343 -7.083 362 HA2 GLY 71 HA2 GLY 71 74.272 35.278 -7.854 363 HA3 GLY 71 HA3 GLY 71 75.683 36.272 -7.510 364 H LEU 72 H LEU 72 76.722 33.519 -9.211 365 HA LEU 72 HA LEU 72 76.698 34.914 -11.824 366 HB2 LEU 72 HB2 LEU 72 78.604 32.852 -10.612 367 HB3 LEU 72 HB3 LEU 72 78.652 33.322 -12.261 368 HG LEU 72 HG LEU 72 78.749 35.785 -11.361 369 HD11 LEU 72 HD11 LEU 72 79.977 34.338 -8.989 370 HD12 LEU 72 HD12 LEU 72 80.086 36.069 -9.332 371 HD13 LEU 72 HD13 LEU 72 78.529 35.359 -8.947 372 HD21 LEU 72 HD21 LEU 72 80.540 34.667 -12.652 373 HD22 LEU 72 HD22 LEU 72 81.213 35.679 -11.377 374 HD23 LEU 72 HD23 LEU 72 81.150 33.918 -11.163 375 HA PRO 73 HA PRO 73 73.921 32.256 -13.745 376 HB2 PRO 73 HB2 PRO 73 74.967 31.791 -16.273 377 HB3 PRO 73 HB3 PRO 73 74.298 33.355 -15.731 378 HG2 PRO 73 HG2 PRO 73 77.183 32.431 -15.808 379 HG3 PRO 73 HG3 PRO 73 76.519 34.001 -16.356 380 HD2 PRO 73 HD2 PRO 73 77.710 33.725 -13.983 381 HD3 PRO 73 HD3 PRO 73 76.294 34.792 -14.153 382 H VAL 74 H VAL 74 73.354 30.110 -14.658 383 HA VAL 74 HA VAL 74 75.385 28.013 -14.000 384 HB VAL 74 HB VAL 74 72.405 27.625 -14.300 385 HG11 VAL 74 HG11 VAL 74 74.589 25.922 -13.040 386 HG12 VAL 74 HG12 VAL 74 72.849 25.573 -13.001 387 HG13 VAL 74 HG13 VAL 74 73.704 25.562 -14.540 388 HG21 VAL 74 HG21 VAL 74 72.753 29.149 -12.405 389 HG22 VAL 74 HG22 VAL 74 72.332 27.543 -11.822 390 HG23 VAL 74 HG23 VAL 74 74.020 28.088 -11.757 391 H THR 75 H THR 75 73.259 29.139 -16.643 392 HA THR 75 HA THR 75 74.698 27.294 -18.519 393 HB THR 75 HB THR 75 72.755 27.087 -19.832 394 HG1 THR 75 HG1 THR 75 70.794 28.192 -19.020 395 HG21 THR 75 HG21 THR 75 71.776 26.897 -16.968 396 HG22 THR 75 HG22 THR 75 71.233 25.962 -18.381 397 HG23 THR 75 HG23 THR 75 72.871 25.723 -17.735 398 H ARG 76 H ARG 76 74.619 27.939 -20.849 399 HA ARG 76 HA ARG 76 75.850 30.497 -21.337 400 HB2 ARG 76 HB2 ARG 76 76.120 28.391 -22.671 401 HB3 ARG 76 HB3 ARG 76 74.457 28.537 -23.234 402 HG2 ARG 76 HG2 ARG 76 75.041 30.629 -24.440 403 HG3 ARG 76 HG3 ARG 76 76.709 30.516 -23.831 404 HD2 ARG 76 HD2 ARG 76 77.003 28.349 -24.960 405 HD3 ARG 76 HD3 ARG 76 75.314 28.356 -25.470 406 HE ARG 76 HE ARG 76 77.337 30.391 -26.420 407 HH11 ARG 76 HH11 ARG 76 74.815 28.091 -27.316 408 HH12 ARG 76 HH12 ARG 76 74.964 28.499 -29.001 409 HH21 ARG 76 HH21 ARG 76 77.497 30.798 -28.473 410 HH22 ARG 76 HH22 ARG 76 76.447 30.037 -29.657 411 H SER 77 H SER 77 72.508 29.368 -21.688 412 HA SER 77 HA SER 77 71.366 31.815 -22.673 413 HB2 SER 77 HB2 SER 77 70.251 29.580 -22.698 414 HB3 SER 77 HB3 SER 77 70.039 29.698 -20.940 415 HG SER 77 HG SER 77 68.193 30.452 -22.151 416 H ASP 78 H ASP 78 71.760 30.566 -19.259 417 HA ASP 78 HA ASP 78 70.653 32.847 -17.979 418 HB2 ASP 78 HB2 ASP 78 72.993 31.157 -17.042 419 HB3 ASP 78 HB3 ASP 78 72.079 32.283 -16.050 420 H ALA 79 H ALA 79 74.123 32.243 -18.872 421 HA ALA 79 HA ALA 79 75.096 34.718 -17.927 422 HB1 ALA 79 HB1 ALA 79 76.111 32.903 -20.167 423 HB2 ALA 79 HB2 ALA 79 77.044 34.180 -19.364 424 HB3 ALA 79 HB3 ALA 79 76.518 32.763 -18.440 425 H ARG 80 H ARG 80 73.859 33.965 -21.248 426 HA ARG 80 HA ARG 80 74.363 36.628 -22.249 427 HB2 ARG 80 HB2 ARG 80 74.024 34.551 -23.624 428 HB3 ARG 80 HB3 ARG 80 72.297 34.615 -23.234 429 HG2 ARG 80 HG2 ARG 80 72.143 36.851 -24.330 430 HG3 ARG 80 HG3 ARG 80 73.887 36.831 -24.625 431 HD2 ARG 80 HD2 ARG 80 72.754 36.226 -26.679 432 HD3 ARG 80 HD3 ARG 80 73.621 34.828 -26.065 433 HE ARG 80 HE ARG 80 71.627 33.704 -25.703 434 HH11 ARG 80 HH11 ARG 80 70.784 37.020 -26.501 435 HH12 ARG 80 HH12 ARG 80 69.092 36.644 -26.647 436 HH21 ARG 80 HH21 ARG 80 69.454 33.306 -25.893 437 HH22 ARG 80 HH22 ARG 80 68.365 34.590 -26.318 438 H VAL 81 H VAL 81 71.424 35.223 -20.745 439 HA VAL 81 HA VAL 81 69.786 37.587 -21.009 440 HB VAL 81 HB VAL 81 69.705 35.289 -19.018 441 HG11 VAL 81 HG11 VAL 81 67.669 37.528 -19.458 442 HG12 VAL 81 HG12 VAL 81 67.340 36.028 -18.569 443 HG13 VAL 81 HG13 VAL 81 68.532 37.166 -17.946 444 HG21 VAL 81 HG21 VAL 81 69.243 34.756 -21.407 445 HG22 VAL 81 HG22 VAL 81 67.841 34.519 -20.360 446 HG23 VAL 81 HG23 VAL 81 67.945 35.961 -21.409 447 H LEU 82 H LEU 82 71.935 36.488 -18.364 448 HA LEU 82 HA LEU 82 71.513 38.770 -16.677 449 HB2 LEU 82 HB2 LEU 82 73.938 36.966 -16.999 450 HB3 LEU 82 HB3 LEU 82 73.850 38.254 -15.803 451 HG LEU 82 HG LEU 82 71.999 35.845 -15.901 452 HD11 LEU 82 HD11 LEU 82 74.115 36.596 -13.851 453 HD12 LEU 82 HD12 LEU 82 73.239 35.054 -14.031 454 HD13 LEU 82 HD13 LEU 82 74.438 35.542 -15.239 455 HD21 LEU 82 HD21 LEU 82 70.774 37.716 -14.921 456 HD22 LEU 82 HD22 LEU 82 71.265 36.595 -13.655 457 HD23 LEU 82 HD23 LEU 82 72.162 38.112 -13.879 458 H ILE 83 H ILE 83 74.065 38.328 -19.219 459 HA ILE 83 HA ILE 83 75.203 40.919 -19.013 460 HB ILE 83 HB ILE 83 74.817 39.069 -21.383 461 HG12 ILE 83 HG12 ILE 83 77.346 39.957 -19.916 462 HG13 ILE 83 HG13 ILE 83 76.416 38.538 -19.452 463 HG21 ILE 83 HG21 ILE 83 76.293 41.748 -21.406 464 HG22 ILE 83 HG22 ILE 83 76.380 40.523 -22.684 465 HG23 ILE 83 HG23 ILE 83 74.865 41.340 -22.376 466 HD11 ILE 83 HD11 ILE 83 77.877 38.944 -22.086 467 HD12 ILE 83 HD12 ILE 83 78.224 37.774 -20.803 468 HD13 ILE 83 HD13 ILE 83 76.745 37.606 -21.767 469 H PHE 84 H PHE 84 72.380 39.908 -21.027 470 HA PHE 84 HA PHE 84 71.884 42.491 -22.037 471 HB2 PHE 84 HB2 PHE 84 70.981 40.234 -22.845 472 HB3 PHE 84 HB3 PHE 84 69.797 40.331 -21.560 473 HD1 PHE 84 HD1 PHE 84 71.155 42.838 -24.068 474 HD2 PHE 84 HD2 PHE 84 67.675 40.850 -22.463 475 HE1 PHE 84 HE1 PHE 84 69.762 43.991 -25.709 476 HE2 PHE 84 HE2 PHE 84 66.247 42.090 -24.072 477 HZ PHE 84 HZ PHE 84 67.278 43.652 -25.713 478 H ASN 85 H ASN 85 70.273 40.912 -19.208 479 HA ASN 85 HA ASN 85 68.575 43.171 -18.739 480 HB2 ASN 85 HB2 ASN 85 68.027 40.847 -18.096 481 HB3 ASN 85 HB3 ASN 85 69.348 40.852 -16.919 482 HD21 ASN 85 HD22 ASN 85 66.335 42.666 -17.780 483 HD22 ASN 85 HD21 ASN 85 65.941 43.030 -16.110 484 H GLU 86 H GLU 86 71.704 42.211 -17.203 485 HA GLU 86 HA GLU 86 71.816 44.438 -15.368 486 HB2 GLU 86 HB2 GLU 86 73.977 42.758 -16.699 487 HB3 GLU 86 HB3 GLU 86 74.367 44.147 -15.713 488 HG2 GLU 86 HG2 GLU 86 72.726 41.790 -14.713 489 HG3 GLU 86 HG3 GLU 86 74.461 41.984 -14.474 490 H TRP 87 H TRP 87 73.151 44.082 -18.776 491 HA TRP 87 HA TRP 87 74.062 46.755 -18.910 492 HB2 TRP 87 HB2 TRP 87 74.724 45.180 -20.577 493 HB3 TRP 87 HB3 TRP 87 73.056 44.849 -21.020 494 HD1 TRP 87 HD1 TRP 87 75.605 47.753 -21.323 495 HE1 TRP 87 HE1 TRP 87 75.082 49.011 -23.495 496 HE3 TRP 87 HE3 TRP 87 71.290 45.333 -22.634 497 HZ2 TRP 87 HZ2 TRP 87 73.148 48.863 -25.615 498 HZ3 TRP 87 HZ3 TRP 87 70.234 45.816 -24.780 499 HH2 TRP 87 HH2 TRP 87 71.106 47.593 -26.293 500 H GLU 88 H GLU 88 70.750 45.502 -19.775 501 HA GLU 88 HA GLU 88 69.694 47.966 -20.642 502 HB2 GLU 88 HB2 GLU 88 68.444 45.556 -19.289 503 HB3 GLU 88 HB3 GLU 88 67.503 46.980 -19.704 504 HG2 GLU 88 HG2 GLU 88 68.155 46.783 -22.068 505 HG3 GLU 88 HG3 GLU 88 69.014 45.289 -21.721 506 H GLU 89 H GLU 89 69.633 46.712 -17.196 507 HA GLU 89 HA GLU 89 68.354 49.156 -16.264 508 HB2 GLU 89 HB2 GLU 89 69.924 47.045 -14.732 509 HB3 GLU 89 HB3 GLU 89 69.025 48.384 -14.002 510 HG2 GLU 89 HG2 GLU 89 66.962 47.545 -15.238 511 HG3 GLU 89 HG3 GLU 89 67.876 46.087 -15.627 512 H ARG 90 H ARG 90 71.758 48.098 -16.284 513 HA ARG 90 HA ARG 90 72.885 50.400 -14.964 514 HB2 ARG 90 HB2 ARG 90 74.090 48.586 -17.082 515 HB3 ARG 90 HB3 ARG 90 75.014 49.680 -16.046 516 HG2 ARG 90 HG2 ARG 90 73.274 47.520 -14.856 517 HG3 ARG 90 HG3 ARG 90 74.850 47.129 -15.537 518 HD2 ARG 90 HD2 ARG 90 75.917 48.661 -13.921 519 HD3 ARG 90 HD3 ARG 90 74.314 49.068 -13.254 520 HE ARG 90 HE ARG 90 74.536 46.236 -13.232 521 HH11 ARG 90 HH11 ARG 90 76.143 48.840 -11.496 522 HH12 ARG 90 HH12 ARG 90 76.487 47.794 -10.144 523 HH21 ARG 90 HH21 ARG 90 74.954 45.056 -11.643 524 HH22 ARG 90 HH22 ARG 90 75.814 45.623 -10.203 525 H LYS 91 H LYS 91 72.352 49.704 -18.401 526 HA LYS 91 HA LYS 91 73.239 52.230 -19.431 527 HB2 LYS 91 HB2 LYS 91 72.907 50.198 -20.866 528 HB3 LYS 91 HB3 LYS 91 71.185 50.220 -20.494 529 HG2 LYS 91 HG2 LYS 91 71.318 50.908 -22.672 530 HG3 LYS 91 HG3 LYS 91 70.981 52.382 -21.776 531 HD2 LYS 91 HD2 LYS 91 73.423 52.947 -21.900 532 HD3 LYS 91 HD3 LYS 91 73.700 51.502 -22.872 533 HE2 LYS 91 HE2 LYS 91 71.826 53.798 -23.634 534 HE3 LYS 91 HE3 LYS 91 73.500 53.660 -24.174 535 HZ1 LYS 91 HZ1 LYS 91 71.354 51.696 -24.833 536 HZ2 LYS 91 HZ2 LYS 91 71.988 52.798 -25.848 537 HZ3 LYS 91 HZ3 LYS 91 72.926 51.580 -25.308 538 H LYS 92 H LYS 92 69.951 51.262 -18.304 539 HA LYS 92 HA LYS 92 68.736 53.820 -18.891 540 HB2 LYS 92 HB2 LYS 92 68.091 51.647 -16.870 541 HB3 LYS 92 HB3 LYS 92 67.172 53.151 -16.963 542 HG2 LYS 92 HG2 LYS 92 66.507 52.730 -19.246 543 HG3 LYS 92 HG3 LYS 92 67.612 51.374 -19.394 544 HD2 LYS 92 HD2 LYS 92 65.368 50.512 -19.131 545 HD3 LYS 92 HD3 LYS 92 66.343 50.083 -17.735 546 HE2 LYS 92 HE2 LYS 92 64.188 50.694 -16.922 547 HE3 LYS 92 HE3 LYS 92 65.299 51.972 -16.441 548 HZ1 LYS 92 HZ1 LYS 92 63.440 52.102 -18.777 549 HZ2 LYS 92 HZ2 LYS 92 63.204 52.853 -17.352 550 HZ3 LYS 92 HZ3 LYS 92 64.434 53.319 -18.314 551 H SER 93 H SER 93 70.755 52.792 -16.115 552 HA SER 93 HA SER 93 70.722 55.528 -15.013 553 HB2 SER 93 HB2 SER 93 72.507 53.160 -14.383 554 HB3 SER 93 HB3 SER 93 72.504 54.709 -13.524 555 HG SER 93 HG SER 93 71.159 53.143 -12.488 556 H GLU 94 H GLU 94 72.644 53.948 -17.444 557 HA GLU 94 HA GLU 94 74.641 56.172 -17.594 558 HB2 GLU 94 HB2 GLU 94 75.186 53.180 -17.833 559 HB3 GLU 94 HB3 GLU 94 76.350 54.488 -17.967 560 HG2 GLU 94 HG2 GLU 94 75.786 55.105 -15.573 561 HG3 GLU 94 HG3 GLU 94 74.800 53.635 -15.520 562 HA PRO 95 HA PRO 95 72.485 55.309 -21.608 563 HB2 PRO 95 HB2 PRO 95 72.482 57.895 -22.662 564 HB3 PRO 95 HB3 PRO 95 71.272 57.212 -21.539 565 HG2 PRO 95 HG2 PRO 95 73.726 58.863 -20.857 566 HG3 PRO 95 HG3 PRO 95 72.038 59.098 -20.294 567 HD2 PRO 95 HD2 PRO 95 73.801 57.818 -18.735 568 HD3 PRO 95 HD3 PRO 95 72.146 57.169 -18.897 569 H TRP 96 H TRP 96 75.657 55.712 -21.106 570 HA TRP 96 HA TRP 96 76.514 55.756 -23.964 571 HB2 TRP 96 HB2 TRP 96 78.765 56.142 -22.955 572 HB3 TRP 96 HB3 TRP 96 77.592 57.398 -22.608 573 HD1 TRP 96 HD1 TRP 96 79.486 54.547 -20.883 574 HE1 TRP 96 HE1 TRP 96 79.422 54.882 -18.333 575 HE3 TRP 96 HE3 TRP 96 76.283 58.543 -20.664 576 HZ2 TRP 96 HZ2 TRP 96 78.140 56.643 -16.446 577 HZ3 TRP 96 HZ3 TRP 96 75.658 59.529 -18.469 578 HH2 TRP 96 HH2 TRP 96 76.569 58.585 -16.360 579 H LEU 97 H LEU 97 75.783 53.424 -21.541 580 HA LEU 97 HA LEU 97 78.052 51.895 -21.501 581 HB2 LEU 97 HB2 LEU 97 75.913 51.911 -20.016 582 HB3 LEU 97 HB3 LEU 97 75.248 50.781 -21.168 583 HG LEU 97 HG LEU 97 77.148 49.260 -20.700 584 HD11 LEU 97 HD11 LEU 97 77.835 51.272 -18.515 585 HD12 LEU 97 HD12 LEU 97 78.471 49.617 -18.599 586 HD13 LEU 97 HD13 LEU 97 78.890 50.775 -19.858 587 HD21 LEU 97 HD21 LEU 97 74.956 49.107 -19.498 588 HD22 LEU 97 HD22 LEU 97 76.306 48.557 -18.485 589 HD23 LEU 97 HD23 LEU 97 75.608 50.180 -18.247 590 H ARG 98 H ARG 98 78.944 50.219 -22.537 591 HA ARG 98 HA ARG 98 77.961 49.416 -25.199 592 HB2 ARG 98 HB2 ARG 98 80.504 48.796 -23.649 593 HB3 ARG 98 HB3 ARG 98 80.175 48.238 -25.292 594 HG2 ARG 98 HG2 ARG 98 80.083 50.547 -26.126 595 HG3 ARG 98 HG3 ARG 98 80.259 51.183 -24.487 596 HD2 ARG 98 HD2 ARG 98 82.387 51.343 -25.580 597 HD3 ARG 98 HD3 ARG 98 82.483 50.130 -24.293 598 HE ARG 98 HE ARG 98 81.854 48.994 -26.917 599 HH11 ARG 98 HH11 ARG 98 84.572 50.061 -24.975 600 HH12 ARG 98 HH12 ARG 98 85.698 49.029 -25.814 601 HH21 ARG 98 HH21 ARG 98 83.342 47.688 -27.937 602 HH22 ARG 98 HH22 ARG 98 85.012 47.731 -27.456 603 H LEU 99 H LEU 99 77.887 47.248 -25.913 604 HA LEU 99 HA LEU 99 77.089 45.169 -23.933 605 HB2 LEU 99 HB2 LEU 99 75.204 46.537 -24.685 606 HB3 LEU 99 HB3 LEU 99 75.537 46.205 -26.351 607 HG LEU 99 HG LEU 99 73.565 45.044 -25.350 608 HD11 LEU 99 HD11 LEU 99 75.538 42.957 -26.284 609 HD12 LEU 99 HD12 LEU 99 73.804 43.124 -26.645 610 HD13 LEU 99 HD13 LEU 99 74.949 44.229 -27.369 611 HD21 LEU 99 HD21 LEU 99 74.789 44.595 -23.138 612 HD22 LEU 99 HD22 LEU 99 73.531 43.537 -23.742 613 HD23 LEU 99 HD23 LEU 99 75.267 43.077 -23.923 614 H ASP 100 H ASP 100 77.929 43.174 -24.466 615 HA ASP 100 HA ASP 100 78.482 42.470 -27.280 616 HB2 ASP 100 HB2 ASP 100 80.573 43.510 -26.447 617 HB3 ASP 100 HB3 ASP 100 80.605 42.364 -25.104 618 H MET 101 H MET 101 78.137 40.348 -27.709 619 HA MET 101 HA MET 101 77.576 38.458 -25.455 620 HB2 MET 101 HB2 MET 101 75.782 39.052 -27.841 621 HB3 MET 101 HB3 MET 101 75.530 37.735 -26.689 622 HG2 MET 101 HG2 MET 101 75.329 39.358 -24.842 623 HG3 MET 101 HG3 MET 101 75.530 40.688 -25.990 624 HE1 MET 101 HE1 MET 101 73.187 41.845 -25.154 625 HE2 MET 101 HE2 MET 101 71.733 40.847 -24.980 626 HE3 MET 101 HE3 MET 101 73.155 40.513 -23.967 627 H SER 102 H SER 102 79.536 38.812 -28.095 628 HA SER 102 HA SER 102 79.375 36.244 -29.376 629 HB2 SER 102 HB2 SER 102 81.739 38.113 -28.946 630 HB3 SER 102 HB3 SER 102 81.754 36.678 -29.991 631 HG SER 102 HG SER 102 81.265 38.637 -31.148 632 H ASP 103 H ASP 103 80.488 34.289 -28.953 633 HA ASP 103 HA ASP 103 80.192 33.591 -26.296 634 HB2 ASP 103 HB2 ASP 103 81.540 32.115 -28.567 635 HB3 ASP 103 HB3 ASP 103 81.311 31.402 -26.971 636 H LYS 104 H LYS 104 83.227 34.648 -27.731 637 HA LYS 104 HA LYS 104 85.063 33.811 -25.712 638 HB2 LYS 104 HB2 LYS 104 85.009 36.332 -27.432 639 HB3 LYS 104 HB3 LYS 104 86.368 35.841 -26.416 640 HG2 LYS 104 HG2 LYS 104 86.559 33.706 -27.667 641 HG3 LYS 104 HG3 LYS 104 85.235 34.214 -28.733 642 HD2 LYS 104 HD2 LYS 104 86.565 36.187 -29.449 643 HD3 LYS 104 HD3 LYS 104 87.894 35.674 -28.386 644 HE2 LYS 104 HE2 LYS 104 88.064 33.530 -29.644 645 HE3 LYS 104 HE3 LYS 104 86.747 34.045 -30.705 646 HZ1 LYS 104 HZ1 LYS 104 89.375 35.431 -30.456 647 HZ2 LYS 104 HZ2 LYS 104 88.919 34.493 -31.710 648 HZ3 LYS 104 HZ3 LYS 104 88.156 35.908 -31.438 649 H ALA 105 H ALA 105 82.801 36.568 -25.689 650 HA ALA 105 HA ALA 105 83.663 37.750 -23.203 651 HB1 ALA 105 HB1 ALA 105 80.899 37.725 -24.470 652 HB2 ALA 105 HB2 ALA 105 81.500 38.847 -23.238 653 HB3 ALA 105 HB3 ALA 105 82.200 38.868 -24.867 654 H ILE 106 H ILE 106 81.586 34.996 -23.943 655 HA ILE 106 HA ILE 106 80.527 34.828 -21.237 656 HB ILE 106 HB ILE 106 80.348 32.655 -23.341 657 HG12 ILE 106 HG12 ILE 106 79.701 34.534 -24.612 658 HG13 ILE 106 HG13 ILE 106 78.222 33.732 -24.127 659 HG21 ILE 106 HG21 ILE 106 78.443 33.567 -21.149 660 HG22 ILE 106 HG22 ILE 106 78.185 32.209 -22.262 661 HG23 ILE 106 HG23 ILE 106 79.499 32.137 -21.079 662 HD11 ILE 106 HD11 ILE 106 79.403 36.341 -23.061 663 HD12 ILE 106 HD12 ILE 106 77.986 36.121 -24.086 664 HD13 ILE 106 HD13 ILE 106 77.936 35.554 -22.396 665 H PHE 107 H PHE 107 82.931 32.964 -23.166 666 HA PHE 107 HA PHE 107 83.757 31.174 -21.113 667 HB2 PHE 107 HB2 PHE 107 85.586 32.488 -23.151 668 HB3 PHE 107 HB3 PHE 107 85.801 30.927 -22.386 669 HD1 PHE 107 HD2 PHE 107 82.783 29.988 -22.939 670 HD2 PHE 107 HD1 PHE 107 85.927 31.721 -25.329 671 HE1 PHE 107 HE2 PHE 107 81.860 28.881 -24.955 672 HE2 PHE 107 HE1 PHE 107 84.991 30.612 -27.356 673 HZ PHE 107 HZ PHE 107 82.961 29.184 -27.163 674 H ARG 108 H ARG 108 84.965 34.474 -21.898 675 HA ARG 108 HA ARG 108 86.992 34.459 -19.886 676 HB2 ARG 108 HB2 ARG 108 86.890 35.615 -22.114 677 HB3 ARG 108 HB3 ARG 108 85.798 36.816 -21.422 678 HG2 ARG 108 HG2 ARG 108 88.521 36.192 -20.219 679 HG3 ARG 108 HG3 ARG 108 88.360 37.249 -21.617 680 HD2 ARG 108 HD2 ARG 108 86.933 38.810 -20.337 681 HD3 ARG 108 HD3 ARG 108 87.022 37.760 -18.930 682 HE ARG 108 HE ARG 108 89.183 38.430 -18.474 683 HH11 ARG 108 HH11 ARG 108 88.339 39.820 -21.592 684 HH12 ARG 108 HH12 ARG 108 89.746 40.846 -21.605 685 HH21 ARG 108 HH21 ARG 108 90.940 39.762 -18.567 686 HH22 ARG 108 HH22 ARG 108 91.176 40.812 -19.932 687 H ARG 109 H ARG 109 83.702 35.894 -19.878 688 HA ARG 109 HA ARG 109 83.904 36.995 -17.179 689 HB2 ARG 109 HB2 ARG 109 81.545 36.209 -18.939 690 HB3 ARG 109 HB3 ARG 109 81.359 36.895 -17.325 691 HG2 ARG 109 HG2 ARG 109 82.409 38.963 -17.945 692 HG3 ARG 109 HG3 ARG 109 82.880 38.337 -19.533 693 HD2 ARG 109 HD2 ARG 109 80.548 38.098 -20.199 694 HD3 ARG 109 HD3 ARG 109 79.979 38.565 -18.599 695 HE ARG 109 HE ARG 109 81.129 40.315 -20.702 696 HH11 ARG 109 HH11 ARG 109 79.966 40.218 -17.390 697 HH12 ARG 109 HH12 ARG 109 79.809 41.948 -17.302 698 HH21 ARG 109 HH21 ARG 109 80.903 42.513 -20.517 699 HH22 ARG 109 HH22 ARG 109 80.325 43.210 -19.036 700 H TYR 110 H TYR 110 82.779 33.879 -18.466 701 HA TYR 110 HA TYR 110 82.353 32.851 -15.693 702 HB2 TYR 110 HB2 TYR 110 80.731 32.236 -18.175 703 HB3 TYR 110 HB3 TYR 110 80.411 31.726 -16.532 704 HD1 TYR 110 HD1 TYR 110 80.271 33.736 -14.741 705 HD2 TYR 110 HD2 TYR 110 79.581 34.104 -18.981 706 HE1 TYR 110 HE1 TYR 110 79.089 35.906 -14.368 707 HE2 TYR 110 HE2 TYR 110 78.334 36.234 -18.597 708 HH TYR 110 HH TYR 110 77.954 37.672 -15.341 709 HA PRO 111 HA PRO 111 85.504 30.206 -17.820 710 HB2 PRO 111 HB2 PRO 111 87.176 29.759 -15.690 711 HB3 PRO 111 HB3 PRO 111 87.212 31.244 -16.687 712 HG2 PRO 111 HG2 PRO 111 85.771 30.814 -14.046 713 HG3 PRO 111 HG3 PRO 111 86.882 32.152 -14.493 714 HD2 PRO 111 HD2 PRO 111 84.205 32.448 -14.668 715 HD3 PRO 111 HD3 PRO 111 85.273 33.126 -15.936 716 H HIS 112 H HIS 112 83.271 29.600 -15.250 717 HA HIS 112 HA HIS 112 83.736 26.707 -15.095 718 HB2 HIS 112 HB2 HIS 112 81.909 26.696 -13.630 719 HB3 HIS 112 HB3 HIS 112 82.755 28.193 -13.265 720 HD2 HIS 112 HD2 HIS 112 79.394 26.913 -13.736 721 HE1 HIS 112 HE1 HIS 112 78.932 30.954 -14.970 722 HE2 HIS 112 HE2 HIS 112 77.727 28.940 -14.178 723 H LEU 113 H LEU 113 81.996 28.878 -17.213 724 HA LEU 113 HA LEU 113 79.980 26.980 -18.001 725 HB2 LEU 113 HB2 LEU 113 80.071 29.630 -17.580 726 HB3 LEU 113 HB3 LEU 113 80.518 29.679 -19.268 727 HG LEU 113 HG LEU 113 78.157 30.124 -18.836 728 HD11 LEU 113 HD11 LEU 113 78.370 27.439 -20.240 729 HD12 LEU 113 HD12 LEU 113 77.222 28.739 -20.539 730 HD13 LEU 113 HD13 LEU 113 78.924 28.969 -20.959 731 HD21 LEU 113 HD21 LEU 113 77.986 28.619 -16.817 732 HD22 LEU 113 HD22 LEU 113 76.632 28.588 -17.931 733 HD23 LEU 113 HD23 LEU 113 77.794 27.248 -17.929 734 H ARG 114 H ARG 114 82.990 28.195 -19.382 735 HA ARG 114 HA ARG 114 82.689 27.256 -22.075 736 HB2 ARG 114 HB2 ARG 114 85.105 27.452 -22.251 737 HB3 ARG 114 HB3 ARG 114 84.391 28.886 -21.526 738 HG2 ARG 114 HG2 ARG 114 85.136 28.260 -19.317 739 HG3 ARG 114 HG3 ARG 114 85.718 26.686 -19.876 740 HD2 ARG 114 HD2 ARG 114 86.817 29.359 -20.820 741 HD3 ARG 114 HD3 ARG 114 87.511 28.379 -19.517 742 HE ARG 114 HE ARG 114 87.271 26.699 -21.773 743 HH11 ARG 114 HH11 ARG 114 89.214 29.465 -20.846 744 HH12 ARG 114 HH12 ARG 114 90.537 28.989 -21.876 745 HH21 ARG 114 HH21 ARG 114 88.981 26.161 -23.065 746 HH22 ARG 114 HH22 ARG 114 90.402 27.160 -23.096 Start of MODEL 10 1 H1 MET 1 H1 MET 1 16.405 19.574 -22.567 2 H2 MET 1 H2 MET 1 16.149 17.968 -22.420 3 H3 MET 1 H3 MET 1 17.449 18.647 -21.704 4 HA MET 1 HA MET 1 15.760 18.153 -20.054 5 HB2 MET 1 HB2 MET 1 16.198 21.144 -20.530 6 HB3 MET 1 HB3 MET 1 15.376 20.486 -19.124 7 HG2 MET 1 HG2 MET 1 17.546 20.870 -18.394 8 HG3 MET 1 HG3 MET 1 17.400 19.131 -18.574 9 HE1 MET 1 HE1 MET 1 19.206 22.396 -19.564 10 HE2 MET 1 HE2 MET 1 20.063 21.991 -21.066 11 HE3 MET 1 HE3 MET 1 18.297 22.171 -21.077 12 H ARG 2 H ARG 2 13.677 18.581 -19.153 13 HA ARG 2 HA ARG 2 11.538 18.410 -21.082 14 HB2 ARG 2 HB2 ARG 2 10.109 18.061 -19.157 15 HB3 ARG 2 HB3 ARG 2 11.606 17.153 -18.979 16 HG2 ARG 2 HG2 ARG 2 12.419 19.234 -17.550 17 HG3 ARG 2 HG3 ARG 2 10.696 19.645 -17.485 18 HD2 ARG 2 HD2 ARG 2 10.186 17.483 -16.439 19 HD3 ARG 2 HD3 ARG 2 11.886 16.964 -16.655 20 HE ARG 2 HE ARG 2 11.298 19.403 -15.036 21 HH11 ARG 2 HH11 ARG 2 12.397 16.073 -14.956 22 HH12 ARG 2 HH12 ARG 2 13.101 16.257 -13.378 23 HH21 ARG 2 HH21 ARG 2 12.220 19.560 -13.033 24 HH22 ARG 2 HH22 ARG 2 12.988 18.179 -12.316 25 H GLY 3 H GLY 3 9.698 19.670 -21.325 26 HA2 GLY 3 HA2 GLY 3 9.030 22.117 -20.146 27 HA3 GLY 3 HA3 GLY 3 10.072 22.532 -21.505 28 H SER 4 H SER 4 6.915 22.042 -20.586 29 HA SER 4 HA SER 4 5.925 21.167 -23.258 30 HB2 SER 4 HB2 SER 4 3.893 20.518 -22.044 31 HB3 SER 4 HB3 SER 4 5.343 19.720 -21.414 32 HG SER 4 HG SER 4 4.003 20.549 -19.723 33 H HIS 5 H HIS 5 6.385 24.067 -21.762 34 HA HIS 5 HA HIS 5 3.936 25.329 -22.938 35 HB2 HIS 5 HB2 HIS 5 3.919 25.323 -20.473 36 HB3 HIS 5 HB3 HIS 5 5.489 26.128 -20.451 37 HD2 HIS 5 HD2 HIS 5 1.817 26.784 -21.578 38 HE1 HIS 5 HE1 HIS 5 3.653 30.594 -21.007 39 HE2 HIS 5 HE2 HIS 5 1.474 29.400 -21.561 40 H HIS 6 H HIS 6 4.124 27.307 -23.940 41 HA HIS 6 HA HIS 6 6.730 28.588 -24.375 42 HB2 HIS 6 HB2 HIS 6 6.607 28.460 -26.799 43 HB3 HIS 6 HB3 HIS 6 6.648 26.838 -26.130 44 HD2 HIS 6 HD2 HIS 6 4.469 29.194 -28.193 45 HE1 HIS 6 HE1 HIS 6 2.284 25.537 -27.936 46 HE2 HIS 6 HE2 HIS 6 2.389 27.821 -29.057 47 H HIS 7 H HIS 7 6.533 30.666 -25.484 48 HA HIS 7 HA HIS 7 3.829 31.821 -25.762 49 HB2 HIS 7 HB2 HIS 7 4.673 32.184 -23.367 50 HB3 HIS 7 HB3 HIS 7 5.913 33.229 -24.059 51 HD2 HIS 7 HD2 HIS 7 2.134 33.006 -23.383 52 HE1 HIS 7 HE1 HIS 7 2.832 36.962 -24.812 53 HE2 HIS 7 HE2 HIS 7 1.106 35.400 -23.784 54 H HIS 8 H HIS 8 3.768 33.769 -27.005 55 HA HIS 8 HA HIS 8 5.764 33.683 -29.159 56 HB2 HIS 8 HB2 HIS 8 4.089 34.963 -30.394 57 HB3 HIS 8 HB3 HIS 8 3.388 33.526 -29.661 58 HD2 HIS 8 HD2 HIS 8 3.289 37.369 -29.462 59 HE1 HIS 8 HE1 HIS 8 0.190 35.957 -26.890 60 HE2 HIS 8 HE2 HIS 8 1.208 38.024 -27.978 61 H HIS 9 H HIS 9 5.211 35.821 -26.462 62 HA HIS 9 HA HIS 9 6.348 38.153 -27.891 63 HB2 HIS 9 HB2 HIS 9 4.290 38.399 -26.548 64 HB3 HIS 9 HB3 HIS 9 5.198 37.957 -25.097 65 HD2 HIS 9 HD2 HIS 9 4.881 40.794 -27.713 66 HE1 HIS 9 HE1 HIS 9 7.165 42.374 -24.471 67 HE2 HIS 9 HE2 HIS 9 6.013 42.937 -26.671 68 H HIS 10 H HIS 10 8.279 39.027 -27.591 69 HA HIS 10 HA HIS 10 9.788 38.762 -25.132 70 HB2 HIS 10 HB2 HIS 10 10.527 36.702 -26.315 71 HB3 HIS 10 HB3 HIS 10 10.992 37.670 -27.713 72 HD2 HIS 10 HD2 HIS 10 13.554 37.943 -27.776 73 HE1 HIS 10 HE1 HIS 10 14.383 38.391 -23.613 74 HE2 HIS 10 HE2 HIS 10 15.409 38.343 -25.944 75 H GLY 11 H GLY 11 11.380 40.389 -24.926 76 HA2 GLY 11 HA2 GLY 11 12.721 41.883 -26.713 77 HA3 GLY 11 HA3 GLY 11 11.170 42.718 -26.738 78 H SER 28 H SER 28 13.573 43.938 -26.008 79 HA SER 28 HA SER 28 12.743 45.108 -23.462 80 HB2 SER 28 HB2 SER 28 14.265 43.308 -22.698 81 HB3 SER 28 HB3 SER 28 15.552 43.964 -23.729 82 HG SER 28 HG SER 28 15.607 44.692 -21.487 83 H VAL 29 H VAL 29 13.364 47.208 -23.241 84 HA VAL 29 HA VAL 29 15.184 48.468 -25.246 85 HB VAL 29 HB VAL 29 13.663 50.383 -25.481 86 HG11 VAL 29 HG11 VAL 29 12.293 47.784 -26.257 87 HG12 VAL 29 HG12 VAL 29 12.073 49.383 -26.994 88 HG13 VAL 29 HG13 VAL 29 13.629 48.551 -27.142 89 HG21 VAL 29 HG21 VAL 29 12.363 50.150 -23.367 90 HG22 VAL 29 HG22 VAL 29 11.326 50.268 -24.794 91 HG23 VAL 29 HG23 VAL 29 11.581 48.693 -24.022 92 H SER 30 H SER 30 15.130 47.754 -22.195 93 HA SER 30 HA SER 30 15.205 50.324 -20.855 94 HB2 SER 30 HB2 SER 30 15.796 47.532 -19.818 95 HB3 SER 30 HB3 SER 30 15.544 48.990 -18.834 96 HG SER 30 HG SER 30 13.616 47.734 -19.041 97 H PHE 31 H PHE 31 17.063 50.786 -22.576 98 HA PHE 31 HA PHE 31 19.723 50.489 -21.234 99 HB2 PHE 31 HB2 PHE 31 19.124 50.136 -24.196 100 HB3 PHE 31 HB3 PHE 31 20.711 50.052 -23.447 101 HD1 PHE 31 HD1 PHE 31 21.152 48.223 -21.676 102 HD2 PHE 31 HD2 PHE 31 17.773 48.167 -24.357 103 HE1 PHE 31 HE1 PHE 31 20.858 45.792 -21.259 104 HE2 PHE 31 HE2 PHE 31 17.476 45.739 -23.931 105 HZ PHE 31 HZ PHE 31 19.018 44.547 -22.383 106 H GLY 32 H GLY 32 21.384 51.943 -22.113 107 HA2 GLY 32 HA2 GLY 32 22.047 53.934 -23.290 108 HA3 GLY 32 HA3 GLY 32 20.416 54.570 -23.168 109 H ALA 33 H ALA 33 23.502 54.552 -21.821 110 HA ALA 33 HA ALA 33 22.801 56.524 -19.777 111 HB1 ALA 33 HB1 ALA 33 24.189 53.892 -19.067 112 HB2 ALA 33 HB2 ALA 33 24.010 55.280 -17.975 113 HB3 ALA 33 HB3 ALA 33 22.573 54.401 -18.529 114 HA PRO 34 HA PRO 34 26.772 58.025 -21.174 115 HB2 PRO 34 HB2 PRO 34 27.597 59.655 -19.141 116 HB3 PRO 34 HB3 PRO 34 26.210 60.040 -20.207 117 HG2 PRO 34 HG2 PRO 34 26.142 58.763 -17.452 118 HG3 PRO 34 HG3 PRO 34 25.169 60.141 -18.057 119 HD2 PRO 34 HD2 PRO 34 24.201 57.596 -18.031 120 HD3 PRO 34 HD3 PRO 34 23.800 58.726 -19.358 121 H SER 35 H SER 35 28.861 57.400 -21.196 122 HA SER 35 HA SER 35 30.105 55.999 -18.869 123 HB2 SER 35 HB2 SER 35 29.942 54.900 -21.699 124 HB3 SER 35 HB3 SER 35 30.931 54.228 -20.389 125 HG SER 35 HG SER 35 28.902 53.149 -20.611 126 HA PRO 36 HA PRO 36 32.862 59.084 -21.102 127 HB2 PRO 36 HB2 PRO 36 33.576 60.676 -18.991 128 HB3 PRO 36 HB3 PRO 36 32.067 60.897 -19.929 129 HG2 PRO 36 HG2 PRO 36 32.418 59.425 -17.294 130 HG3 PRO 36 HG3 PRO 36 31.192 60.663 -17.716 131 HD2 PRO 36 HD2 PRO 36 30.636 58.006 -17.853 132 HD3 PRO 36 HD3 PRO 36 29.991 59.151 -19.068 133 H LEU 37 H LEU 37 34.924 58.566 -21.459 134 HA LEU 37 HA LEU 37 36.791 57.798 -19.339 135 HB2 LEU 37 HB2 LEU 37 35.651 55.655 -19.872 136 HB3 LEU 37 HB3 LEU 37 36.012 55.878 -21.580 137 HG LEU 37 HG LEU 37 38.451 55.679 -21.087 138 HD11 LEU 37 HD11 LEU 37 37.516 55.039 -18.252 139 HD12 LEU 37 HD12 LEU 37 39.160 54.790 -18.879 140 HD13 LEU 37 HD13 LEU 37 38.519 56.426 -18.732 141 HD21 LEU 37 HD21 LEU 37 37.119 53.707 -21.730 142 HD22 LEU 37 HD22 LEU 37 38.425 53.271 -20.616 143 HD23 LEU 37 HD23 LEU 37 36.753 53.387 -20.019 144 H SER 38 H SER 38 38.804 58.530 -19.827 145 HA SER 38 HA SER 38 39.842 58.476 -22.560 146 HB2 SER 38 HB2 SER 38 38.724 60.693 -22.489 147 HB3 SER 38 HB3 SER 38 39.696 61.133 -21.072 148 HG SER 38 HG SER 38 40.608 61.875 -23.086 149 H SER 39 H SER 39 41.947 57.927 -22.505 150 HA SER 39 HA SER 39 43.808 58.883 -20.489 151 HB2 SER 39 HB2 SER 39 42.709 56.960 -19.301 152 HB3 SER 39 HB3 SER 39 43.299 55.878 -20.569 153 HG SER 39 HG SER 39 44.719 55.990 -18.732 154 H GLU 40 H GLU 40 44.600 59.743 -22.505 155 HA GLU 40 HA GLU 40 46.303 57.817 -24.043 156 HB2 GLU 40 HB2 GLU 40 45.569 58.759 -26.146 157 HB3 GLU 40 HB3 GLU 40 44.210 58.088 -25.254 158 HG2 GLU 40 HG2 GLU 40 43.494 60.348 -24.571 159 HG3 GLU 40 HG3 GLU 40 44.904 61.057 -25.360 160 H SER 41 H SER 41 46.300 60.846 -22.437 161 HA SER 41 HA SER 41 47.869 62.389 -24.244 162 HB2 SER 41 HB2 SER 41 46.520 63.318 -22.382 163 HB3 SER 41 HB3 SER 41 47.707 62.680 -21.226 164 HG SER 41 HG SER 41 48.094 64.899 -21.814 165 H GLU 42 H GLU 42 49.812 61.924 -24.947 166 HA GLU 42 HA GLU 42 51.877 61.052 -25.214 167 HB2 GLU 42 HB2 GLU 42 52.334 61.956 -22.355 168 HB3 GLU 42 HB3 GLU 42 53.578 61.566 -23.546 169 HG2 GLU 42 HG2 GLU 42 52.725 63.379 -25.028 170 HG3 GLU 42 HG3 GLU 42 51.570 63.842 -23.774 171 H ASP 43 H ASP 43 49.763 59.175 -24.096 172 HA ASP 43 HA ASP 43 51.108 57.395 -22.314 173 HB2 ASP 43 HB2 ASP 43 48.648 57.773 -22.439 174 HB3 ASP 43 HB3 ASP 43 48.619 56.924 -23.987 175 H GLU 44 H GLU 44 50.899 57.417 -25.729 176 HA GLU 44 HA GLU 44 52.752 55.084 -25.950 177 HB2 GLU 44 HB2 GLU 44 51.479 54.117 -27.768 178 HB3 GLU 44 HB3 GLU 44 50.487 54.246 -26.325 179 HG2 GLU 44 HG2 GLU 44 49.363 56.259 -27.244 180 HG3 GLU 44 HG3 GLU 44 50.382 56.184 -28.680 181 H ILE 45 H ILE 45 52.888 58.182 -26.337 182 HA ILE 45 HA ILE 45 53.473 58.400 -29.220 183 HB ILE 45 HB ILE 45 53.503 60.612 -27.154 184 HG12 ILE 45 HG12 ILE 45 51.271 59.661 -27.073 185 HG13 ILE 45 HG13 ILE 45 51.239 61.205 -27.889 186 HG21 ILE 45 HG21 ILE 45 53.297 60.622 -30.205 187 HG22 ILE 45 HG22 ILE 45 53.078 62.046 -29.167 188 HG23 ILE 45 HG23 ILE 45 54.641 61.235 -29.228 189 HD11 ILE 45 HD11 ILE 45 51.125 58.490 -29.282 190 HD12 ILE 45 HD12 ILE 45 49.759 59.570 -28.969 191 HD13 ILE 45 HD13 ILE 45 51.034 60.074 -30.086 192 H ASN 46 H ASN 46 55.210 56.803 -28.846 193 HA ASN 46 HA ASN 46 57.804 58.225 -28.796 194 HB2 ASN 46 HB2 ASN 46 57.450 57.393 -26.482 195 HB3 ASN 46 HB3 ASN 46 57.237 55.754 -27.091 196 HD21 ASN 46 HD22 ASN 46 59.105 56.128 -25.169 197 HD22 ASN 46 HD21 ASN 46 60.715 56.050 -25.871 198 H TYR 47 H TYR 47 58.921 57.678 -30.548 199 HA TYR 47 HA TYR 47 58.737 54.925 -31.679 200 HB2 TYR 47 HB2 TYR 47 57.268 56.658 -32.846 201 HB3 TYR 47 HB3 TYR 47 58.744 57.456 -33.355 202 HD1 TYR 47 HD1 TYR 47 57.091 54.063 -33.365 203 HD2 TYR 47 HD2 TYR 47 59.605 56.861 -35.484 204 HE1 TYR 47 HE1 TYR 47 57.129 52.538 -35.331 205 HE2 TYR 47 HE2 TYR 47 59.632 55.334 -37.456 206 HH TYR 47 HH TYR 47 57.896 52.193 -37.475 207 H MET 48 H MET 48 60.811 56.583 -30.024 208 HA MET 48 HA MET 48 63.088 56.547 -31.959 209 HB2 MET 48 HB2 MET 48 64.170 58.183 -30.603 210 HB3 MET 48 HB3 MET 48 62.549 58.716 -31.031 211 HG2 MET 48 HG2 MET 48 61.732 58.214 -28.789 212 HG3 MET 48 HG3 MET 48 63.264 57.453 -28.355 213 HE1 MET 48 HE1 MET 48 61.300 60.767 -28.980 214 HE2 MET 48 HE2 MET 48 62.556 62.015 -28.843 215 HE3 MET 48 HE3 MET 48 62.530 60.940 -30.254 216 H THR 49 H THR 49 61.953 54.389 -29.800 217 HA THR 49 HA THR 49 64.646 53.220 -29.410 218 HB THR 49 HB THR 49 64.413 54.479 -27.449 219 HG1 THR 49 HG1 THR 49 64.714 52.808 -25.984 220 HG21 THR 49 HG21 THR 49 61.877 52.988 -26.681 221 HG22 THR 49 HG22 THR 49 62.761 54.194 -25.733 222 HG23 THR 49 HG23 THR 49 61.953 54.674 -27.229 223 HA PRO 50 HA PRO 50 61.559 50.099 -30.828 224 HB2 PRO 50 HB2 PRO 50 62.962 49.082 -32.942 225 HB3 PRO 50 HB3 PRO 50 61.988 50.582 -33.050 226 HG2 PRO 50 HG2 PRO 50 64.976 50.334 -32.561 227 HG3 PRO 50 HG3 PRO 50 64.136 51.371 -33.759 228 HD2 PRO 50 HD2 PRO 50 64.943 52.324 -31.344 229 HD3 PRO 50 HD3 PRO 50 63.414 52.874 -32.092 230 HA PRO 51 HA PRO 51 63.623 46.788 -28.668 231 HB2 PRO 51 HB2 PRO 51 62.320 44.547 -29.531 232 HB3 PRO 51 HB3 PRO 51 61.536 45.802 -28.523 233 HG2 PRO 51 HG2 PRO 51 61.427 45.510 -31.546 234 HG3 PRO 51 HG3 PRO 51 60.058 45.731 -30.407 235 HD2 PRO 51 HD2 PRO 51 61.158 47.825 -31.756 236 HD3 PRO 51 HD3 PRO 51 60.588 48.009 -30.070 237 H GLU 52 H GLU 52 65.190 45.162 -28.834 238 HA GLU 52 HA GLU 52 66.353 44.650 -31.555 239 HB2 GLU 52 HB2 GLU 52 67.827 45.291 -28.976 240 HB3 GLU 52 HB3 GLU 52 68.576 44.862 -30.518 241 HG2 GLU 52 HG2 GLU 52 67.457 46.850 -31.573 242 HG3 GLU 52 HG3 GLU 52 66.910 47.344 -29.968 243 H GLN 53 H GLN 53 64.709 42.966 -29.428 244 HA GLN 53 HA GLN 53 66.310 40.468 -29.752 245 HB2 GLN 53 HB2 GLN 53 65.019 41.550 -27.226 246 HB3 GLN 53 HB3 GLN 53 65.287 39.829 -27.447 247 HG2 GLN 53 HG2 GLN 53 67.523 41.899 -27.582 248 HG3 GLN 53 HG3 GLN 53 67.061 41.010 -26.133 249 HE21 GLN 53 HE22 GLN 53 67.072 38.511 -26.336 250 HE22 GLN 53 HE21 GLN 53 68.378 37.848 -27.300 251 H GLU 54 H GLU 54 65.153 38.570 -29.920 252 HA GLU 54 HA GLU 54 62.246 38.483 -29.823 253 HB2 GLU 54 HB2 GLU 54 61.936 37.627 -32.054 254 HB3 GLU 54 HB3 GLU 54 62.601 39.244 -32.141 255 HG2 GLU 54 HG2 GLU 54 64.223 36.678 -32.502 256 HG3 GLU 54 HG3 GLU 54 63.500 37.592 -33.810 257 H ALA 55 H ALA 55 61.481 36.227 -30.179 258 HA ALA 55 HA ALA 55 61.403 34.097 -29.413 259 HB1 ALA 55 HB1 ALA 55 64.013 33.931 -30.952 260 HB2 ALA 55 HB2 ALA 55 62.900 32.590 -30.606 261 HB3 ALA 55 HB3 ALA 55 62.383 33.918 -31.663 262 H GLN 56 H GLN 56 62.195 35.612 -27.320 263 HA GLN 56 HA GLN 56 63.751 33.712 -25.678 264 HB2 GLN 56 HB2 GLN 56 65.352 35.447 -26.632 265 HB3 GLN 56 HB3 GLN 56 64.464 36.674 -25.733 266 HG2 GLN 56 HG2 GLN 56 65.008 35.385 -23.601 267 HG3 GLN 56 HG3 GLN 56 65.946 34.255 -24.577 268 HE21 GLN 56 HE22 GLN 56 65.703 37.734 -23.639 269 HE22 GLN 56 HE21 GLN 56 67.430 38.026 -23.794 270 HA PRO 57 HA PRO 57 59.853 35.810 -24.078 271 HB2 PRO 57 HB2 PRO 57 58.130 33.745 -23.826 272 HB3 PRO 57 HB3 PRO 57 58.548 34.455 -25.426 273 HG2 PRO 57 HG2 PRO 57 59.804 32.004 -24.127 274 HG3 PRO 57 HG3 PRO 57 59.056 32.122 -25.756 275 HD2 PRO 57 HD2 PRO 57 61.735 32.428 -25.396 276 HD3 PRO 57 HD3 PRO 57 60.833 33.414 -26.585 277 H GLY 58 H GLY 58 59.001 35.935 -21.968 278 HA2 GLY 58 HA2 GLY 58 58.897 35.713 -19.675 279 HA3 GLY 58 HA3 GLY 58 59.711 34.155 -19.786 280 H ALA 59 H ALA 59 62.122 35.010 -21.028 281 HA ALA 59 HA ALA 59 64.203 35.718 -20.593 282 HB1 ALA 59 HB1 ALA 59 62.877 38.174 -19.455 283 HB2 ALA 59 HB2 ALA 59 64.510 38.059 -20.143 284 HB3 ALA 59 HB3 ALA 59 63.091 37.845 -21.197 285 H LEU 60 H LEU 60 62.931 34.199 -18.447 286 HA LEU 60 HA LEU 60 64.293 34.930 -15.958 287 HB2 LEU 60 HB2 LEU 60 62.681 32.550 -16.908 288 HB3 LEU 60 HB3 LEU 60 63.734 32.377 -15.517 289 HG LEU 60 HG LEU 60 62.599 34.205 -14.335 290 HD11 LEU 60 HD11 LEU 60 60.674 34.208 -16.697 291 HD12 LEU 60 HD12 LEU 60 60.380 34.996 -15.131 292 HD13 LEU 60 HD13 LEU 60 61.701 35.559 -16.153 293 HD21 LEU 60 HD21 LEU 60 61.899 31.856 -14.040 294 HD22 LEU 60 HD22 LEU 60 60.528 32.961 -13.867 295 HD23 LEU 60 HD23 LEU 60 60.730 32.029 -15.368 296 H ALA 61 H ALA 61 66.004 33.841 -15.000 297 HA ALA 61 HA ALA 61 67.639 31.945 -16.508 298 HB1 ALA 61 HB1 ALA 61 68.667 34.658 -15.568 299 HB2 ALA 61 HB2 ALA 61 69.719 33.312 -16.048 300 HB3 ALA 61 HB3 ALA 61 68.615 34.024 -17.233 301 H ALA 62 H ALA 62 69.125 30.770 -15.246 302 HA ALA 62 HA ALA 62 68.548 30.707 -12.325 303 HB1 ALA 62 HB1 ALA 62 69.859 28.633 -14.118 304 HB2 ALA 62 HB2 ALA 62 69.487 28.448 -12.393 305 HB3 ALA 62 HB3 ALA 62 68.170 28.628 -13.566 306 H LEU 63 H LEU 63 70.169 30.629 -10.787 307 HA LEU 63 HA LEU 63 72.893 31.589 -11.551 308 HB2 LEU 63 HB2 LEU 63 71.177 32.563 -9.232 309 HB3 LEU 63 HB3 LEU 63 72.841 33.038 -9.543 310 HG LEU 63 HG LEU 63 70.456 33.692 -11.334 311 HD11 LEU 63 HD11 LEU 63 72.147 35.448 -9.507 312 HD12 LEU 63 HD12 LEU 63 70.794 35.979 -10.530 313 HD13 LEU 63 HD13 LEU 63 70.493 34.894 -9.164 314 HD21 LEU 63 HD21 LEU 63 72.429 33.578 -12.729 315 HD22 LEU 63 HD22 LEU 63 72.109 35.280 -12.396 316 HD23 LEU 63 HD23 LEU 63 73.403 34.448 -11.521 317 H HIS 64 H HIS 64 74.561 31.133 -10.025 318 HA HIS 64 HA HIS 64 74.254 28.676 -8.408 319 HB2 HIS 64 HB2 HIS 64 76.532 30.588 -8.960 320 HB3 HIS 64 HB3 HIS 64 76.674 29.246 -7.834 321 HD2 HIS 64 HD2 HIS 64 77.109 30.092 -11.442 322 HE1 HIS 64 HE1 HIS 64 77.178 25.826 -11.257 323 HE2 HIS 64 HE2 HIS 64 77.736 27.858 -12.684 324 H ALA 65 H ALA 65 74.104 28.601 -6.184 325 HA ALA 65 HA ALA 65 73.374 31.136 -4.843 326 HB1 ALA 65 HB1 ALA 65 72.952 28.231 -4.042 327 HB2 ALA 65 HB2 ALA 65 72.240 29.658 -3.261 328 HB3 ALA 65 HB3 ALA 65 71.788 29.251 -4.926 329 H GLU 66 H GLU 66 76.155 29.131 -4.898 330 HA GLU 66 HA GLU 66 77.233 30.316 -2.412 331 HB2 GLU 66 HB2 GLU 66 77.795 28.166 -1.438 332 HB3 GLU 66 HB3 GLU 66 76.057 28.305 -1.653 333 HG2 GLU 66 HG2 GLU 66 76.194 26.888 -3.702 334 HG3 GLU 66 HG3 GLU 66 77.939 26.746 -3.479 335 H GLY 67 H GLY 67 79.541 29.651 -2.023 336 HA2 GLY 67 HA2 GLY 67 81.739 29.383 -2.697 337 HA3 GLY 67 HA3 GLY 67 81.151 28.629 -4.176 338 HA PRO 68 HA PRO 68 83.184 32.719 -5.154 339 HB2 PRO 68 HB2 PRO 68 84.710 31.907 -7.289 340 HB3 PRO 68 HB3 PRO 68 85.196 31.688 -5.581 341 HG2 PRO 68 HG2 PRO 68 83.834 29.668 -7.396 342 HG3 PRO 68 HG3 PRO 68 85.301 29.436 -6.388 343 HD2 PRO 68 HD2 PRO 68 82.866 28.660 -5.513 344 HD3 PRO 68 HD3 PRO 68 84.032 29.416 -4.384 345 H LEU 69 H LEU 69 81.175 30.547 -6.994 346 HA LEU 69 HA LEU 69 80.583 32.571 -9.075 347 HB2 LEU 69 HB2 LEU 69 79.621 29.717 -8.712 348 HB3 LEU 69 HB3 LEU 69 79.179 30.760 -10.056 349 HG LEU 69 HG LEU 69 82.018 29.846 -9.465 350 HD11 LEU 69 HD11 LEU 69 80.061 28.947 -11.607 351 HD12 LEU 69 HD12 LEU 69 81.718 28.349 -11.348 352 HD13 LEU 69 HD13 LEU 69 80.467 28.025 -10.144 353 HD21 LEU 69 HD21 LEU 69 82.072 31.950 -10.693 354 HD22 LEU 69 HD22 LEU 69 82.462 30.630 -11.797 355 HD23 LEU 69 HD23 LEU 69 80.842 31.355 -11.843 356 H ALA 70 H ALA 70 79.503 32.362 -5.944 357 HA ALA 70 HA ALA 70 76.731 32.193 -6.151 358 HB1 ALA 70 HB1 ALA 70 78.380 33.938 -4.270 359 HB2 ALA 70 HB2 ALA 70 76.686 33.459 -4.028 360 HB3 ALA 70 HB3 ALA 70 77.963 32.231 -4.019 361 H GLY 71 H GLY 71 75.238 33.292 -7.092 362 HA2 GLY 71 HA2 GLY 71 73.972 35.086 -7.898 363 HA3 GLY 71 HA3 GLY 71 75.285 36.207 -7.544 364 H LEU 72 H LEU 72 76.568 33.612 -9.320 365 HA LEU 72 HA LEU 72 76.419 35.117 -11.887 366 HB2 LEU 72 HB2 LEU 72 78.466 33.043 -11.028 367 HB3 LEU 72 HB3 LEU 72 78.542 34.063 -12.430 368 HG LEU 72 HG LEU 72 78.887 34.926 -9.549 369 HD11 LEU 72 HD11 LEU 72 80.683 35.207 -11.996 370 HD12 LEU 72 HD12 LEU 72 81.091 35.595 -10.311 371 HD13 LEU 72 HD13 LEU 72 80.819 33.915 -10.794 372 HD21 LEU 72 HD21 LEU 72 77.612 36.737 -10.619 373 HD22 LEU 72 HD22 LEU 72 79.293 37.219 -10.409 374 HD23 LEU 72 HD23 LEU 72 78.712 36.720 -12.010 375 HA PRO 73 HA PRO 73 73.896 32.305 -13.772 376 HB2 PRO 73 HB2 PRO 73 74.582 32.266 -16.399 377 HB3 PRO 73 HB3 PRO 73 74.124 33.784 -15.557 378 HG2 PRO 73 HG2 PRO 73 76.899 32.700 -16.143 379 HG3 PRO 73 HG3 PRO 73 76.285 34.362 -16.409 380 HD2 PRO 73 HD2 PRO 73 77.714 33.598 -14.232 381 HD3 PRO 73 HD3 PRO 73 76.494 34.910 -14.164 382 H VAL 74 H VAL 74 73.334 30.217 -14.670 383 HA VAL 74 HA VAL 74 75.470 28.222 -14.202 384 HB VAL 74 HB VAL 74 72.501 27.744 -14.501 385 HG11 VAL 74 HG11 VAL 74 74.753 25.980 -13.456 386 HG12 VAL 74 HG12 VAL 74 73.019 25.607 -13.363 387 HG13 VAL 74 HG13 VAL 74 73.804 25.712 -14.936 388 HG21 VAL 74 HG21 VAL 74 72.954 29.145 -12.522 389 HG22 VAL 74 HG22 VAL 74 72.529 27.507 -12.035 390 HG23 VAL 74 HG23 VAL 74 74.229 28.025 -12.002 391 H THR 75 H THR 75 73.271 29.102 -16.918 392 HA THR 75 HA THR 75 74.931 27.361 -18.715 393 HB THR 75 HB THR 75 73.022 26.979 -20.064 394 HG1 THR 75 HG1 THR 75 70.973 27.925 -19.313 395 HG21 THR 75 HG21 THR 75 72.069 26.722 -17.196 396 HG22 THR 75 HG22 THR 75 71.626 25.720 -18.600 397 HG23 THR 75 HG23 THR 75 73.281 25.663 -17.951 398 H ARG 76 H ARG 76 74.670 27.960 -21.141 399 HA ARG 76 HA ARG 76 75.846 30.580 -21.555 400 HB2 ARG 76 HB2 ARG 76 74.619 28.576 -23.528 401 HB3 ARG 76 HB3 ARG 76 75.475 30.050 -24.004 402 HG2 ARG 76 HG2 ARG 76 77.516 29.279 -22.877 403 HG3 ARG 76 HG3 ARG 76 76.692 27.785 -22.373 404 HD2 ARG 76 HD2 ARG 76 76.376 27.171 -24.746 405 HD3 ARG 76 HD3 ARG 76 77.258 28.639 -25.231 406 HE ARG 76 HE ARG 76 78.903 27.241 -23.398 407 HH11 ARG 76 HH11 ARG 76 77.707 26.681 -26.645 408 HH12 ARG 76 HH12 ARG 76 79.059 25.668 -27.066 409 HH21 ARG 76 HH21 ARG 76 80.610 25.948 -24.002 410 HH22 ARG 76 HH22 ARG 76 80.657 25.272 -25.600 411 H SER 77 H SER 77 72.549 29.328 -22.026 412 HA SER 77 HA SER 77 71.306 31.740 -22.896 413 HB2 SER 77 HB2 SER 77 70.129 29.523 -21.171 414 HB3 SER 77 HB3 SER 77 69.226 30.730 -22.109 415 HG SER 77 HG SER 77 69.433 28.724 -23.242 416 H ASP 78 H ASP 78 71.841 30.474 -19.513 417 HA ASP 78 HA ASP 78 70.631 32.723 -18.218 418 HB2 ASP 78 HB2 ASP 78 72.941 31.002 -17.264 419 HB3 ASP 78 HB3 ASP 78 72.023 32.121 -16.266 420 H ALA 79 H ALA 79 74.090 32.182 -19.141 421 HA ALA 79 HA ALA 79 75.012 34.664 -18.124 422 HB1 ALA 79 HB1 ALA 79 76.133 32.901 -20.354 423 HB2 ALA 79 HB2 ALA 79 77.013 34.198 -19.528 424 HB3 ALA 79 HB3 ALA 79 76.508 32.765 -18.614 425 H ARG 80 H ARG 80 73.720 33.941 -21.403 426 HA ARG 80 HA ARG 80 74.126 36.630 -22.380 427 HB2 ARG 80 HB2 ARG 80 73.752 34.573 -23.773 428 HB3 ARG 80 HB3 ARG 80 72.045 34.596 -23.302 429 HG2 ARG 80 HG2 ARG 80 71.772 36.825 -24.345 430 HG3 ARG 80 HG3 ARG 80 73.512 36.891 -24.693 431 HD2 ARG 80 HD2 ARG 80 73.291 34.912 -26.163 432 HD3 ARG 80 HD3 ARG 80 71.540 34.875 -25.847 433 HE ARG 80 HE ARG 80 72.081 37.472 -26.745 434 HH11 ARG 80 HH11 ARG 80 72.391 34.280 -28.167 435 HH12 ARG 80 HH12 ARG 80 72.225 34.885 -29.790 436 HH21 ARG 80 HH21 ARG 80 71.859 38.178 -28.851 437 HH22 ARG 80 HH22 ARG 80 71.927 37.035 -30.156 438 H VAL 81 H VAL 81 71.295 35.141 -20.737 439 HA VAL 81 HA VAL 81 69.618 37.486 -20.795 440 HB VAL 81 HB VAL 81 69.775 35.185 -18.816 441 HG11 VAL 81 HG11 VAL 81 67.708 37.428 -18.981 442 HG12 VAL 81 HG12 VAL 81 67.485 35.920 -18.077 443 HG13 VAL 81 HG13 VAL 81 68.747 37.044 -17.588 444 HG21 VAL 81 HG21 VAL 81 68.994 34.674 -21.140 445 HG22 VAL 81 HG22 VAL 81 67.758 34.411 -19.899 446 HG23 VAL 81 HG23 VAL 81 67.694 35.860 -20.934 447 H LEU 82 H LEU 82 71.884 36.352 -18.226 448 HA LEU 82 HA LEU 82 71.549 38.662 -16.614 449 HB2 LEU 82 HB2 LEU 82 73.660 36.495 -16.799 450 HB3 LEU 82 HB3 LEU 82 73.999 37.920 -15.841 451 HG LEU 82 HG LEU 82 73.203 36.212 -14.405 452 HD11 LEU 82 HD11 LEU 82 70.897 38.178 -14.653 453 HD12 LEU 82 HD12 LEU 82 71.493 37.376 -13.200 454 HD13 LEU 82 HD13 LEU 82 72.492 38.612 -13.981 455 HD21 LEU 82 HD21 LEU 82 71.850 34.809 -15.796 456 HD22 LEU 82 HD22 LEU 82 70.871 35.365 -14.444 457 HD23 LEU 82 HD23 LEU 82 70.650 36.103 -16.041 458 H ILE 83 H ILE 83 73.983 38.159 -19.222 459 HA ILE 83 HA ILE 83 75.239 40.719 -18.982 460 HB ILE 83 HB ILE 83 74.756 38.860 -21.325 461 HG12 ILE 83 HG12 ILE 83 77.341 39.787 -19.983 462 HG13 ILE 83 HG13 ILE 83 76.430 38.387 -19.432 463 HG21 ILE 83 HG21 ILE 83 76.228 41.538 -21.454 464 HG22 ILE 83 HG22 ILE 83 76.273 40.284 -22.708 465 HG23 ILE 83 HG23 ILE 83 74.766 41.103 -22.364 466 HD11 ILE 83 HD11 ILE 83 77.756 38.684 -22.154 467 HD12 ILE 83 HD12 ILE 83 78.222 37.610 -20.828 468 HD13 ILE 83 HD13 ILE 83 76.695 37.332 -21.686 469 H PHE 84 H PHE 84 72.317 39.818 -20.923 470 HA PHE 84 HA PHE 84 71.860 42.449 -21.860 471 HB2 PHE 84 HB2 PHE 84 70.903 40.237 -22.711 472 HB3 PHE 84 HB3 PHE 84 69.744 40.313 -21.399 473 HD1 PHE 84 HD1 PHE 84 71.127 42.633 -24.056 474 HD2 PHE 84 HD2 PHE 84 67.614 41.178 -22.012 475 HE1 PHE 84 HE1 PHE 84 69.726 43.854 -25.640 476 HE2 PHE 84 HE2 PHE 84 66.193 42.536 -23.532 477 HZ PHE 84 HZ PHE 84 67.231 43.866 -25.361 478 H ASN 85 H ASN 85 70.426 40.828 -18.986 479 HA ASN 85 HA ASN 85 68.683 42.995 -18.316 480 HB2 ASN 85 HB2 ASN 85 68.443 40.590 -17.622 481 HB3 ASN 85 HB3 ASN 85 69.824 40.790 -16.540 482 HD21 ASN 85 HD22 ASN 85 68.260 40.093 -14.842 483 HD22 ASN 85 HD21 ASN 85 67.175 41.304 -14.182 484 H GLU 86 H GLU 86 71.956 42.118 -17.029 485 HA GLU 86 HA GLU 86 72.170 44.389 -15.265 486 HB2 GLU 86 HB2 GLU 86 74.248 42.637 -16.632 487 HB3 GLU 86 HB3 GLU 86 74.698 44.035 -15.673 488 HG2 GLU 86 HG2 GLU 86 73.046 41.711 -14.611 489 HG3 GLU 86 HG3 GLU 86 74.783 41.908 -14.390 490 H TRP 87 H TRP 87 73.335 43.961 -18.726 491 HA TRP 87 HA TRP 87 74.296 46.609 -18.941 492 HB2 TRP 87 HB2 TRP 87 74.824 44.973 -20.604 493 HB3 TRP 87 HB3 TRP 87 73.122 44.703 -20.965 494 HD1 TRP 87 HD1 TRP 87 75.737 47.541 -21.365 495 HE1 TRP 87 HE1 TRP 87 75.204 48.781 -23.550 496 HE3 TRP 87 HE3 TRP 87 71.380 45.167 -22.625 497 HZ2 TRP 87 HZ2 TRP 87 73.275 48.640 -25.651 498 HZ3 TRP 87 HZ3 TRP 87 70.316 45.655 -24.770 499 HH2 TRP 87 HH2 TRP 87 71.214 47.385 -26.314 500 H GLU 88 H GLU 88 70.920 45.421 -19.680 501 HA GLU 88 HA GLU 88 69.940 47.935 -20.497 502 HB2 GLU 88 HB2 GLU 88 68.646 45.484 -19.273 503 HB3 GLU 88 HB3 GLU 88 67.706 46.927 -19.595 504 HG2 GLU 88 HG2 GLU 88 69.337 45.582 -21.767 505 HG3 GLU 88 HG3 GLU 88 67.674 45.149 -21.400 506 H GLU 89 H GLU 89 69.954 46.633 -17.060 507 HA GLU 89 HA GLU 89 68.698 48.981 -16.026 508 HB2 GLU 89 HB2 GLU 89 68.804 46.662 -15.024 509 HB3 GLU 89 HB3 GLU 89 70.506 46.961 -14.620 510 HG2 GLU 89 HG2 GLU 89 69.826 48.935 -13.309 511 HG3 GLU 89 HG3 GLU 89 68.142 48.660 -13.780 512 H ARG 90 H ARG 90 72.145 47.981 -16.133 513 HA ARG 90 HA ARG 90 73.261 50.292 -14.828 514 HB2 ARG 90 HB2 ARG 90 74.447 48.496 -16.977 515 HB3 ARG 90 HB3 ARG 90 75.382 49.586 -15.948 516 HG2 ARG 90 HG2 ARG 90 73.671 47.380 -14.780 517 HG3 ARG 90 HG3 ARG 90 75.270 47.043 -15.441 518 HD2 ARG 90 HD2 ARG 90 76.267 48.581 -13.785 519 HD3 ARG 90 HD3 ARG 90 74.641 48.947 -13.149 520 HE ARG 90 HE ARG 90 74.901 46.127 -13.129 521 HH11 ARG 90 HH11 ARG 90 76.489 48.734 -11.373 522 HH12 ARG 90 HH12 ARG 90 76.839 47.679 -10.028 523 HH21 ARG 90 HH21 ARG 90 75.330 44.942 -11.544 524 HH22 ARG 90 HH22 ARG 90 76.184 45.509 -10.101 525 H LYS 91 H LYS 91 72.602 49.590 -18.239 526 HA LYS 91 HA LYS 91 73.449 52.160 -19.227 527 HB2 LYS 91 HB2 LYS 91 73.184 50.058 -20.623 528 HB3 LYS 91 HB3 LYS 91 71.432 50.259 -20.494 529 HG2 LYS 91 HG2 LYS 91 71.842 52.573 -21.660 530 HG3 LYS 91 HG3 LYS 91 73.468 51.956 -21.975 531 HD2 LYS 91 HD2 LYS 91 72.357 51.285 -23.911 532 HD3 LYS 91 HD3 LYS 91 72.154 49.842 -22.903 533 HE2 LYS 91 HE2 LYS 91 69.912 50.910 -22.130 534 HE3 LYS 91 HE3 LYS 91 70.151 52.075 -23.438 535 HZ1 LYS 91 HZ1 LYS 91 69.654 49.157 -23.632 536 HZ2 LYS 91 HZ2 LYS 91 68.839 50.359 -24.345 537 HZ3 LYS 91 HZ3 LYS 91 70.326 49.972 -24.915 538 H LYS 92 H LYS 92 70.216 51.087 -18.037 539 HA LYS 92 HA LYS 92 68.870 53.536 -18.666 540 HB2 LYS 92 HB2 LYS 92 67.823 51.390 -17.824 541 HB3 LYS 92 HB3 LYS 92 68.404 51.804 -16.201 542 HG2 LYS 92 HG2 LYS 92 67.096 53.891 -16.252 543 HG3 LYS 92 HG3 LYS 92 66.581 53.539 -17.915 544 HD2 LYS 92 HD2 LYS 92 65.443 51.474 -17.121 545 HD3 LYS 92 HD3 LYS 92 65.950 51.841 -15.455 546 HE2 LYS 92 HE2 LYS 92 64.702 53.990 -15.551 547 HE3 LYS 92 HE3 LYS 92 64.211 53.639 -17.212 548 HZ1 LYS 92 HZ1 LYS 92 63.457 52.007 -14.834 549 HZ2 LYS 92 HZ2 LYS 92 62.466 53.031 -15.629 550 HZ3 LYS 92 HZ3 LYS 92 63.002 51.683 -16.373 551 H SER 93 H SER 93 71.072 52.700 -15.960 552 HA SER 93 HA SER 93 71.103 55.494 -15.025 553 HB2 SER 93 HB2 SER 93 72.993 53.212 -14.388 554 HB3 SER 93 HB3 SER 93 72.979 54.804 -13.614 555 HG SER 93 HG SER 93 71.761 53.254 -12.413 556 H GLU 94 H GLU 94 72.950 53.762 -17.450 557 HA GLU 94 HA GLU 94 74.790 56.074 -17.925 558 HB2 GLU 94 HB2 GLU 94 75.487 53.106 -17.890 559 HB3 GLU 94 HB3 GLU 94 76.570 54.439 -18.260 560 HG2 GLU 94 HG2 GLU 94 76.173 55.317 -15.925 561 HG3 GLU 94 HG3 GLU 94 75.240 53.848 -15.602 562 HA PRO 95 HA PRO 95 72.465 54.735 -21.715 563 HB2 PRO 95 HB2 PRO 95 72.396 57.195 -23.045 564 HB3 PRO 95 HB3 PRO 95 71.213 56.601 -21.845 565 HG2 PRO 95 HG2 PRO 95 73.612 58.392 -21.374 566 HG3 PRO 95 HG3 PRO 95 71.930 58.608 -20.785 567 HD2 PRO 95 HD2 PRO 95 73.791 57.557 -19.163 568 HD3 PRO 95 HD3 PRO 95 72.163 56.824 -19.216 569 H TRP 96 H TRP 96 75.679 55.658 -21.471 570 HA TRP 96 HA TRP 96 76.403 55.325 -24.322 571 HB2 TRP 96 HB2 TRP 96 78.674 55.884 -23.438 572 HB3 TRP 96 HB3 TRP 96 77.461 57.114 -23.145 573 HD1 TRP 96 HD1 TRP 96 79.551 54.498 -21.280 574 HE1 TRP 96 HE1 TRP 96 79.554 55.024 -18.763 575 HE3 TRP 96 HE3 TRP 96 76.156 58.339 -21.243 576 HZ2 TRP 96 HZ2 TRP 96 78.236 56.852 -16.965 577 HZ3 TRP 96 HZ3 TRP 96 75.540 59.446 -19.105 578 HH2 TRP 96 HH2 TRP 96 76.563 58.708 -16.965 579 H LEU 97 H LEU 97 75.858 53.144 -21.721 580 HA LEU 97 HA LEU 97 78.188 51.681 -21.672 581 HB2 LEU 97 HB2 LEU 97 76.121 51.696 -20.109 582 HB3 LEU 97 HB3 LEU 97 75.404 50.552 -21.223 583 HG LEU 97 HG LEU 97 77.307 49.025 -20.804 584 HD11 LEU 97 HD11 LEU 97 78.105 51.066 -18.684 585 HD12 LEU 97 HD12 LEU 97 78.726 49.405 -18.771 586 HD13 LEU 97 HD13 LEU 97 79.093 50.540 -20.066 587 HD21 LEU 97 HD21 LEU 97 75.170 48.903 -19.504 588 HD22 LEU 97 HD22 LEU 97 76.561 48.357 -18.545 589 HD23 LEU 97 HD23 LEU 97 75.883 49.984 -18.293 590 H ARG 98 H ARG 98 79.078 49.967 -22.714 591 HA ARG 98 HA ARG 98 77.962 49.153 -25.327 592 HB2 ARG 98 HB2 ARG 98 80.588 48.369 -24.005 593 HB3 ARG 98 HB3 ARG 98 80.139 48.122 -25.689 594 HG2 ARG 98 HG2 ARG 98 80.734 50.777 -24.318 595 HG3 ARG 98 HG3 ARG 98 81.675 49.950 -25.555 596 HD2 ARG 98 HD2 ARG 98 79.592 50.212 -27.072 597 HD3 ARG 98 HD3 ARG 98 79.007 51.376 -25.882 598 HE ARG 98 HE ARG 98 81.308 51.622 -27.729 599 HH11 ARG 98 HH11 ARG 98 79.604 53.270 -25.091 600 HH12 ARG 98 HH12 ARG 98 80.535 54.718 -25.343 601 HH21 ARG 98 HH21 ARG 98 82.365 53.523 -27.980 602 HH22 ARG 98 HH22 ARG 98 82.009 54.874 -26.948 603 H LEU 99 H LEU 99 77.915 46.967 -26.033 604 HA LEU 99 HA LEU 99 77.130 44.936 -23.992 605 HB2 LEU 99 HB2 LEU 99 75.260 46.310 -24.789 606 HB3 LEU 99 HB3 LEU 99 75.577 45.904 -26.438 607 HG LEU 99 HG LEU 99 73.586 44.814 -25.363 608 HD11 LEU 99 HD11 LEU 99 75.554 42.705 -26.283 609 HD12 LEU 99 HD12 LEU 99 73.805 42.826 -26.586 610 HD13 LEU 99 HD13 LEU 99 74.900 43.929 -27.385 611 HD21 LEU 99 HD21 LEU 99 74.847 44.398 -23.156 612 HD22 LEU 99 HD22 LEU 99 73.572 43.337 -23.713 613 HD23 LEU 99 HD23 LEU 99 75.298 42.859 -23.917 614 H ASP 100 H ASP 100 77.936 42.920 -24.468 615 HA ASP 100 HA ASP 100 78.543 42.169 -27.268 616 HB2 ASP 100 HB2 ASP 100 80.625 43.127 -26.298 617 HB3 ASP 100 HB3 ASP 100 80.560 41.928 -25.006 618 H MET 101 H MET 101 77.961 40.142 -27.711 619 HA MET 101 HA MET 101 77.356 38.214 -25.506 620 HB2 MET 101 HB2 MET 101 75.607 38.896 -27.900 621 HB3 MET 101 HB3 MET 101 75.318 37.548 -26.792 622 HG2 MET 101 HG2 MET 101 75.098 39.088 -24.900 623 HG3 MET 101 HG3 MET 101 75.404 40.468 -25.961 624 HE1 MET 101 HE1 MET 101 73.044 41.661 -25.071 625 HE2 MET 101 HE2 MET 101 71.580 40.658 -24.965 626 HE3 MET 101 HE3 MET 101 73.008 40.234 -23.996 627 H SER 102 H SER 102 79.446 38.613 -27.977 628 HA SER 102 HA SER 102 79.363 36.013 -29.274 629 HB2 SER 102 HB2 SER 102 81.640 37.975 -28.788 630 HB3 SER 102 HB3 SER 102 81.780 36.486 -29.742 631 HG SER 102 HG SER 102 81.298 38.365 -31.039 632 H ASP 103 H ASP 103 80.562 34.121 -28.735 633 HA ASP 103 HA ASP 103 80.104 33.457 -26.099 634 HB2 ASP 103 HB2 ASP 103 80.597 32.081 -28.405 635 HB3 ASP 103 HB3 ASP 103 82.095 31.765 -27.565 636 H LYS 104 H LYS 104 83.155 34.600 -27.407 637 HA LYS 104 HA LYS 104 84.917 33.996 -25.250 638 HB2 LYS 104 HB2 LYS 104 84.863 36.353 -27.184 639 HB3 LYS 104 HB3 LYS 104 86.186 36.009 -26.062 640 HG2 LYS 104 HG2 LYS 104 86.509 33.775 -27.102 641 HG3 LYS 104 HG3 LYS 104 85.229 34.138 -28.275 642 HD2 LYS 104 HD2 LYS 104 86.534 36.082 -29.104 643 HD3 LYS 104 HD3 LYS 104 87.818 35.717 -27.930 644 HE2 LYS 104 HE2 LYS 104 88.125 33.475 -28.969 645 HE3 LYS 104 HE3 LYS 104 86.852 33.841 -30.140 646 HZ1 LYS 104 HZ1 LYS 104 89.421 35.336 -29.891 647 HZ2 LYS 104 HZ2 LYS 104 89.062 34.268 -31.070 648 HZ3 LYS 104 HZ3 LYS 104 88.243 35.675 -30.976 649 H ALA 105 H ALA 105 82.469 36.576 -25.451 650 HA ALA 105 HA ALA 105 83.326 38.007 -23.088 651 HB1 ALA 105 HB1 ALA 105 80.562 37.787 -24.344 652 HB2 ALA 105 HB2 ALA 105 81.097 39.000 -23.167 653 HB3 ALA 105 HB3 ALA 105 81.815 38.964 -24.788 654 H ILE 106 H ILE 106 81.201 35.222 -23.614 655 HA ILE 106 HA ILE 106 80.323 35.035 -20.852 656 HB ILE 106 HB ILE 106 80.094 33.202 -23.267 657 HG12 ILE 106 HG12 ILE 106 77.689 33.659 -23.030 658 HG13 ILE 106 HG13 ILE 106 77.999 34.716 -21.654 659 HG21 ILE 106 HG21 ILE 106 79.038 32.689 -20.453 660 HG22 ILE 106 HG22 ILE 106 78.551 31.799 -21.912 661 HG23 ILE 106 HG23 ILE 106 80.214 31.702 -21.353 662 HD11 ILE 106 HD11 ILE 106 79.029 35.255 -24.469 663 HD12 ILE 106 HD12 ILE 106 77.504 35.891 -23.816 664 HD13 ILE 106 HD13 ILE 106 79.039 36.381 -23.089 665 H PHE 107 H PHE 107 82.756 33.248 -22.827 666 HA PHE 107 HA PHE 107 83.793 31.605 -20.773 667 HB2 PHE 107 HB2 PHE 107 85.489 33.025 -22.856 668 HB3 PHE 107 HB3 PHE 107 85.860 31.524 -22.036 669 HD1 PHE 107 HD2 PHE 107 82.781 30.475 -22.633 670 HD2 PHE 107 HD1 PHE 107 86.090 32.026 -24.924 671 HE1 PHE 107 HE2 PHE 107 81.973 29.252 -24.636 672 HE2 PHE 107 HE1 PHE 107 85.266 30.794 -26.934 673 HZ PHE 107 HZ PHE 107 83.226 29.388 -26.772 674 H ARG 108 H ARG 108 84.839 34.944 -21.637 675 HA ARG 108 HA ARG 108 86.900 35.048 -19.678 676 HB2 ARG 108 HB2 ARG 108 86.736 36.152 -21.908 677 HB3 ARG 108 HB3 ARG 108 85.567 37.302 -21.258 678 HG2 ARG 108 HG2 ARG 108 88.308 36.903 -20.010 679 HG3 ARG 108 HG3 ARG 108 88.104 37.886 -21.458 680 HD2 ARG 108 HD2 ARG 108 86.562 39.407 -20.274 681 HD3 ARG 108 HD3 ARG 108 86.687 38.431 -18.818 682 HE ARG 108 HE ARG 108 88.803 39.243 -18.363 683 HH11 ARG 108 HH11 ARG 108 87.902 40.478 -21.529 684 HH12 ARG 108 HH12 ARG 108 89.226 41.608 -21.553 685 HH21 ARG 108 HH21 ARG 108 90.456 40.701 -18.470 686 HH22 ARG 108 HH22 ARG 108 90.633 41.728 -19.862 687 H ARG 109 H ARG 109 83.546 36.324 -19.603 688 HA ARG 109 HA ARG 109 83.832 37.470 -16.914 689 HB2 ARG 109 HB2 ARG 109 81.403 36.707 -18.595 690 HB3 ARG 109 HB3 ARG 109 81.305 37.407 -16.978 691 HG2 ARG 109 HG2 ARG 109 82.545 39.411 -17.722 692 HG3 ARG 109 HG3 ARG 109 82.684 38.744 -19.351 693 HD2 ARG 109 HD2 ARG 109 80.848 40.366 -19.269 694 HD3 ARG 109 HD3 ARG 109 80.236 38.752 -19.598 695 HE ARG 109 HE ARG 109 79.147 38.698 -17.541 696 HH11 ARG 109 HH11 ARG 109 81.145 41.579 -17.539 697 HH12 ARG 109 HH12 ARG 109 80.487 42.143 -16.030 698 HH21 ARG 109 HH21 ARG 109 78.388 39.434 -15.608 699 HH22 ARG 109 HH22 ARG 109 78.937 40.963 -14.977 700 H TYR 110 H TYR 110 82.739 34.338 -18.167 701 HA TYR 110 HA TYR 110 82.395 33.304 -15.385 702 HB2 TYR 110 HB2 TYR 110 80.713 32.618 -17.802 703 HB3 TYR 110 HB3 TYR 110 80.445 32.191 -16.129 704 HD1 TYR 110 HD2 TYR 110 80.395 34.424 -14.485 705 HD2 TYR 110 HD1 TYR 110 79.338 34.247 -18.662 706 HE1 TYR 110 HE2 TYR 110 79.015 36.500 -14.248 707 HE2 TYR 110 HE1 TYR 110 77.891 36.256 -18.396 708 HH TYR 110 HH TYR 110 76.965 37.765 -16.886 709 HA PRO 111 HA PRO 111 85.547 30.825 -17.664 710 HB2 PRO 111 HB2 PRO 111 87.124 30.071 -15.537 711 HB3 PRO 111 HB3 PRO 111 87.214 31.667 -16.340 712 HG2 PRO 111 HG2 PRO 111 85.673 30.935 -13.827 713 HG3 PRO 111 HG3 PRO 111 86.796 32.314 -14.075 714 HD2 PRO 111 HD2 PRO 111 84.127 32.638 -14.299 715 HD3 PRO 111 HD3 PRO 111 85.231 33.457 -15.448 716 H HIS 112 H HIS 112 83.343 29.818 -15.151 717 HA HIS 112 HA HIS 112 83.848 26.952 -15.370 718 HB2 HIS 112 HB2 HIS 112 82.011 26.735 -13.917 719 HB3 HIS 112 HB3 HIS 112 82.822 28.208 -13.395 720 HD2 HIS 112 HD2 HIS 112 79.489 26.892 -14.132 721 HE1 HIS 112 HE1 HIS 112 78.993 30.996 -15.151 722 HE2 HIS 112 HE2 HIS 112 77.793 28.878 -14.679 723 H LEU 113 H LEU 113 81.991 29.299 -17.203 724 HA LEU 113 HA LEU 113 80.050 27.471 -18.244 725 HB2 LEU 113 HB2 LEU 113 80.245 30.166 -17.740 726 HB3 LEU 113 HB3 LEU 113 80.589 30.164 -19.452 727 HG LEU 113 HG LEU 113 78.308 30.638 -19.139 728 HD11 LEU 113 HD11 LEU 113 78.318 27.688 -19.860 729 HD12 LEU 113 HD12 LEU 113 77.184 28.946 -20.364 730 HD13 LEU 113 HD13 LEU 113 78.848 29.001 -20.951 731 HD21 LEU 113 HD21 LEU 113 77.870 29.943 -16.933 732 HD22 LEU 113 HD22 LEU 113 76.716 29.144 -17.974 733 HD23 LEU 113 HD23 LEU 113 78.090 28.215 -17.339 734 H ARG 114 H ARG 114 83.226 28.443 -19.302 735 HA ARG 114 HA ARG 114 82.984 27.939 -22.130 736 HB2 ARG 114 HB2 ARG 114 84.714 29.356 -21.053 737 HB3 ARG 114 HB3 ARG 114 85.470 27.930 -20.367 738 HG2 ARG 114 HG2 ARG 114 85.040 28.234 -23.371 739 HG3 ARG 114 HG3 ARG 114 86.398 29.006 -22.567 740 HD2 ARG 114 HD2 ARG 114 85.881 26.009 -22.607 741 HD3 ARG 114 HD3 ARG 114 87.014 26.861 -23.633 742 HE ARG 114 HE ARG 114 87.301 26.217 -20.782 743 HH11 ARG 114 HH11 ARG 114 88.684 28.092 -23.407 744 HH12 ARG 114 HH12 ARG 114 90.198 28.305 -22.573 745 HH21 ARG 114 HH21 ARG 114 89.248 26.530 -19.784 746 HH22 ARG 114 HH22 ARG 114 90.506 27.435 -20.575 Start of MODEL 11 1 H1 MET 1 H1 MET 1 15.144 51.211 22.206 2 H2 MET 1 H2 MET 1 14.202 52.405 22.808 3 H3 MET 1 H3 MET 1 15.481 51.876 23.665 4 HA MET 1 HA MET 1 16.007 54.010 22.657 5 HB2 MET 1 HB2 MET 1 17.544 51.691 21.391 6 HB3 MET 1 HB3 MET 1 18.050 53.376 21.348 7 HG2 MET 1 HG2 MET 1 18.202 53.409 23.820 8 HG3 MET 1 HG3 MET 1 17.737 51.702 23.866 9 HE1 MET 1 HE1 MET 1 19.822 51.070 25.315 10 HE2 MET 1 HE2 MET 1 21.490 51.516 24.898 11 HE3 MET 1 HE3 MET 1 20.318 52.780 25.332 12 H ARG 2 H ARG 2 15.779 55.431 20.979 13 HA ARG 2 HA ARG 2 15.579 54.492 18.193 14 HB2 ARG 2 HB2 ARG 2 13.404 56.194 19.515 15 HB3 ARG 2 HB3 ARG 2 13.796 56.352 17.813 16 HG2 ARG 2 HG2 ARG 2 12.132 54.883 17.564 17 HG3 ARG 2 HG3 ARG 2 13.446 53.730 17.738 18 HD2 ARG 2 HD2 ARG 2 12.800 53.547 20.217 19 HD3 ARG 2 HD3 ARG 2 11.480 54.652 19.884 20 HE ARG 2 HE ARG 2 10.272 52.957 18.914 21 HH11 ARG 2 HH11 ARG 2 13.590 51.739 19.090 22 HH12 ARG 2 HH12 ARG 2 13.090 50.147 18.582 23 HH21 ARG 2 HH21 ARG 2 9.755 50.909 18.292 24 HH22 ARG 2 HH22 ARG 2 10.988 49.692 18.155 25 H GLY 3 H GLY 3 16.370 55.984 16.719 26 HA2 GLY 3 HA2 GLY 3 16.912 58.692 16.973 27 HA3 GLY 3 HA3 GLY 3 18.284 57.925 17.780 28 H SER 4 H SER 4 16.501 56.931 14.798 29 HA SER 4 HA SER 4 18.876 56.036 13.520 30 HB2 SER 4 HB2 SER 4 16.165 56.648 12.293 31 HB3 SER 4 HB3 SER 4 17.451 55.667 11.563 32 HG SER 4 HG SER 4 15.839 54.395 12.667 33 H HIS 5 H HIS 5 20.417 57.095 12.488 34 HA HIS 5 HA HIS 5 19.811 59.563 10.909 35 HB2 HIS 5 HB2 HIS 5 20.742 59.896 13.314 36 HB3 HIS 5 HB3 HIS 5 22.266 59.302 12.671 37 HD2 HIS 5 HD2 HIS 5 19.621 62.070 11.827 38 HE1 HIS 5 HE1 HIS 5 23.484 63.760 11.164 39 HE2 HIS 5 HE2 HIS 5 20.982 64.232 11.163 40 H HIS 6 H HIS 6 20.511 56.603 10.312 41 HA HIS 6 HA HIS 6 23.168 56.665 9.116 42 HB2 HIS 6 HB2 HIS 6 22.656 54.299 8.578 43 HB3 HIS 6 HB3 HIS 6 22.439 54.705 10.273 44 HD2 HIS 6 HD2 HIS 6 20.307 53.728 11.316 45 HE1 HIS 6 HE1 HIS 6 17.787 53.511 7.880 46 HE2 HIS 6 HE2 HIS 6 17.950 53.016 10.373 47 H HIS 7 H HIS 7 20.205 57.704 7.871 48 HA HIS 7 HA HIS 7 20.327 56.764 5.179 49 HB2 HIS 7 HB2 HIS 7 18.334 57.690 6.356 50 HB3 HIS 7 HB3 HIS 7 19.058 59.298 6.292 51 HD2 HIS 7 HD2 HIS 7 18.575 60.704 4.145 52 HE1 HIS 7 HE1 HIS 7 16.942 57.651 1.650 53 HE2 HIS 7 HE2 HIS 7 17.405 60.147 1.846 54 H HIS 8 H HIS 8 22.136 59.311 6.708 55 HA HIS 8 HA HIS 8 22.584 60.899 4.325 56 HB2 HIS 8 HB2 HIS 8 23.838 61.102 7.079 57 HB3 HIS 8 HB3 HIS 8 23.890 62.329 5.811 58 HD2 HIS 8 HD2 HIS 8 22.012 61.555 8.842 59 HE1 HIS 8 HE1 HIS 8 19.149 63.653 6.474 60 HE2 HIS 8 HE2 HIS 8 19.679 62.782 8.808 61 H HIS 9 H HIS 9 23.428 58.437 3.615 62 HA HIS 9 HA HIS 9 26.289 58.025 3.863 63 HB2 HIS 9 HB2 HIS 9 24.744 56.182 3.413 64 HB3 HIS 9 HB3 HIS 9 24.254 56.928 1.890 65 HD2 HIS 9 HD2 HIS 9 25.450 55.941 -0.169 66 HE1 HIS 9 HE1 HIS 9 29.164 54.776 1.584 67 HE2 HIS 9 HE2 HIS 9 27.805 54.824 -0.571 68 H HIS 10 H HIS 10 27.938 58.420 2.434 69 HA HIS 10 HA HIS 10 27.555 59.829 -0.102 70 HB2 HIS 10 HB2 HIS 10 27.472 61.665 1.594 71 HB3 HIS 10 HB3 HIS 10 29.042 61.158 2.209 72 HD2 HIS 10 HD2 HIS 10 27.399 62.722 -0.943 73 HE1 HIS 10 HE1 HIS 10 31.553 63.695 -1.075 74 HE2 HIS 10 HE2 HIS 10 29.284 64.091 -2.174 75 H GLY 11 H GLY 11 29.386 59.674 -1.455 76 HA2 GLY 11 HA2 GLY 11 31.874 58.421 -0.409 77 HA3 GLY 11 HA3 GLY 11 30.934 57.523 -1.599 78 H SER 28 H SER 28 30.805 60.905 -2.266 79 HA SER 28 HA SER 28 32.446 60.519 -4.652 80 HB2 SER 28 HB2 SER 28 31.076 63.043 -3.673 81 HB3 SER 28 HB3 SER 28 31.757 62.753 -5.282 82 HG SER 28 HG SER 28 29.493 62.377 -5.270 83 H VAL 29 H VAL 29 34.381 61.448 -5.187 84 HA VAL 29 HA VAL 29 35.768 63.313 -3.388 85 HB VAL 29 HB VAL 29 36.215 61.074 -2.428 86 HG11 VAL 29 HG11 VAL 29 37.711 60.445 -5.005 87 HG12 VAL 29 HG12 VAL 29 37.659 59.460 -3.532 88 HG13 VAL 29 HG13 VAL 29 36.186 59.693 -4.480 89 HG21 VAL 29 HG21 VAL 29 37.864 62.917 -2.194 90 HG22 VAL 29 HG22 VAL 29 38.575 61.300 -2.128 91 HG23 VAL 29 HG23 VAL 29 38.751 62.267 -3.599 92 H SER 30 H SER 30 37.618 64.315 -4.343 93 HA SER 30 HA SER 30 38.201 63.761 -7.197 94 HB2 SER 30 HB2 SER 30 36.449 65.499 -7.193 95 HB3 SER 30 HB3 SER 30 37.456 66.514 -6.143 96 HG SER 30 HG SER 30 37.635 67.005 -8.432 97 H PHE 31 H PHE 31 40.204 64.408 -7.887 98 HA PHE 31 HA PHE 31 42.093 65.701 -6.005 99 HB2 PHE 31 HB2 PHE 31 42.221 63.150 -5.891 100 HB3 PHE 31 HB3 PHE 31 42.809 63.182 -7.544 101 HD1 PHE 31 HD1 PHE 31 43.475 64.666 -4.142 102 HD2 PHE 31 HD2 PHE 31 45.172 63.292 -7.862 103 HE1 PHE 31 HE1 PHE 31 45.761 64.995 -3.222 104 HE2 PHE 31 HE2 PHE 31 47.455 63.617 -6.938 105 HZ PHE 31 HZ PHE 31 47.753 64.470 -4.618 106 H GLY 32 H GLY 32 40.593 66.657 -8.320 107 HA2 GLY 32 HA2 GLY 32 40.973 68.048 -10.162 108 HA3 GLY 32 HA3 GLY 32 42.707 67.771 -10.022 109 H ALA 33 H ALA 33 42.750 67.551 -12.331 110 HA ALA 33 HA ALA 33 41.937 64.858 -13.346 111 HB1 ALA 33 HB1 ALA 33 41.603 67.521 -14.778 112 HB2 ALA 33 HB2 ALA 33 41.243 65.912 -15.447 113 HB3 ALA 33 HB3 ALA 33 40.303 66.532 -14.078 114 HA PRO 34 HA PRO 34 46.481 65.725 -14.189 115 HB2 PRO 34 HB2 PRO 34 47.577 63.551 -12.953 116 HB3 PRO 34 HB3 PRO 34 47.172 65.063 -12.083 117 HG2 PRO 34 HG2 PRO 34 45.496 62.537 -12.295 118 HG3 PRO 34 HG3 PRO 34 45.932 63.451 -10.815 119 HD2 PRO 34 HD2 PRO 34 43.550 63.823 -12.068 120 HD3 PRO 34 HD3 PRO 34 44.435 65.196 -11.338 121 H SER 35 H SER 35 47.741 64.695 -15.758 122 HA SER 35 HA SER 35 46.975 62.102 -16.903 123 HB2 SER 35 HB2 SER 35 46.697 63.022 -19.185 124 HB3 SER 35 HB3 SER 35 45.456 63.602 -18.069 125 HG SER 35 HG SER 35 46.290 65.309 -19.350 126 HA PRO 36 HA PRO 36 51.341 62.076 -17.779 127 HB2 PRO 36 HB2 PRO 36 51.595 60.220 -19.760 128 HB3 PRO 36 HB3 PRO 36 51.121 59.803 -18.085 129 HG2 PRO 36 HG2 PRO 36 49.305 60.230 -20.480 130 HG3 PRO 36 HG3 PRO 36 49.286 58.881 -19.303 131 HD2 PRO 36 HD2 PRO 36 47.615 61.027 -19.087 132 HD3 PRO 36 HD3 PRO 36 48.290 60.216 -17.643 133 H LEU 37 H LEU 37 52.697 63.363 -18.858 134 HA LEU 37 HA LEU 37 52.092 64.302 -21.637 135 HB2 LEU 37 HB2 LEU 37 53.037 65.883 -19.218 136 HB3 LEU 37 HB3 LEU 37 53.489 66.350 -20.844 137 HG LEU 37 HG LEU 37 51.046 66.483 -21.465 138 HD11 LEU 37 HD11 LEU 37 50.686 66.320 -18.439 139 HD12 LEU 37 HD12 LEU 37 49.465 66.936 -19.573 140 HD13 LEU 37 HD13 LEU 37 49.960 65.254 -19.657 141 HD21 LEU 37 HD21 LEU 37 52.450 68.453 -20.983 142 HD22 LEU 37 HD22 LEU 37 50.792 68.702 -20.423 143 HD23 LEU 37 HD23 LEU 37 52.072 68.311 -19.251 144 H SER 38 H SER 38 53.852 64.623 -22.999 145 HA SER 38 HA SER 38 56.588 64.122 -22.072 146 HB2 SER 38 HB2 SER 38 57.083 62.476 -23.833 147 HB3 SER 38 HB3 SER 38 55.916 61.867 -22.652 148 HG SER 38 HG SER 38 55.277 61.386 -24.810 149 H SER 39 H SER 39 58.179 65.001 -23.382 150 HA SER 39 HA SER 39 57.269 66.853 -25.558 151 HB2 SER 39 HB2 SER 39 59.089 67.545 -23.227 152 HB3 SER 39 HB3 SER 39 58.571 68.636 -24.524 153 HG SER 39 HG SER 39 57.310 68.898 -22.617 154 H GLU 40 H GLU 40 59.153 64.274 -25.317 155 HA GLU 40 HA GLU 40 61.209 65.277 -27.196 156 HB2 GLU 40 HB2 GLU 40 62.147 65.573 -24.915 157 HB3 GLU 40 HB3 GLU 40 61.895 63.857 -24.589 158 HG2 GLU 40 HG2 GLU 40 63.502 63.259 -26.358 159 HG3 GLU 40 HG3 GLU 40 63.663 64.957 -26.816 160 H SER 41 H SER 41 61.871 63.788 -28.670 161 HA SER 41 HA SER 41 61.592 60.912 -28.258 162 HB2 SER 41 HB2 SER 41 59.324 61.629 -29.099 163 HB3 SER 41 HB3 SER 41 60.108 62.216 -30.577 164 HG SER 41 HG SER 41 59.294 60.041 -30.761 165 H GLU 42 H GLU 42 62.751 59.699 -29.836 166 HA GLU 42 HA GLU 42 64.670 59.252 -30.975 167 HB2 GLU 42 HB2 GLU 42 62.828 59.936 -32.640 168 HB3 GLU 42 HB3 GLU 42 63.797 61.380 -32.931 169 HG2 GLU 42 HG2 GLU 42 65.734 59.877 -33.551 170 HG3 GLU 42 HG3 GLU 42 64.711 58.478 -33.235 171 H ASP 43 H ASP 43 65.337 60.875 -28.860 172 HA ASP 43 HA ASP 43 67.125 63.011 -29.652 173 HB2 ASP 43 HB2 ASP 43 65.956 63.024 -27.516 174 HB3 ASP 43 HB3 ASP 43 66.779 61.544 -27.017 175 H GLU 44 H GLU 44 68.403 62.008 -31.228 176 HA GLU 44 HA GLU 44 70.119 60.899 -32.171 177 HB2 GLU 44 HB2 GLU 44 71.457 60.984 -29.448 178 HB3 GLU 44 HB3 GLU 44 72.232 60.648 -30.998 179 HG2 GLU 44 HG2 GLU 44 71.528 62.906 -31.819 180 HG3 GLU 44 HG3 GLU 44 70.902 63.270 -30.207 181 H ILE 45 H ILE 45 67.901 59.330 -31.258 182 HA ILE 45 HA ILE 45 69.054 56.704 -30.522 183 HB ILE 45 HB ILE 45 66.159 57.431 -31.065 184 HG12 ILE 45 HG12 ILE 45 67.640 57.164 -28.406 185 HG13 ILE 45 HG13 ILE 45 67.059 58.671 -29.109 186 HG21 ILE 45 HG21 ILE 45 67.405 54.975 -29.732 187 HG22 ILE 45 HG22 ILE 45 65.671 55.264 -29.991 188 HG23 ILE 45 HG23 ILE 45 66.718 55.007 -31.371 189 HD11 ILE 45 HD11 ILE 45 65.335 56.408 -28.062 190 HD12 ILE 45 HD12 ILE 45 65.509 58.047 -27.422 191 HD13 ILE 45 HD13 ILE 45 64.708 57.797 -28.985 192 H ASN 46 H ASN 46 70.151 55.805 -32.158 193 HA ASN 46 HA ASN 46 68.644 54.851 -34.463 194 HB2 ASN 46 HB2 ASN 46 70.151 55.675 -36.176 195 HB3 ASN 46 HB3 ASN 46 69.508 57.039 -35.286 196 HD21 ASN 46 HD22 ASN 46 72.436 55.231 -36.077 197 HD22 ASN 46 HD21 ASN 46 73.525 56.363 -35.297 198 H TYR 47 H TYR 47 69.685 53.123 -35.596 199 HA TYR 47 HA TYR 47 72.041 51.841 -34.306 200 HB2 TYR 47 HB2 TYR 47 69.370 50.484 -34.849 201 HB3 TYR 47 HB3 TYR 47 70.841 49.666 -34.349 202 HD1 TYR 47 HD2 TYR 47 71.834 50.095 -32.071 203 HD2 TYR 47 HD1 TYR 47 67.956 51.603 -33.225 204 HE1 TYR 47 HE2 TYR 47 71.263 50.477 -29.675 205 HE2 TYR 47 HE1 TYR 47 67.392 51.988 -30.832 206 HH TYR 47 HH TYR 47 68.103 51.826 -28.643 207 H MET 48 H MET 48 73.169 50.345 -35.650 208 HA MET 48 HA MET 48 73.185 51.187 -38.440 209 HB2 MET 48 HB2 MET 48 74.849 49.138 -36.922 210 HB3 MET 48 HB3 MET 48 75.123 49.620 -38.600 211 HG2 MET 48 HG2 MET 48 75.476 51.961 -37.899 212 HG3 MET 48 HG3 MET 48 75.173 51.517 -36.223 213 HE1 MET 48 HE1 MET 48 77.643 51.430 -39.234 214 HE2 MET 48 HE2 MET 48 78.970 50.404 -38.647 215 HE3 MET 48 HE3 MET 48 77.403 49.676 -39.049 216 H THR 49 H THR 49 72.035 48.286 -36.775 217 HA THR 49 HA THR 49 70.931 47.200 -39.307 218 HB THR 49 HB THR 49 71.684 44.894 -38.565 219 HG1 THR 49 HG1 THR 49 73.449 44.804 -37.165 220 HG21 THR 49 HG21 THR 49 73.984 46.781 -39.216 221 HG22 THR 49 HG22 THR 49 73.896 45.034 -39.525 222 HG23 THR 49 HG23 THR 49 72.827 46.137 -40.405 223 HA PRO 50 HA PRO 50 67.512 46.059 -36.621 224 HB2 PRO 50 HB2 PRO 50 66.314 44.050 -38.031 225 HB3 PRO 50 HB3 PRO 50 66.285 45.757 -38.570 226 HG2 PRO 50 HG2 PRO 50 68.187 43.556 -39.451 227 HG3 PRO 50 HG3 PRO 50 67.237 44.673 -40.485 228 HD2 PRO 50 HD2 PRO 50 69.840 45.157 -39.860 229 HD3 PRO 50 HD3 PRO 50 68.655 46.490 -39.988 230 HA PRO 51 HA PRO 51 68.963 42.618 -34.169 231 HB2 PRO 51 HB2 PRO 51 66.698 41.636 -32.984 232 HB3 PRO 51 HB3 PRO 51 67.416 43.224 -32.567 233 HG2 PRO 51 HG2 PRO 51 65.138 42.660 -34.497 234 HG3 PRO 51 HG3 PRO 51 65.190 43.869 -33.172 235 HD2 PRO 51 HD2 PRO 51 65.729 44.558 -35.739 236 HD3 PRO 51 HD3 PRO 51 66.661 45.272 -34.390 237 H GLU 52 H GLU 52 69.325 40.441 -34.246 238 HA GLU 52 HA GLU 52 68.182 38.927 -36.527 239 HB2 GLU 52 HB2 GLU 52 70.046 37.440 -36.268 240 HB3 GLU 52 HB3 GLU 52 70.603 39.097 -36.414 241 HG2 GLU 52 HG2 GLU 52 70.349 37.689 -33.719 242 HG3 GLU 52 HG3 GLU 52 71.776 37.558 -34.730 243 H GLN 53 H GLN 53 67.736 39.101 -33.153 244 HA GLN 53 HA GLN 53 66.064 36.635 -33.170 245 HB2 GLN 53 HB2 GLN 53 68.098 37.446 -31.053 246 HB3 GLN 53 HB3 GLN 53 66.795 36.285 -30.763 247 HG2 GLN 53 HG2 GLN 53 67.653 34.803 -32.524 248 HG3 GLN 53 HG3 GLN 53 68.947 35.943 -32.898 249 HE21 GLN 53 HE22 GLN 53 69.730 33.395 -32.313 250 HE22 GLN 53 HE21 GLN 53 70.455 33.363 -30.712 251 H GLU 54 H GLU 54 64.059 37.050 -32.543 252 HA GLU 54 HA GLU 54 63.442 39.453 -30.852 253 HB2 GLU 54 HB2 GLU 54 62.005 38.518 -33.365 254 HB3 GLU 54 HB3 GLU 54 61.500 39.854 -32.325 255 HG2 GLU 54 HG2 GLU 54 63.649 41.028 -32.812 256 HG3 GLU 54 HG3 GLU 54 64.068 39.748 -33.955 257 H ALA 55 H ALA 55 63.452 36.295 -30.507 258 HA ALA 55 HA ALA 55 60.765 36.067 -29.218 259 HB1 ALA 55 HB1 ALA 55 62.042 34.075 -31.138 260 HB2 ALA 55 HB2 ALA 55 60.517 33.850 -30.250 261 HB3 ALA 55 HB3 ALA 55 60.646 35.123 -31.477 262 H GLN 56 H GLN 56 62.143 36.607 -27.352 263 HA GLN 56 HA GLN 56 62.754 34.128 -25.923 264 HB2 GLN 56 HB2 GLN 56 64.959 34.857 -26.900 265 HB3 GLN 56 HB3 GLN 56 64.862 36.330 -25.930 266 HG2 GLN 56 HG2 GLN 56 64.767 34.917 -23.854 267 HG3 GLN 56 HG3 GLN 56 64.794 33.464 -24.851 268 HE21 GLN 56 HE22 GLN 56 66.662 33.176 -23.171 269 HE22 GLN 56 HE21 GLN 56 68.236 33.695 -23.750 270 HA PRO 57 HA PRO 57 60.317 37.626 -24.102 271 HB2 PRO 57 HB2 PRO 57 57.965 36.410 -23.525 272 HB3 PRO 57 HB3 PRO 57 58.460 36.831 -25.202 273 HG2 PRO 57 HG2 PRO 57 58.788 34.140 -23.819 274 HG3 PRO 57 HG3 PRO 57 57.996 34.479 -25.395 275 HD2 PRO 57 HD2 PRO 57 60.599 33.719 -25.257 276 HD3 PRO 57 HD3 PRO 57 60.057 34.947 -26.440 277 H GLY 58 H GLY 58 59.735 38.220 -21.985 278 HA2 GLY 58 HA2 GLY 58 59.783 38.231 -19.675 279 HA3 GLY 58 HA3 GLY 58 59.996 36.482 -19.671 280 H ALA 59 H ALA 59 62.358 36.171 -21.041 281 HA ALA 59 HA ALA 59 64.575 35.959 -20.715 282 HB1 ALA 59 HB1 ALA 59 64.473 38.947 -20.318 283 HB2 ALA 59 HB2 ALA 59 65.885 37.965 -20.775 284 HB3 ALA 59 HB3 ALA 59 64.497 38.084 -21.883 285 H LEU 60 H LEU 60 64.056 34.736 -18.881 286 HA LEU 60 HA LEU 60 65.044 35.777 -16.255 287 HB2 LEU 60 HB2 LEU 60 63.350 33.352 -16.982 288 HB3 LEU 60 HB3 LEU 60 64.105 33.542 -15.418 289 HG LEU 60 HG LEU 60 61.812 34.113 -15.258 290 HD11 LEU 60 HD11 LEU 60 63.393 36.705 -15.071 291 HD12 LEU 60 HD12 LEU 60 61.919 36.271 -14.191 292 HD13 LEU 60 HD13 LEU 60 63.421 35.395 -13.865 293 HD21 LEU 60 HD21 LEU 60 61.426 34.874 -17.615 294 HD22 LEU 60 HD22 LEU 60 60.693 35.899 -16.366 295 HD23 LEU 60 HD23 LEU 60 62.181 36.428 -17.165 296 H ALA 61 H ALA 61 66.593 34.636 -15.071 297 HA ALA 61 HA ALA 61 68.171 32.548 -16.431 298 HB1 ALA 61 HB1 ALA 61 69.280 35.098 -15.178 299 HB2 ALA 61 HB2 ALA 61 70.260 33.721 -15.720 300 HB3 ALA 61 HB3 ALA 61 69.322 34.656 -16.898 301 H ALA 62 H ALA 62 69.195 31.092 -15.108 302 HA ALA 62 HA ALA 62 68.512 31.063 -12.218 303 HB1 ALA 62 HB1 ALA 62 69.829 28.967 -13.987 304 HB2 ALA 62 HB2 ALA 62 69.372 28.763 -12.284 305 HB3 ALA 62 HB3 ALA 62 68.117 29.010 -13.513 306 H LEU 63 H LEU 63 70.208 30.599 -10.668 307 HA LEU 63 HA LEU 63 72.923 31.634 -11.326 308 HB2 LEU 63 HB2 LEU 63 71.120 32.538 -9.038 309 HB3 LEU 63 HB3 LEU 63 72.826 32.940 -9.174 310 HG LEU 63 HG LEU 63 70.678 33.822 -11.155 311 HD11 LEU 63 HD11 LEU 63 72.164 35.355 -8.981 312 HD12 LEU 63 HD12 LEU 63 71.012 36.042 -10.148 313 HD13 LEU 63 HD13 LEU 63 70.453 34.879 -8.935 314 HD21 LEU 63 HD21 LEU 63 72.881 33.678 -12.233 315 HD22 LEU 63 HD22 LEU 63 72.469 35.375 -11.940 316 HD23 LEU 63 HD23 LEU 63 73.626 34.548 -10.884 317 H HIS 64 H HIS 64 74.554 31.079 -9.829 318 HA HIS 64 HA HIS 64 74.095 28.689 -8.116 319 HB2 HIS 64 HB2 HIS 64 76.509 30.309 -8.926 320 HB3 HIS 64 HB3 HIS 64 76.593 29.090 -7.664 321 HD2 HIS 64 HD2 HIS 64 76.959 29.550 -11.323 322 HE1 HIS 64 HE1 HIS 64 76.509 25.340 -10.842 323 HE2 HIS 64 HE2 HIS 64 77.216 27.174 -12.443 324 H ALA 65 H ALA 65 73.995 28.820 -5.886 325 HA ALA 65 HA ALA 65 73.532 31.535 -4.784 326 HB1 ALA 65 HB1 ALA 65 72.788 28.776 -3.739 327 HB2 ALA 65 HB2 ALA 65 72.247 30.337 -3.086 328 HB3 ALA 65 HB3 ALA 65 71.746 29.842 -4.714 329 H GLU 66 H GLU 66 75.953 29.063 -4.516 330 HA GLU 66 HA GLU 66 77.179 30.358 -2.124 331 HB2 GLU 66 HB2 GLU 66 76.614 27.381 -2.454 332 HB3 GLU 66 HB3 GLU 66 77.644 28.086 -1.206 333 HG2 GLU 66 HG2 GLU 66 75.691 29.414 -0.374 334 HG3 GLU 66 HG3 GLU 66 74.657 28.572 -1.532 335 H GLY 67 H GLY 67 79.431 29.652 -1.745 336 HA2 GLY 67 HA2 GLY 67 81.598 29.161 -2.398 337 HA3 GLY 67 HA3 GLY 67 80.943 28.294 -3.780 338 HA PRO 68 HA PRO 68 83.281 32.066 -5.183 339 HB2 PRO 68 HB2 PRO 68 84.599 30.961 -7.325 340 HB3 PRO 68 HB3 PRO 68 85.139 30.789 -5.628 341 HG2 PRO 68 HG2 PRO 68 83.472 28.837 -7.251 342 HG3 PRO 68 HG3 PRO 68 84.951 28.496 -6.294 343 HD2 PRO 68 HD2 PRO 68 82.492 28.058 -5.268 344 HD3 PRO 68 HD3 PRO 68 83.787 28.745 -4.241 345 H LEU 69 H LEU 69 80.950 30.054 -6.811 346 HA LEU 69 HA LEU 69 80.482 32.065 -8.941 347 HB2 LEU 69 HB2 LEU 69 79.429 29.261 -8.518 348 HB3 LEU 69 HB3 LEU 69 78.852 30.327 -9.792 349 HG LEU 69 HG LEU 69 81.759 29.490 -9.531 350 HD11 LEU 69 HD11 LEU 69 79.589 28.424 -11.368 351 HD12 LEU 69 HD12 LEU 69 81.300 27.938 -11.350 352 HD13 LEU 69 HD13 LEU 69 80.262 27.566 -9.966 353 HD21 LEU 69 HD21 LEU 69 81.520 31.567 -10.805 354 HD22 LEU 69 HD22 LEU 69 81.885 30.238 -11.902 355 HD23 LEU 69 HD23 LEU 69 80.223 30.846 -11.793 356 H ALA 70 H ALA 70 79.527 32.077 -5.786 357 HA ALA 70 HA ALA 70 76.718 32.170 -5.930 358 HB1 ALA 70 HB1 ALA 70 78.597 33.730 -4.100 359 HB2 ALA 70 HB2 ALA 70 76.865 33.453 -3.819 360 HB3 ALA 70 HB3 ALA 70 77.993 32.085 -3.823 361 H GLY 71 H GLY 71 75.463 33.344 -7.149 362 HA2 GLY 71 HA2 GLY 71 74.413 35.320 -7.925 363 HA3 GLY 71 HA3 GLY 71 75.857 36.263 -7.574 364 H LEU 72 H LEU 72 76.756 33.440 -9.276 365 HA LEU 72 HA LEU 72 76.807 34.848 -11.887 366 HB2 LEU 72 HB2 LEU 72 78.679 32.761 -10.667 367 HB3 LEU 72 HB3 LEU 72 78.749 33.249 -12.312 368 HG LEU 72 HG LEU 72 78.841 35.708 -11.346 369 HD11 LEU 72 HD11 LEU 72 80.158 34.195 -9.063 370 HD12 LEU 72 HD12 LEU 72 80.171 35.942 -9.327 371 HD13 LEU 72 HD13 LEU 72 78.663 35.134 -8.934 372 HD21 LEU 72 HD21 LEU 72 80.614 34.642 -12.700 373 HD22 LEU 72 HD22 LEU 72 81.304 35.604 -11.397 374 HD23 LEU 72 HD23 LEU 72 81.245 33.836 -11.253 375 HA PRO 73 HA PRO 73 74.033 32.202 -13.879 376 HB2 PRO 73 HB2 PRO 73 75.215 31.663 -16.353 377 HB3 PRO 73 HB3 PRO 73 74.472 33.215 -15.891 378 HG2 PRO 73 HG2 PRO 73 77.384 32.406 -15.821 379 HG3 PRO 73 HG3 PRO 73 76.677 33.937 -16.425 380 HD2 PRO 73 HD2 PRO 73 77.782 33.770 -13.998 381 HD3 PRO 73 HD3 PRO 73 76.312 34.747 -14.244 382 H VAL 74 H VAL 74 73.482 30.058 -14.769 383 HA VAL 74 HA VAL 74 75.480 27.945 -14.062 384 HB VAL 74 HB VAL 74 72.505 27.565 -14.404 385 HG11 VAL 74 HG11 VAL 74 74.657 25.901 -13.037 386 HG12 VAL 74 HG12 VAL 74 72.919 25.542 -13.054 387 HG13 VAL 74 HG13 VAL 74 73.829 25.507 -14.561 388 HG21 VAL 74 HG21 VAL 74 72.775 29.130 -12.536 389 HG22 VAL 74 HG22 VAL 74 72.371 27.531 -11.920 390 HG23 VAL 74 HG23 VAL 74 74.048 28.110 -11.831 391 H THR 75 H THR 75 73.367 29.098 -16.703 392 HA THR 75 HA THR 75 74.784 27.241 -18.591 393 HB THR 75 HB THR 75 72.806 27.081 -19.896 394 HG1 THR 75 HG1 THR 75 70.871 28.178 -18.987 395 HG21 THR 75 HG21 THR 75 71.896 26.821 -17.012 396 HG22 THR 75 HG22 THR 75 71.323 25.916 -18.433 397 HG23 THR 75 HG23 THR 75 72.975 25.666 -17.828 398 H ARG 76 H ARG 76 74.739 27.913 -20.924 399 HA ARG 76 HA ARG 76 75.863 30.535 -21.310 400 HB2 ARG 76 HB2 ARG 76 75.830 30.043 -23.674 401 HB3 ARG 76 HB3 ARG 76 76.343 28.614 -22.786 402 HG2 ARG 76 HG2 ARG 76 73.999 27.682 -23.034 403 HG3 ARG 76 HG3 ARG 76 73.602 29.086 -24.046 404 HD2 ARG 76 HD2 ARG 76 75.379 28.450 -25.636 405 HD3 ARG 76 HD3 ARG 76 75.792 27.055 -24.614 406 HE ARG 76 HE ARG 76 72.994 27.002 -25.280 407 HH11 ARG 76 HH11 ARG 76 76.081 26.366 -26.814 408 HH12 ARG 76 HH12 ARG 76 75.392 25.225 -27.936 409 HH21 ARG 76 HH21 ARG 76 72.180 25.537 -26.735 410 HH22 ARG 76 HH22 ARG 76 73.232 24.776 -27.890 411 H SER 77 H SER 77 72.548 29.353 -21.674 412 HA SER 77 HA SER 77 71.368 31.766 -22.651 413 HB2 SER 77 HB2 SER 77 70.122 29.638 -20.866 414 HB3 SER 77 HB3 SER 77 69.265 30.822 -21.875 415 HG SER 77 HG SER 77 69.456 28.770 -22.925 416 H ASP 78 H ASP 78 71.927 30.584 -19.253 417 HA ASP 78 HA ASP 78 70.807 32.886 -17.984 418 HB2 ASP 78 HB2 ASP 78 73.140 31.180 -17.062 419 HB3 ASP 78 HB3 ASP 78 72.263 32.337 -16.073 420 H ALA 79 H ALA 79 74.267 32.255 -18.935 421 HA ALA 79 HA ALA 79 75.234 34.760 -18.052 422 HB1 ALA 79 HB1 ALA 79 76.244 32.943 -20.293 423 HB2 ALA 79 HB2 ALA 79 77.171 34.236 -19.506 424 HB3 ALA 79 HB3 ALA 79 76.672 32.819 -18.567 425 H ARG 80 H ARG 80 73.932 33.939 -21.313 426 HA ARG 80 HA ARG 80 74.297 36.544 -22.470 427 HB2 ARG 80 HB2 ARG 80 73.847 34.344 -23.619 428 HB3 ARG 80 HB3 ARG 80 72.160 34.458 -23.147 429 HG2 ARG 80 HG2 ARG 80 73.607 36.552 -24.839 430 HG3 ARG 80 HG3 ARG 80 72.818 35.136 -25.516 431 HD2 ARG 80 HD2 ARG 80 70.631 35.902 -24.543 432 HD3 ARG 80 HD3 ARG 80 71.429 37.379 -24.006 433 HE ARG 80 HE ARG 80 71.648 38.143 -26.199 434 HH11 ARG 80 HH11 ARG 80 70.027 34.999 -26.323 435 HH12 ARG 80 HH12 ARG 80 69.718 35.192 -28.038 436 HH21 ARG 80 HH21 ARG 80 71.090 38.244 -28.386 437 HH22 ARG 80 HH22 ARG 80 70.249 36.875 -29.090 438 H VAL 81 H VAL 81 71.418 35.167 -20.810 439 HA VAL 81 HA VAL 81 69.762 37.507 -21.026 440 HB VAL 81 HB VAL 81 69.830 35.231 -19.014 441 HG11 VAL 81 HG11 VAL 81 67.794 37.488 -19.255 442 HG12 VAL 81 HG12 VAL 81 67.511 35.973 -18.378 443 HG13 VAL 81 HG13 VAL 81 68.760 37.075 -17.819 444 HG21 VAL 81 HG21 VAL 81 69.154 34.731 -21.369 445 HG22 VAL 81 HG22 VAL 81 67.864 34.461 -20.186 446 HG23 VAL 81 HG23 VAL 81 67.844 35.918 -21.219 447 H LEU 82 H LEU 82 71.950 36.467 -18.388 448 HA LEU 82 HA LEU 82 71.486 38.753 -16.726 449 HB2 LEU 82 HB2 LEU 82 73.912 36.939 -16.981 450 HB3 LEU 82 HB3 LEU 82 73.759 38.176 -15.737 451 HG LEU 82 HG LEU 82 71.825 35.843 -16.049 452 HD11 LEU 82 HD11 LEU 82 73.950 36.257 -13.918 453 HD12 LEU 82 HD12 LEU 82 72.980 34.798 -14.269 454 HD13 LEU 82 HD13 LEU 82 74.240 35.326 -15.394 455 HD21 LEU 82 HD21 LEU 82 70.728 37.713 -14.926 456 HD22 LEU 82 HD22 LEU 82 71.114 36.449 -13.758 457 HD23 LEU 82 HD23 LEU 82 72.123 37.911 -13.839 458 H ILE 83 H ILE 83 74.022 38.306 -19.280 459 HA ILE 83 HA ILE 83 75.197 40.894 -18.982 460 HB ILE 83 HB ILE 83 74.885 39.091 -21.402 461 HG12 ILE 83 HG12 ILE 83 77.396 39.910 -19.878 462 HG13 ILE 83 HG13 ILE 83 76.408 38.557 -19.354 463 HG21 ILE 83 HG21 ILE 83 76.264 41.817 -21.229 464 HG22 ILE 83 HG22 ILE 83 76.623 40.639 -22.495 465 HG23 ILE 83 HG23 ILE 83 75.009 41.313 -22.384 466 HD11 ILE 83 HD11 ILE 83 77.835 38.753 -22.031 467 HD12 ILE 83 HD12 ILE 83 78.212 37.680 -20.671 468 HD13 ILE 83 HD13 ILE 83 76.704 37.459 -21.572 469 H PHE 84 H PHE 84 72.463 39.907 -21.144 470 HA PHE 84 HA PHE 84 72.035 42.526 -22.106 471 HB2 PHE 84 HB2 PHE 84 71.240 40.354 -23.099 472 HB3 PHE 84 HB3 PHE 84 69.996 40.282 -21.877 473 HD1 PHE 84 HD1 PHE 84 71.362 42.943 -24.189 474 HD2 PHE 84 HD2 PHE 84 67.864 40.886 -22.724 475 HE1 PHE 84 HE1 PHE 84 69.999 44.142 -25.823 476 HE2 PHE 84 HE2 PHE 84 66.457 42.187 -24.307 477 HZ PHE 84 HZ PHE 84 67.511 43.804 -25.878 478 H ASN 85 H ASN 85 70.333 40.868 -19.411 479 HA ASN 85 HA ASN 85 68.515 43.002 -18.848 480 HB2 ASN 85 HB2 ASN 85 69.566 40.681 -17.161 481 HB3 ASN 85 HB3 ASN 85 68.324 41.791 -16.611 482 HD21 ASN 85 HD22 ASN 85 67.334 39.508 -16.402 483 HD22 ASN 85 HD21 ASN 85 66.369 38.991 -17.775 484 H GLU 86 H GLU 86 71.679 42.150 -17.281 485 HA GLU 86 HA GLU 86 71.563 44.322 -15.399 486 HB2 GLU 86 HB2 GLU 86 72.968 42.275 -15.134 487 HB3 GLU 86 HB3 GLU 86 74.015 42.852 -16.445 488 HG2 GLU 86 HG2 GLU 86 74.578 44.862 -15.135 489 HG3 GLU 86 HG3 GLU 86 73.460 44.369 -13.861 490 H TRP 87 H TRP 87 73.139 44.036 -18.683 491 HA TRP 87 HA TRP 87 74.144 46.702 -18.730 492 HB2 TRP 87 HB2 TRP 87 74.810 45.144 -20.431 493 HB3 TRP 87 HB3 TRP 87 73.138 44.854 -20.898 494 HD1 TRP 87 HD1 TRP 87 75.696 47.773 -21.040 495 HE1 TRP 87 HE1 TRP 87 75.322 48.990 -23.267 496 HE3 TRP 87 HE3 TRP 87 71.478 45.337 -22.650 497 HZ2 TRP 87 HZ2 TRP 87 73.506 48.922 -25.448 498 HZ3 TRP 87 HZ3 TRP 87 70.542 45.874 -24.834 499 HH2 TRP 87 HH2 TRP 87 71.514 47.650 -26.278 500 H GLU 88 H GLU 88 70.845 45.467 -19.765 501 HA GLU 88 HA GLU 88 69.996 48.041 -20.573 502 HB2 GLU 88 HB2 GLU 88 68.650 45.452 -19.997 503 HB3 GLU 88 HB3 GLU 88 67.637 46.856 -19.751 504 HG2 GLU 88 HG2 GLU 88 69.185 46.300 -22.306 505 HG3 GLU 88 HG3 GLU 88 67.475 45.964 -22.056 506 H GLU 89 H GLU 89 69.711 46.635 -17.247 507 HA GLU 89 HA GLU 89 68.291 48.946 -16.211 508 HB2 GLU 89 HB2 GLU 89 70.072 46.891 -14.836 509 HB3 GLU 89 HB3 GLU 89 69.154 48.144 -13.989 510 HG2 GLU 89 HG2 GLU 89 67.046 47.261 -14.969 511 HG3 GLU 89 HG3 GLU 89 67.953 45.964 -15.745 512 H ARG 90 H ARG 90 71.780 48.102 -16.148 513 HA ARG 90 HA ARG 90 72.740 50.516 -14.927 514 HB2 ARG 90 HB2 ARG 90 74.021 48.692 -17.006 515 HB3 ARG 90 HB3 ARG 90 74.879 49.984 -16.163 516 HG2 ARG 90 HG2 ARG 90 73.536 47.720 -14.684 517 HG3 ARG 90 HG3 ARG 90 75.165 47.609 -15.348 518 HD2 ARG 90 HD2 ARG 90 75.563 48.229 -13.139 519 HD3 ARG 90 HD3 ARG 90 75.721 49.746 -14.007 520 HE ARG 90 HE ARG 90 73.349 48.850 -12.386 521 HH11 ARG 90 HH11 ARG 90 75.146 51.647 -13.658 522 HH12 ARG 90 HH12 ARG 90 74.403 52.696 -12.484 523 HH21 ARG 90 HH21 ARG 90 72.408 50.307 -11.042 524 HH22 ARG 90 HH22 ARG 90 72.852 51.983 -11.105 525 H LYS 91 H LYS 91 72.370 49.707 -18.318 526 HA LYS 91 HA LYS 91 73.088 52.256 -19.375 527 HB2 LYS 91 HB2 LYS 91 73.166 50.152 -20.640 528 HB3 LYS 91 HB3 LYS 91 71.416 50.020 -20.608 529 HG2 LYS 91 HG2 LYS 91 72.835 52.317 -22.002 530 HG3 LYS 91 HG3 LYS 91 72.577 50.750 -22.750 531 HD2 LYS 91 HD2 LYS 91 70.010 51.244 -21.918 532 HD3 LYS 91 HD3 LYS 91 70.587 52.893 -22.132 533 HE2 LYS 91 HE2 LYS 91 69.591 52.310 -24.173 534 HE3 LYS 91 HE3 LYS 91 71.330 52.253 -24.477 535 HZ1 LYS 91 HZ1 LYS 91 69.642 49.853 -23.849 536 HZ2 LYS 91 HZ2 LYS 91 70.072 50.301 -25.369 537 HZ3 LYS 91 HZ3 LYS 91 71.210 49.814 -24.295 538 H LYS 92 H LYS 92 69.810 51.097 -18.416 539 HA LYS 92 HA LYS 92 68.476 53.540 -19.222 540 HB2 LYS 92 HB2 LYS 92 67.876 51.421 -17.132 541 HB3 LYS 92 HB3 LYS 92 66.946 52.917 -17.209 542 HG2 LYS 92 HG2 LYS 92 66.374 52.488 -19.574 543 HG3 LYS 92 HG3 LYS 92 67.250 50.951 -19.523 544 HD2 LYS 92 HD2 LYS 92 65.710 50.129 -17.742 545 HD3 LYS 92 HD3 LYS 92 64.920 51.708 -17.705 546 HE2 LYS 92 HE2 LYS 92 63.440 50.479 -18.973 547 HE3 LYS 92 HE3 LYS 92 64.359 51.359 -20.193 548 HZ1 LYS 92 HZ1 LYS 92 64.835 48.518 -19.404 549 HZ2 LYS 92 HZ2 LYS 92 64.069 48.999 -20.758 550 HZ3 LYS 92 HZ3 LYS 92 65.659 49.294 -20.599 551 H SER 93 H SER 93 70.463 52.783 -16.339 552 HA SER 93 HA SER 93 70.241 55.592 -15.433 553 HB2 SER 93 HB2 SER 93 70.638 53.585 -13.946 554 HB3 SER 93 HB3 SER 93 72.309 53.578 -14.535 555 HG SER 93 HG SER 93 71.920 54.834 -12.557 556 H GLU 94 H GLU 94 72.374 53.876 -17.588 557 HA GLU 94 HA GLU 94 74.277 56.156 -17.915 558 HB2 GLU 94 HB2 GLU 94 74.863 53.162 -17.832 559 HB3 GLU 94 HB3 GLU 94 76.031 54.450 -18.076 560 HG2 GLU 94 HG2 GLU 94 75.541 55.305 -15.789 561 HG3 GLU 94 HG3 GLU 94 74.387 53.985 -15.567 562 HA PRO 95 HA PRO 95 72.220 54.738 -21.859 563 HB2 PRO 95 HB2 PRO 95 72.114 57.185 -23.206 564 HB3 PRO 95 HB3 PRO 95 70.894 56.554 -22.063 565 HG2 PRO 95 HG2 PRO 95 73.200 58.438 -21.479 566 HG3 PRO 95 HG3 PRO 95 71.478 58.605 -20.995 567 HD2 PRO 95 HD2 PRO 95 73.271 57.633 -19.250 568 HD3 PRO 95 HD3 PRO 95 71.674 56.842 -19.395 569 H TRP 96 H TRP 96 75.352 55.944 -21.431 570 HA TRP 96 HA TRP 96 76.308 55.656 -24.197 571 HB2 TRP 96 HB2 TRP 96 78.497 56.153 -23.097 572 HB3 TRP 96 HB3 TRP 96 77.265 57.372 -22.836 573 HD1 TRP 96 HD1 TRP 96 79.198 54.652 -20.953 574 HE1 TRP 96 HE1 TRP 96 79.016 55.050 -18.423 575 HE3 TRP 96 HE3 TRP 96 75.797 58.490 -20.973 576 HZ2 TRP 96 HZ2 TRP 96 77.578 56.793 -16.637 577 HZ3 TRP 96 HZ3 TRP 96 75.029 59.489 -18.831 578 HH2 TRP 96 HH2 TRP 96 75.905 58.650 -16.664 579 H LEU 97 H LEU 97 75.749 53.412 -21.575 580 HA LEU 97 HA LEU 97 78.120 52.085 -21.453 581 HB2 LEU 97 HB2 LEU 97 76.081 52.002 -19.926 582 HB3 LEU 97 HB3 LEU 97 75.362 50.869 -21.053 583 HG LEU 97 HG LEU 97 77.237 49.319 -20.622 584 HD11 LEU 97 HD11 LEU 97 78.088 51.366 -18.529 585 HD12 LEU 97 HD12 LEU 97 78.688 49.697 -18.613 586 HD13 LEU 97 HD13 LEU 97 79.054 50.820 -19.919 587 HD21 LEU 97 HD21 LEU 97 75.116 49.239 -19.298 588 HD22 LEU 97 HD22 LEU 97 76.507 48.696 -18.339 589 HD23 LEU 97 HD23 LEU 97 75.854 50.338 -18.119 590 H ARG 98 H ARG 98 79.178 50.433 -22.405 591 HA ARG 98 HA ARG 98 78.384 49.478 -25.055 592 HB2 ARG 98 HB2 ARG 98 80.689 48.649 -23.247 593 HB3 ARG 98 HB3 ARG 98 80.524 48.244 -24.949 594 HG2 ARG 98 HG2 ARG 98 80.998 51.039 -23.809 595 HG3 ARG 98 HG3 ARG 98 82.161 49.999 -24.612 596 HD2 ARG 98 HD2 ARG 98 81.591 51.475 -26.292 597 HD3 ARG 98 HD3 ARG 98 80.597 50.058 -26.660 598 HE ARG 98 HE ARG 98 79.322 52.152 -24.990 599 HH11 ARG 98 HH11 ARG 98 79.806 51.150 -28.321 600 HH12 ARG 98 HH12 ARG 98 78.446 52.080 -28.885 601 HH21 ARG 98 HH21 ARG 98 77.654 53.284 -25.744 602 HH22 ARG 98 HH22 ARG 98 77.237 53.279 -27.447 603 H LEU 99 H LEU 99 78.205 47.301 -25.700 604 HA LEU 99 HA LEU 99 77.261 45.316 -23.687 605 HB2 LEU 99 HB2 LEU 99 75.424 46.645 -24.621 606 HB3 LEU 99 HB3 LEU 99 75.864 46.235 -26.242 607 HG LEU 99 HG LEU 99 73.835 45.091 -25.294 608 HD11 LEU 99 HD11 LEU 99 75.891 43.002 -26.051 609 HD12 LEU 99 HD12 LEU 99 74.177 43.130 -26.504 610 HD13 LEU 99 HD13 LEU 99 75.338 44.225 -27.212 611 HD21 LEU 99 HD21 LEU 99 74.920 44.711 -23.009 612 HD22 LEU 99 HD22 LEU 99 73.785 43.552 -23.668 613 HD23 LEU 99 HD23 LEU 99 75.554 43.220 -23.724 614 H ASP 100 H ASP 100 78.265 43.397 -23.992 615 HA ASP 100 HA ASP 100 78.688 42.379 -26.721 616 HB2 ASP 100 HB2 ASP 100 80.826 43.499 -26.199 617 HB3 ASP 100 HB3 ASP 100 80.975 42.541 -24.727 618 H MET 101 H MET 101 77.881 40.436 -26.784 619 HA MET 101 HA MET 101 78.361 38.486 -24.646 620 HB2 MET 101 HB2 MET 101 75.839 37.712 -25.006 621 HB3 MET 101 HB3 MET 101 76.318 38.864 -23.799 622 HG2 MET 101 HG2 MET 101 75.629 40.744 -25.198 623 HG3 MET 101 HG3 MET 101 75.182 39.626 -26.495 624 HE1 MET 101 HE1 MET 101 72.997 40.961 -26.583 625 HE2 MET 101 HE2 MET 101 71.719 40.907 -25.356 626 HE3 MET 101 HE3 MET 101 73.151 41.940 -25.103 627 H SER 102 H SER 102 79.548 38.936 -27.222 628 HA SER 102 HA SER 102 78.945 36.624 -28.902 629 HB2 SER 102 HB2 SER 102 80.334 38.553 -29.646 630 HB3 SER 102 HB3 SER 102 81.564 38.109 -28.442 631 HG SER 102 HG SER 102 81.950 37.250 -30.598 632 H ASP 103 H ASP 103 80.160 34.594 -28.858 633 HA ASP 103 HA ASP 103 79.968 33.328 -26.392 634 HB2 ASP 103 HB2 ASP 103 81.667 32.518 -28.786 635 HB3 ASP 103 HB3 ASP 103 81.221 31.459 -27.450 636 H LYS 104 H LYS 104 82.931 34.746 -27.767 637 HA LYS 104 HA LYS 104 84.784 33.762 -25.795 638 HB2 LYS 104 HB2 LYS 104 84.802 36.121 -27.714 639 HB3 LYS 104 HB3 LYS 104 86.069 35.924 -26.512 640 HG2 LYS 104 HG2 LYS 104 86.843 35.011 -28.559 641 HG3 LYS 104 HG3 LYS 104 86.657 33.711 -27.385 642 HD2 LYS 104 HD2 LYS 104 84.582 32.968 -28.467 643 HD3 LYS 104 HD3 LYS 104 84.644 34.319 -29.609 644 HE2 LYS 104 HE2 LYS 104 86.773 32.135 -29.354 645 HE3 LYS 104 HE3 LYS 104 85.419 32.068 -30.482 646 HZ1 LYS 104 HZ1 LYS 104 87.553 34.147 -30.520 647 HZ2 LYS 104 HZ2 LYS 104 87.378 32.931 -31.587 648 HZ3 LYS 104 HZ3 LYS 104 86.262 34.117 -31.530 649 H ALA 105 H ALA 105 82.561 36.520 -25.660 650 HA ALA 105 HA ALA 105 83.668 37.693 -23.250 651 HB1 ALA 105 HB1 ALA 105 80.836 37.880 -24.337 652 HB2 ALA 105 HB2 ALA 105 81.629 38.964 -23.182 653 HB3 ALA 105 HB3 ALA 105 82.197 38.898 -24.857 654 H ILE 106 H ILE 106 81.265 35.158 -23.875 655 HA ILE 106 HA ILE 106 80.534 34.869 -21.068 656 HB ILE 106 HB ILE 106 79.967 33.254 -23.575 657 HG12 ILE 106 HG12 ILE 106 77.637 33.871 -23.058 658 HG13 ILE 106 HG13 ILE 106 78.164 34.747 -21.621 659 HG21 ILE 106 HG21 ILE 106 79.109 32.548 -20.728 660 HG22 ILE 106 HG22 ILE 106 78.439 31.837 -22.211 661 HG23 ILE 106 HG23 ILE 106 80.128 31.567 -21.805 662 HD11 ILE 106 HD11 ILE 106 78.940 35.492 -24.464 663 HD12 ILE 106 HD12 ILE 106 77.585 36.199 -23.567 664 HD13 ILE 106 HD13 ILE 106 79.243 36.461 -23.002 665 H PHE 107 H PHE 107 82.681 33.028 -23.289 666 HA PHE 107 HA PHE 107 83.706 31.161 -21.435 667 HB2 PHE 107 HB2 PHE 107 85.355 32.660 -23.504 668 HB3 PHE 107 HB3 PHE 107 85.723 31.101 -22.799 669 HD1 PHE 107 HD2 PHE 107 82.469 30.354 -23.333 670 HD2 PHE 107 HD1 PHE 107 85.928 31.587 -25.595 671 HE1 PHE 107 HE2 PHE 107 81.567 29.205 -25.332 672 HE2 PHE 107 HE1 PHE 107 85.021 30.416 -27.605 673 HZ PHE 107 HZ PHE 107 82.842 29.224 -27.468 674 H ARG 108 H ARG 108 84.947 34.482 -22.075 675 HA ARG 108 HA ARG 108 87.047 34.269 -20.149 676 HB2 ARG 108 HB2 ARG 108 87.022 35.451 -22.337 677 HB3 ARG 108 HB3 ARG 108 85.956 36.690 -21.671 678 HG2 ARG 108 HG2 ARG 108 88.582 36.005 -20.328 679 HG3 ARG 108 HG3 ARG 108 88.575 36.998 -21.782 680 HD2 ARG 108 HD2 ARG 108 87.331 38.747 -20.771 681 HD3 ARG 108 HD3 ARG 108 86.897 37.794 -19.368 682 HE ARG 108 HE ARG 108 89.429 39.175 -19.872 683 HH11 ARG 108 HH11 ARG 108 87.945 36.693 -17.825 684 HH12 ARG 108 HH12 ARG 108 89.170 36.891 -16.602 685 HH21 ARG 108 HH21 ARG 108 90.928 39.331 -18.261 686 HH22 ARG 108 HH22 ARG 108 90.807 38.333 -16.843 687 H ARG 109 H ARG 109 83.796 35.705 -19.902 688 HA ARG 109 HA ARG 109 84.346 36.808 -17.203 689 HB2 ARG 109 HB2 ARG 109 81.787 36.482 -18.822 690 HB3 ARG 109 HB3 ARG 109 81.861 37.228 -17.223 691 HG2 ARG 109 HG2 ARG 109 83.343 38.995 -18.017 692 HG3 ARG 109 HG3 ARG 109 83.464 38.243 -19.616 693 HD2 ARG 109 HD2 ARG 109 81.000 38.482 -19.881 694 HD3 ARG 109 HD3 ARG 109 80.941 39.384 -18.350 695 HE ARG 109 HE ARG 109 82.760 40.865 -19.615 696 HH11 ARG 109 HH11 ARG 109 79.750 39.686 -20.900 697 HH12 ARG 109 HH12 ARG 109 79.715 40.817 -22.229 698 HH21 ARG 109 HH21 ARG 109 82.621 42.421 -21.209 699 HH22 ARG 109 HH22 ARG 109 81.248 42.453 -22.273 700 H TYR 110 H TYR 110 82.916 33.870 -18.526 701 HA TYR 110 HA TYR 110 82.470 32.793 -15.773 702 HB2 TYR 110 HB2 TYR 110 80.801 32.286 -18.253 703 HB3 TYR 110 HB3 TYR 110 80.492 31.723 -16.627 704 HD1 TYR 110 HD2 TYR 110 80.430 33.677 -14.767 705 HD2 TYR 110 HD1 TYR 110 79.634 34.169 -18.970 706 HE1 TYR 110 HE2 TYR 110 79.254 35.845 -14.303 707 HE2 TYR 110 HE1 TYR 110 78.421 36.302 -18.502 708 HH TYR 110 HH TYR 110 77.756 37.817 -16.882 709 HA PRO 111 HA PRO 111 85.512 30.148 -18.096 710 HB2 PRO 111 HB2 PRO 111 87.282 29.668 -16.052 711 HB3 PRO 111 HB3 PRO 111 87.301 31.150 -17.054 712 HG2 PRO 111 HG2 PRO 111 85.988 30.761 -14.342 713 HG3 PRO 111 HG3 PRO 111 87.105 32.072 -14.850 714 HD2 PRO 111 HD2 PRO 111 84.431 32.433 -14.890 715 HD3 PRO 111 HD3 PRO 111 85.448 33.074 -16.217 716 H HIS 112 H HIS 112 83.465 29.601 -15.341 717 HA HIS 112 HA HIS 112 83.867 26.719 -15.142 718 HB2 HIS 112 HB2 HIS 112 82.076 26.776 -13.642 719 HB3 HIS 112 HB3 HIS 112 82.909 28.296 -13.361 720 HD2 HIS 112 HD2 HIS 112 79.557 26.921 -13.796 721 HE1 HIS 112 HE1 HIS 112 79.005 30.941 -15.060 722 HE2 HIS 112 HE2 HIS 112 77.850 28.905 -14.235 723 H LEU 113 H LEU 113 82.072 28.832 -17.275 724 HA LEU 113 HA LEU 113 80.002 26.961 -17.933 725 HB2 LEU 113 HB2 LEU 113 80.189 29.618 -17.682 726 HB3 LEU 113 HB3 LEU 113 80.629 29.557 -19.372 727 HG LEU 113 HG LEU 113 78.292 30.129 -18.944 728 HD11 LEU 113 HD11 LEU 113 78.401 27.384 -20.247 729 HD12 LEU 113 HD12 LEU 113 77.301 28.718 -20.596 730 HD13 LEU 113 HD13 LEU 113 79.009 28.867 -21.020 731 HD21 LEU 113 HD21 LEU 113 78.066 28.708 -16.869 732 HD22 LEU 113 HD22 LEU 113 76.707 28.693 -17.973 733 HD23 LEU 113 HD23 LEU 113 77.811 27.306 -17.926 734 H ARG 114 H ARG 114 83.010 28.003 -19.456 735 HA ARG 114 HA ARG 114 82.520 26.534 -21.970 736 HB2 ARG 114 HB2 ARG 114 83.594 28.810 -21.838 737 HB3 ARG 114 HB3 ARG 114 84.993 28.071 -21.091 738 HG2 ARG 114 HG2 ARG 114 83.900 27.540 -23.896 739 HG3 ARG 114 HG3 ARG 114 85.321 28.493 -23.482 740 HD2 ARG 114 HD2 ARG 114 85.001 25.495 -23.337 741 HD3 ARG 114 HD3 ARG 114 86.103 26.418 -24.342 742 HE ARG 114 HE ARG 114 86.256 25.958 -21.398 743 HH11 ARG 114 HH11 ARG 114 87.975 27.227 -24.197 744 HH12 ARG 114 HH12 ARG 114 89.464 27.369 -23.310 745 HH21 ARG 114 HH21 ARG 114 88.160 26.128 -20.377 746 HH22 ARG 114 HH22 ARG 114 89.569 26.754 -21.188 Start of MODEL 12 1 H1 MET 1 H1 MET 1 47.003 108.761 10.243 2 H2 MET 1 H2 MET 1 45.910 107.667 10.780 3 H3 MET 1 H3 MET 1 45.496 108.728 9.613 4 HA MET 1 HA MET 1 45.858 106.556 8.630 5 HB2 MET 1 HB2 MET 1 46.325 108.615 7.321 6 HB3 MET 1 HB3 MET 1 48.010 108.575 7.838 7 HG2 MET 1 HG2 MET 1 48.295 106.386 6.693 8 HG3 MET 1 HG3 MET 1 46.589 106.412 6.224 9 HE1 MET 1 HE1 MET 1 47.326 105.931 3.714 10 HE2 MET 1 HE2 MET 1 48.506 106.922 2.828 11 HE3 MET 1 HE3 MET 1 49.036 105.939 4.211 12 H ARG 2 H ARG 2 46.433 104.916 10.100 13 HA ARG 2 HA ARG 2 49.313 104.168 10.187 14 HB2 ARG 2 HB2 ARG 2 47.499 104.399 12.640 15 HB3 ARG 2 HB3 ARG 2 49.014 103.502 12.614 16 HG2 ARG 2 HG2 ARG 2 50.237 105.620 12.035 17 HG3 ARG 2 HG3 ARG 2 48.709 106.499 12.187 18 HD2 ARG 2 HD2 ARG 2 49.898 106.762 14.246 19 HD3 ARG 2 HD3 ARG 2 48.502 105.711 14.536 20 HE ARG 2 HE ARG 2 51.015 104.301 13.928 21 HH11 ARG 2 HH11 ARG 2 49.152 105.636 16.581 22 HH12 ARG 2 HH12 ARG 2 49.910 104.597 17.757 23 HH21 ARG 2 HH21 ARG 2 51.929 102.995 15.474 24 HH22 ARG 2 HH22 ARG 2 51.452 103.148 17.139 25 H GLY 3 H GLY 3 49.659 101.955 10.733 26 HA2 GLY 3 HA2 GLY 3 49.233 99.723 11.045 27 HA3 GLY 3 HA3 GLY 3 47.562 100.133 11.392 28 H SER 4 H SER 4 49.852 99.510 8.728 29 HA SER 4 HA SER 4 47.849 97.783 7.437 30 HB2 SER 4 HB2 SER 4 47.528 100.024 6.376 31 HB3 SER 4 HB3 SER 4 49.219 99.979 5.840 32 HG SER 4 HG SER 4 47.777 99.201 4.222 33 H HIS 5 H HIS 5 48.776 95.960 6.753 34 HA HIS 5 HA HIS 5 51.482 95.828 5.654 35 HB2 HIS 5 HB2 HIS 5 51.985 95.644 8.057 36 HB3 HIS 5 HB3 HIS 5 50.786 94.364 8.236 37 HD2 HIS 5 HD2 HIS 5 54.232 95.033 6.564 38 HE1 HIS 5 HE1 HIS 5 53.778 90.798 6.834 39 HE2 HIS 5 HE2 HIS 5 55.375 92.684 6.208 40 H HIS 6 H HIS 6 51.593 94.250 4.130 41 HA HIS 6 HA HIS 6 49.590 92.043 4.055 42 HB2 HIS 6 HB2 HIS 6 50.035 94.021 1.782 43 HB3 HIS 6 HB3 HIS 6 49.035 92.574 1.721 44 HD2 HIS 6 HD2 HIS 6 49.089 96.163 3.078 45 HE1 HIS 6 HE1 HIS 6 45.174 94.670 3.872 46 HE2 HIS 6 HE2 HIS 6 46.676 96.737 3.942 47 H HIS 7 H HIS 7 50.939 90.324 4.099 48 HA HIS 7 HA HIS 7 52.568 89.801 1.731 49 HB2 HIS 7 HB2 HIS 7 54.242 90.923 3.155 50 HB3 HIS 7 HB3 HIS 7 53.868 89.826 4.486 51 HD2 HIS 7 HD2 HIS 7 55.208 87.594 4.581 52 HE1 HIS 7 HE1 HIS 7 56.675 87.436 0.579 53 HE2 HIS 7 HE2 HIS 7 56.673 86.263 2.840 54 H HIS 8 H HIS 8 52.832 87.637 1.306 55 HA HIS 8 HA HIS 8 52.607 85.604 3.353 56 HB2 HIS 8 HB2 HIS 8 50.209 85.844 2.817 57 HB3 HIS 8 HB3 HIS 8 50.555 85.626 1.100 58 HD2 HIS 8 HD2 HIS 8 50.120 83.221 0.276 59 HE1 HIS 8 HE1 HIS 8 50.946 81.026 3.843 60 HE2 HIS 8 HE2 HIS 8 50.210 80.841 1.410 61 H HIS 9 H HIS 9 53.713 83.762 2.803 62 HA HIS 9 HA HIS 9 54.122 82.988 0.043 63 HB2 HIS 9 HB2 HIS 9 56.493 82.868 -0.004 64 HB3 HIS 9 HB3 HIS 9 56.086 84.514 0.443 65 HD2 HIS 9 HD2 HIS 9 57.901 81.406 1.674 66 HE1 HIS 9 HE1 HIS 9 58.381 84.305 4.767 67 HE2 HIS 9 HE2 HIS 9 59.125 82.021 3.927 68 H HIS 10 H HIS 10 54.719 80.768 -0.187 69 HA HIS 10 HA HIS 10 55.173 79.108 2.186 70 HB2 HIS 10 HB2 HIS 10 52.693 79.386 2.152 71 HB3 HIS 10 HB3 HIS 10 52.651 78.743 0.511 72 HD2 HIS 10 HD2 HIS 10 53.589 77.647 4.134 73 HE1 HIS 10 HE1 HIS 10 52.666 74.098 1.951 74 HE2 HIS 10 HE2 HIS 10 53.267 75.031 4.243 75 H GLY 11 H GLY 11 56.117 77.164 1.735 76 HA2 GLY 11 HA2 GLY 11 56.913 75.346 0.601 77 HA3 GLY 11 HA3 GLY 11 56.022 75.837 -0.828 78 H SER 28 H SER 28 58.579 74.643 -0.761 79 HA SER 28 HA SER 28 59.976 76.371 -2.628 80 HB2 SER 28 HB2 SER 28 60.901 77.143 -0.419 81 HB3 SER 28 HB3 SER 28 61.464 75.488 -0.117 82 HG SER 28 HG SER 28 63.088 76.868 -1.066 83 H VAL 29 H VAL 29 61.437 75.173 -3.948 84 HA VAL 29 HA VAL 29 62.052 72.388 -3.367 85 HB VAL 29 HB VAL 29 59.795 72.160 -4.289 86 HG11 VAL 29 HG11 VAL 29 60.855 73.284 -6.911 87 HG12 VAL 29 HG12 VAL 29 59.248 72.603 -6.604 88 HG13 VAL 29 HG13 VAL 29 59.724 74.113 -5.818 89 HG21 VAL 29 HG21 VAL 29 61.470 70.372 -4.640 90 HG22 VAL 29 HG22 VAL 29 60.240 70.437 -5.909 91 HG23 VAL 29 HG23 VAL 29 61.863 71.070 -6.232 92 H SER 30 H SER 30 63.841 71.655 -4.377 93 HA SER 30 HA SER 30 65.035 73.094 -6.682 94 HB2 SER 30 HB2 SER 30 66.519 72.502 -4.086 95 HB3 SER 30 HB3 SER 30 67.269 73.038 -5.600 96 HG SER 30 HG SER 30 66.880 74.787 -4.143 97 H PHE 31 H PHE 31 66.151 71.752 -8.066 98 HA PHE 31 HA PHE 31 66.928 69.026 -7.302 99 HB2 PHE 31 HB2 PHE 31 65.548 67.925 -8.987 100 HB3 PHE 31 HB3 PHE 31 64.553 68.723 -7.793 101 HD1 PHE 31 HD2 PHE 31 63.168 70.682 -8.377 102 HD2 PHE 31 HD1 PHE 31 65.611 68.706 -11.333 103 HE1 PHE 31 HE2 PHE 31 61.925 71.848 -10.185 104 HE2 PHE 31 HE1 PHE 31 64.366 69.872 -13.138 105 HZ PHE 31 HZ PHE 31 62.524 71.447 -12.568 106 H GLY 32 H GLY 32 68.005 67.860 -9.045 107 HA2 GLY 32 HA2 GLY 32 69.261 67.623 -10.980 108 HA3 GLY 32 HA3 GLY 32 68.974 69.296 -11.421 109 H ALA 33 H ALA 33 71.396 67.391 -11.053 110 HA ALA 33 HA ALA 33 73.291 69.461 -10.162 111 HB1 ALA 33 HB1 ALA 33 73.110 66.740 -8.794 112 HB2 ALA 33 HB2 ALA 33 74.395 67.944 -8.547 113 HB3 ALA 33 HB3 ALA 33 72.732 68.313 -8.062 114 HA PRO 34 HA PRO 34 74.386 66.704 -13.804 115 HB2 PRO 34 HB2 PRO 34 74.878 68.614 -15.706 116 HB3 PRO 34 HB3 PRO 34 73.237 68.019 -15.303 117 HG2 PRO 34 HG2 PRO 34 74.623 70.510 -14.249 118 HG3 PRO 34 HG3 PRO 34 72.977 70.372 -14.946 119 HD2 PRO 34 HD2 PRO 34 73.386 70.347 -12.263 120 HD3 PRO 34 HD3 PRO 34 72.147 69.295 -13.014 121 H SER 35 H SER 35 76.383 66.036 -14.407 122 HA SER 35 HA SER 35 78.767 67.757 -14.172 123 HB2 SER 35 HB2 SER 35 79.937 66.111 -12.718 124 HB3 SER 35 HB3 SER 35 78.584 66.929 -11.935 125 HG SER 35 HG SER 35 78.584 64.661 -11.514 126 HA PRO 36 HA PRO 36 78.715 64.385 -17.546 127 HB2 PRO 36 HB2 PRO 36 78.588 65.905 -19.817 128 HB3 PRO 36 HB3 PRO 36 77.140 65.381 -18.903 129 HG2 PRO 36 HG2 PRO 36 78.601 68.041 -18.700 130 HG3 PRO 36 HG3 PRO 36 76.845 67.760 -18.926 131 HD2 PRO 36 HD2 PRO 36 77.878 68.230 -16.465 132 HD3 PRO 36 HD3 PRO 36 76.577 67.023 -16.702 133 H LEU 37 H LEU 37 80.567 63.638 -18.428 134 HA LEU 37 HA LEU 37 82.813 65.391 -19.178 135 HB2 LEU 37 HB2 LEU 37 82.878 64.913 -16.660 136 HB3 LEU 37 HB3 LEU 37 83.193 63.234 -17.053 137 HG LEU 37 HG LEU 37 84.941 65.614 -17.847 138 HD11 LEU 37 HD11 LEU 37 85.315 63.526 -15.659 139 HD12 LEU 37 HD12 LEU 37 86.453 64.827 -16.074 140 HD13 LEU 37 HD13 LEU 37 84.865 65.227 -15.408 141 HD21 LEU 37 HD21 LEU 37 85.434 63.822 -19.397 142 HD22 LEU 37 HD22 LEU 37 86.713 63.844 -18.198 143 HD23 LEU 37 HD23 LEU 37 85.437 62.614 -18.086 144 H SER 38 H SER 38 83.413 64.635 -21.125 145 HA SER 38 HA SER 38 84.177 61.831 -21.429 146 HB2 SER 38 HB2 SER 38 81.791 61.825 -22.159 147 HB3 SER 38 HB3 SER 38 82.193 63.032 -23.398 148 HG SER 38 HG SER 38 82.255 60.833 -24.181 149 H SER 39 H SER 39 85.771 61.525 -22.937 150 HA SER 39 HA SER 39 86.665 63.733 -24.705 151 HB2 SER 39 HB2 SER 39 88.968 63.584 -23.830 152 HB3 SER 39 HB3 SER 39 87.820 64.129 -22.602 153 HG SER 39 HG SER 39 89.264 62.510 -21.797 154 H GLU 40 H GLU 40 85.633 60.777 -24.881 155 HA GLU 40 HA GLU 40 87.929 59.557 -26.366 156 HB2 GLU 40 HB2 GLU 40 85.642 58.238 -24.865 157 HB3 GLU 40 HB3 GLU 40 86.870 57.392 -25.814 158 HG2 GLU 40 HG2 GLU 40 88.649 58.361 -24.346 159 HG3 GLU 40 HG3 GLU 40 87.397 59.097 -23.341 160 H SER 41 H SER 41 87.496 58.171 -28.149 161 HA SER 41 HA SER 41 84.919 58.368 -29.558 162 HB2 SER 41 HB2 SER 41 86.328 60.363 -30.254 163 HB3 SER 41 HB3 SER 41 87.486 59.213 -30.950 164 HG SER 41 HG SER 41 85.891 59.994 -32.473 165 H GLU 42 H GLU 42 84.992 57.021 -31.562 166 HA GLU 42 HA GLU 42 85.002 54.974 -32.498 167 HB2 GLU 42 HB2 GLU 42 87.963 55.027 -31.872 168 HB3 GLU 42 HB3 GLU 42 87.162 53.968 -33.031 169 HG2 GLU 42 HG2 GLU 42 86.369 55.962 -34.302 170 HG3 GLU 42 HG3 GLU 42 87.266 57.008 -33.196 171 H ASP 43 H ASP 43 85.609 54.925 -29.176 172 HA ASP 43 HA ASP 43 86.040 52.181 -28.728 173 HB2 ASP 43 HB2 ASP 43 86.417 54.076 -27.149 174 HB3 ASP 43 HB3 ASP 43 84.673 54.233 -26.950 175 H GLU 44 H GLU 44 83.175 53.631 -29.772 176 HA GLU 44 HA GLU 44 81.574 51.164 -29.206 177 HB2 GLU 44 HB2 GLU 44 80.869 53.554 -28.367 178 HB3 GLU 44 HB3 GLU 44 80.373 53.807 -30.040 179 HG2 GLU 44 HG2 GLU 44 78.896 51.736 -29.799 180 HG3 GLU 44 HG3 GLU 44 79.388 51.650 -28.112 181 H ILE 45 H ILE 45 83.460 52.269 -31.622 182 HA ILE 45 HA ILE 45 81.514 51.786 -33.843 183 HB ILE 45 HB ILE 45 84.128 53.309 -33.988 184 HG12 ILE 45 HG12 ILE 45 81.252 54.306 -33.707 185 HG13 ILE 45 HG13 ILE 45 82.551 54.514 -32.534 186 HG21 ILE 45 HG21 ILE 45 81.784 53.106 -35.945 187 HG22 ILE 45 HG22 ILE 45 83.299 54.001 -36.195 188 HG23 ILE 45 HG23 ILE 45 83.328 52.250 -36.132 189 HD11 ILE 45 HD11 ILE 45 82.324 55.856 -35.245 190 HD12 ILE 45 HD12 ILE 45 82.286 56.595 -33.638 191 HD13 ILE 45 HD13 ILE 45 83.800 55.897 -34.249 192 H ASN 46 H ASN 46 81.583 49.575 -33.820 193 HA ASN 46 HA ASN 46 83.681 48.519 -35.557 194 HB2 ASN 46 HB2 ASN 46 84.303 48.026 -33.057 195 HB3 ASN 46 HB3 ASN 46 82.977 46.870 -33.093 196 HD21 ASN 46 HD22 ASN 46 83.204 44.985 -34.674 197 HD22 ASN 46 HD21 ASN 46 84.833 44.579 -35.184 198 H TYR 47 H TYR 47 82.959 46.660 -36.770 199 HA TYR 47 HA TYR 47 80.072 46.395 -37.124 200 HB2 TYR 47 HB2 TYR 47 80.668 44.785 -38.855 201 HB3 TYR 47 HB3 TYR 47 81.551 46.285 -39.036 202 HD1 TYR 47 HD2 TYR 47 81.834 42.704 -38.043 203 HD2 TYR 47 HD1 TYR 47 83.975 46.354 -38.912 204 HE1 TYR 47 HE2 TYR 47 83.981 41.441 -38.084 205 HE2 TYR 47 HE1 TYR 47 86.114 45.090 -38.946 206 HH TYR 47 HH TYR 47 87.132 43.035 -38.721 207 H MET 48 H MET 48 78.964 44.297 -37.053 208 HA MET 48 HA MET 48 80.106 42.133 -35.444 209 HB2 MET 48 HB2 MET 48 79.061 43.708 -33.771 210 HB3 MET 48 HB3 MET 48 77.500 43.455 -34.562 211 HG2 MET 48 HG2 MET 48 77.615 41.048 -34.020 212 HG3 MET 48 HG3 MET 48 79.225 41.268 -33.324 213 HE1 MET 48 HE1 MET 48 78.448 39.967 -31.154 214 HE2 MET 48 HE2 MET 48 76.979 40.376 -30.238 215 HE3 MET 48 HE3 MET 48 76.845 39.753 -31.897 216 H THR 49 H THR 49 79.133 40.119 -35.899 217 HA THR 49 HA THR 49 77.649 39.911 -38.376 218 HB THR 49 HB THR 49 77.617 37.427 -37.733 219 HG1 THR 49 HG1 THR 49 79.024 36.856 -36.063 220 HG21 THR 49 HG21 THR 49 80.325 38.833 -37.857 221 HG22 THR 49 HG22 THR 49 80.000 37.128 -38.245 222 HG23 THR 49 HG23 THR 49 79.310 38.410 -39.252 223 HA PRO 50 HA PRO 50 73.523 39.856 -36.810 224 HB2 PRO 50 HB2 PRO 50 72.182 38.199 -38.541 225 HB3 PRO 50 HB3 PRO 50 72.789 39.821 -38.995 226 HG2 PRO 50 HG2 PRO 50 74.137 37.137 -39.446 227 HG3 PRO 50 HG3 PRO 50 73.862 38.449 -40.638 228 HD2 PRO 50 HD2 PRO 50 76.232 38.185 -39.356 229 HD3 PRO 50 HD3 PRO 50 75.544 39.805 -39.671 230 HA PRO 51 HA PRO 51 73.153 36.353 -34.096 231 HB2 PRO 51 HB2 PRO 51 70.539 36.433 -33.310 232 HB3 PRO 51 HB3 PRO 51 71.732 37.688 -32.848 233 HG2 PRO 51 HG2 PRO 51 69.745 37.767 -35.148 234 HG3 PRO 51 HG3 PRO 51 70.037 39.020 -33.897 235 HD2 PRO 51 HD2 PRO 51 71.208 39.146 -36.352 236 HD3 PRO 51 HD3 PRO 51 72.090 39.655 -34.880 237 H GLU 52 H GLU 52 72.305 34.237 -33.846 238 HA GLU 52 HA GLU 52 70.643 33.085 -36.029 239 HB2 GLU 52 HB2 GLU 52 73.321 32.030 -35.040 240 HB3 GLU 52 HB3 GLU 52 72.183 31.058 -35.957 241 HG2 GLU 52 HG2 GLU 52 73.524 33.614 -36.936 242 HG3 GLU 52 HG3 GLU 52 73.991 31.972 -37.355 243 H GLN 53 H GLN 53 69.536 31.153 -35.479 244 HA GLN 53 HA GLN 53 68.646 31.093 -32.701 245 HB2 GLN 53 HB2 GLN 53 67.887 29.395 -35.110 246 HB3 GLN 53 HB3 GLN 53 67.125 29.295 -33.520 247 HG2 GLN 53 HG2 GLN 53 66.414 31.668 -33.691 248 HG3 GLN 53 HG3 GLN 53 67.159 31.784 -35.288 249 HE21 GLN 53 HE22 GLN 53 64.513 30.159 -33.456 250 HE22 GLN 53 HE21 GLN 53 63.581 29.781 -34.898 251 H GLU 54 H GLU 54 69.075 29.632 -31.136 252 HA GLU 54 HA GLU 54 70.714 27.217 -31.780 253 HB2 GLU 54 HB2 GLU 54 72.123 27.570 -29.929 254 HB3 GLU 54 HB3 GLU 54 72.132 29.015 -30.940 255 HG2 GLU 54 HG2 GLU 54 70.577 30.133 -29.343 256 HG3 GLU 54 HG3 GLU 54 70.624 28.699 -28.317 257 H ALA 55 H ALA 55 67.815 27.698 -31.178 258 HA ALA 55 HA ALA 55 66.056 26.800 -30.044 259 HB1 ALA 55 HB1 ALA 55 67.865 24.361 -30.037 260 HB2 ALA 55 HB2 ALA 55 66.093 24.368 -29.909 261 HB3 ALA 55 HB3 ALA 55 66.874 24.927 -31.399 262 H GLN 56 H GLN 56 67.035 28.451 -28.340 263 HA GLN 56 HA GLN 56 66.985 27.161 -25.667 264 HB2 GLN 56 HB2 GLN 56 69.344 27.230 -26.560 265 HB3 GLN 56 HB3 GLN 56 69.247 28.992 -26.558 266 HG2 GLN 56 HG2 GLN 56 68.944 29.003 -24.129 267 HG3 GLN 56 HG3 GLN 56 68.847 27.235 -24.095 268 HE21 GLN 56 HE22 GLN 56 70.842 25.987 -24.682 269 HE22 GLN 56 HE21 GLN 56 72.399 26.772 -24.484 270 HA PRO 57 HA PRO 57 64.724 31.170 -26.254 271 HB2 PRO 57 HB2 PRO 57 62.158 30.423 -26.009 272 HB3 PRO 57 HB3 PRO 57 63.149 29.903 -27.416 273 HG2 PRO 57 HG2 PRO 57 62.617 28.324 -24.866 274 HG3 PRO 57 HG3 PRO 57 62.319 27.807 -26.559 275 HD2 PRO 57 HD2 PRO 57 64.645 27.213 -25.234 276 HD3 PRO 57 HD3 PRO 57 64.600 27.550 -26.990 277 H GLY 58 H GLY 58 63.099 32.399 -24.883 278 HA2 GLY 58 HA2 GLY 58 62.059 32.942 -22.837 279 HA3 GLY 58 HA3 GLY 58 63.028 31.752 -21.983 280 H ALA 59 H ALA 59 62.657 34.149 -20.871 281 HA ALA 59 HA ALA 59 65.207 35.676 -21.193 282 HB1 ALA 59 HB1 ALA 59 62.414 36.741 -20.655 283 HB2 ALA 59 HB2 ALA 59 63.890 37.710 -20.877 284 HB3 ALA 59 HB3 ALA 59 63.240 36.770 -22.234 285 H LEU 60 H LEU 60 64.273 33.581 -19.193 286 HA LEU 60 HA LEU 60 64.688 35.037 -16.613 287 HB2 LEU 60 HB2 LEU 60 63.642 32.264 -17.297 288 HB3 LEU 60 HB3 LEU 60 64.243 32.659 -15.697 289 HG LEU 60 HG LEU 60 62.561 34.460 -15.460 290 HD11 LEU 60 HD11 LEU 60 61.461 33.379 -18.092 291 HD12 LEU 60 HD12 LEU 60 60.562 34.422 -16.968 292 HD13 LEU 60 HD13 LEU 60 62.007 35.044 -17.758 293 HD21 LEU 60 HD21 LEU 60 62.176 32.181 -14.593 294 HD22 LEU 60 HD22 LEU 60 60.661 32.935 -15.111 295 HD23 LEU 60 HD23 LEU 60 61.437 31.710 -16.140 296 H ALA 61 H ALA 61 66.300 34.234 -15.119 297 HA ALA 61 HA ALA 61 68.415 32.529 -16.252 298 HB1 ALA 61 HB1 ALA 61 68.925 35.224 -14.941 299 HB2 ALA 61 HB2 ALA 61 70.171 34.036 -15.382 300 HB3 ALA 61 HB3 ALA 61 69.196 34.804 -16.647 301 H ALA 62 H ALA 62 69.114 31.011 -14.930 302 HA ALA 62 HA ALA 62 68.451 31.028 -12.037 303 HB1 ALA 62 HB1 ALA 62 69.695 28.887 -13.810 304 HB2 ALA 62 HB2 ALA 62 69.246 28.700 -12.103 305 HB3 ALA 62 HB3 ALA 62 67.988 28.979 -13.323 306 H LEU 63 H LEU 63 70.165 30.523 -10.492 307 HA LEU 63 HA LEU 63 72.853 31.609 -11.200 308 HB2 LEU 63 HB2 LEU 63 71.125 32.389 -8.817 309 HB3 LEU 63 HB3 LEU 63 72.792 32.891 -9.062 310 HG LEU 63 HG LEU 63 70.446 33.674 -10.852 311 HD11 LEU 63 HD11 LEU 63 72.054 35.272 -8.816 312 HD12 LEU 63 HD12 LEU 63 70.753 35.895 -9.855 313 HD13 LEU 63 HD13 LEU 63 70.385 34.699 -8.604 314 HD21 LEU 63 HD21 LEU 63 72.533 33.653 -12.139 315 HD22 LEU 63 HD22 LEU 63 72.079 35.324 -11.777 316 HD23 LEU 63 HD23 LEU 63 73.371 34.533 -10.854 317 H HIS 64 H HIS 64 74.550 31.073 -9.782 318 HA HIS 64 HA HIS 64 74.262 28.607 -8.152 319 HB2 HIS 64 HB2 HIS 64 76.562 30.446 -8.829 320 HB3 HIS 64 HB3 HIS 64 76.714 29.142 -7.658 321 HD2 HIS 64 HD2 HIS 64 77.112 29.857 -11.278 322 HE1 HIS 64 HE1 HIS 64 76.956 25.597 -11.007 323 HE2 HIS 64 HE2 HIS 64 77.571 27.566 -12.497 324 H ALA 65 H ALA 65 74.095 28.590 -5.939 325 HA ALA 65 HA ALA 65 73.473 31.165 -4.644 326 HB1 ALA 65 HB1 ALA 65 73.065 28.289 -3.737 327 HB2 ALA 65 HB2 ALA 65 72.388 29.744 -2.976 328 HB3 ALA 65 HB3 ALA 65 71.878 29.288 -4.611 329 H GLU 66 H GLU 66 76.202 29.060 -4.680 330 HA GLU 66 HA GLU 66 77.419 30.370 -2.327 331 HB2 GLU 66 HB2 GLU 66 77.922 28.277 -1.212 332 HB3 GLU 66 HB3 GLU 66 76.185 28.476 -1.379 333 HG2 GLU 66 HG2 GLU 66 76.188 26.905 -3.317 334 HG3 GLU 66 HG3 GLU 66 77.933 26.703 -3.142 335 H GLY 67 H GLY 67 79.713 29.589 -1.970 336 HA2 GLY 67 HA2 GLY 67 81.861 29.142 -2.711 337 HA3 GLY 67 HA3 GLY 67 81.174 28.375 -4.138 338 HA PRO 68 HA PRO 68 83.428 32.291 -5.305 339 HB2 PRO 68 HB2 PRO 68 84.812 31.334 -7.477 340 HB3 PRO 68 HB3 PRO 68 85.346 31.119 -5.783 341 HG2 PRO 68 HG2 PRO 68 83.784 29.160 -7.499 342 HG3 PRO 68 HG3 PRO 68 85.267 28.849 -6.540 343 HD2 PRO 68 HD2 PRO 68 82.819 28.260 -5.560 344 HD3 PRO 68 HD3 PRO 68 84.074 28.961 -4.492 345 H LEU 69 H LEU 69 81.215 30.234 -7.049 346 HA LEU 69 HA LEU 69 80.668 32.314 -9.090 347 HB2 LEU 69 HB2 LEU 69 79.598 29.494 -8.788 348 HB3 LEU 69 HB3 LEU 69 79.171 30.599 -10.086 349 HG LEU 69 HG LEU 69 81.964 29.505 -9.597 350 HD11 LEU 69 HD11 LEU 69 79.927 28.870 -11.762 351 HD12 LEU 69 HD12 LEU 69 81.547 28.159 -11.580 352 HD13 LEU 69 HD13 LEU 69 80.299 27.829 -10.370 353 HD21 LEU 69 HD21 LEU 69 82.147 31.666 -10.705 354 HD22 LEU 69 HD22 LEU 69 82.429 30.389 -11.890 355 HD23 LEU 69 HD23 LEU 69 80.863 31.224 -11.866 356 H ALA 70 H ALA 70 79.702 32.158 -5.950 357 HA ALA 70 HA ALA 70 76.918 32.100 -6.026 358 HB1 ALA 70 HB1 ALA 70 78.720 33.816 -4.262 359 HB2 ALA 70 HB2 ALA 70 77.021 33.410 -3.932 360 HB3 ALA 70 HB3 ALA 70 78.249 32.132 -3.954 361 H GLY 71 H GLY 71 75.438 33.238 -6.957 362 HA2 GLY 71 HA2 GLY 71 74.218 35.070 -7.747 363 HA3 GLY 71 HA3 GLY 71 75.567 36.149 -7.409 364 H LEU 72 H LEU 72 76.640 33.471 -9.250 365 HA LEU 72 HA LEU 72 76.522 34.998 -11.809 366 HB2 LEU 72 HB2 LEU 72 78.486 32.843 -10.939 367 HB3 LEU 72 HB3 LEU 72 78.594 33.788 -12.375 368 HG LEU 72 HG LEU 72 79.027 34.770 -9.551 369 HD11 LEU 72 HD11 LEU 72 80.778 34.863 -12.049 370 HD12 LEU 72 HD12 LEU 72 81.240 35.313 -10.393 371 HD13 LEU 72 HD13 LEU 72 80.890 33.628 -10.789 372 HD21 LEU 72 HD21 LEU 72 77.814 36.589 -10.689 373 HD22 LEU 72 HD22 LEU 72 79.517 37.003 -10.526 374 HD23 LEU 72 HD23 LEU 72 78.890 36.457 -12.094 375 HA PRO 73 HA PRO 73 73.856 32.242 -13.750 376 HB2 PRO 73 HB2 PRO 73 74.882 31.779 -16.288 377 HB3 PRO 73 HB3 PRO 73 74.194 33.341 -15.750 378 HG2 PRO 73 HG2 PRO 73 77.072 32.460 -15.932 379 HG3 PRO 73 HG3 PRO 73 76.362 34.033 -16.402 380 HD2 PRO 73 HD2 PRO 73 77.667 33.588 -14.087 381 HD3 PRO 73 HD3 PRO 73 76.352 34.792 -14.191 382 H VAL 74 H VAL 74 73.331 30.068 -14.651 383 HA VAL 74 HA VAL 74 75.440 28.039 -14.037 384 HB VAL 74 HB VAL 74 72.467 27.540 -14.253 385 HG11 VAL 74 HG11 VAL 74 74.754 25.930 -13.046 386 HG12 VAL 74 HG12 VAL 74 73.031 25.506 -12.967 387 HG13 VAL 74 HG13 VAL 74 73.850 25.532 -14.526 388 HG21 VAL 74 HG21 VAL 74 72.797 29.076 -12.369 389 HG22 VAL 74 HG22 VAL 74 72.483 27.454 -11.763 390 HG23 VAL 74 HG23 VAL 74 74.144 28.086 -11.762 391 H THR 75 H THR 75 73.214 29.121 -16.601 392 HA THR 75 HA THR 75 74.605 27.297 -18.536 393 HB THR 75 HB THR 75 72.587 27.082 -19.757 394 HG1 THR 75 HG1 THR 75 70.670 28.148 -18.693 395 HG21 THR 75 HG21 THR 75 71.798 26.823 -16.840 396 HG22 THR 75 HG22 THR 75 71.195 25.893 -18.233 397 HG23 THR 75 HG23 THR 75 72.876 25.690 -17.690 398 H ARG 76 H ARG 76 74.383 27.951 -20.881 399 HA ARG 76 HA ARG 76 75.460 30.573 -21.403 400 HB2 ARG 76 HB2 ARG 76 75.722 28.546 -22.866 401 HB3 ARG 76 HB3 ARG 76 74.013 28.645 -23.284 402 HG2 ARG 76 HG2 ARG 76 74.468 30.987 -24.207 403 HG3 ARG 76 HG3 ARG 76 76.190 30.688 -23.943 404 HD2 ARG 76 HD2 ARG 76 74.307 29.029 -25.676 405 HD3 ARG 76 HD3 ARG 76 75.423 30.259 -26.283 406 HE ARG 76 HE ARG 76 77.078 28.532 -24.898 407 HH11 ARG 76 HH11 ARG 76 74.864 28.155 -27.609 408 HH12 ARG 76 HH12 ARG 76 75.750 26.785 -28.242 409 HH21 ARG 76 HH21 ARG 76 78.140 26.763 -25.764 410 HH22 ARG 76 HH22 ARG 76 77.559 26.035 -27.229 411 H SER 77 H SER 77 72.141 29.302 -21.499 412 HA SER 77 HA SER 77 70.799 31.643 -22.413 413 HB2 SER 77 HB2 SER 77 69.801 29.329 -22.065 414 HB3 SER 77 HB3 SER 77 69.744 29.688 -20.334 415 HG SER 77 HG SER 77 67.767 30.238 -21.404 416 H ASP 78 H ASP 78 71.588 30.571 -19.033 417 HA ASP 78 HA ASP 78 70.568 32.893 -17.748 418 HB2 ASP 78 HB2 ASP 78 72.933 31.194 -16.932 419 HB3 ASP 78 HB3 ASP 78 72.052 32.311 -15.889 420 H ALA 79 H ALA 79 73.942 32.235 -18.917 421 HA ALA 79 HA ALA 79 75.012 34.725 -18.082 422 HB1 ALA 79 HB1 ALA 79 75.879 32.840 -20.324 423 HB2 ALA 79 HB2 ALA 79 76.860 34.157 -19.662 424 HB3 ALA 79 HB3 ALA 79 76.417 32.785 -18.623 425 H ARG 80 H ARG 80 73.572 33.899 -21.297 426 HA ARG 80 HA ARG 80 74.006 36.487 -22.475 427 HB2 ARG 80 HB2 ARG 80 73.408 34.356 -23.694 428 HB3 ARG 80 HB3 ARG 80 71.763 34.491 -23.059 429 HG2 ARG 80 HG2 ARG 80 71.617 36.774 -24.184 430 HG3 ARG 80 HG3 ARG 80 73.192 36.458 -24.911 431 HD2 ARG 80 HD2 ARG 80 70.664 34.782 -25.284 432 HD3 ARG 80 HD3 ARG 80 71.223 35.999 -26.417 433 HE ARG 80 HE ARG 80 72.146 33.270 -26.181 434 HH11 ARG 80 HH11 ARG 80 73.300 36.417 -27.250 435 HH12 ARG 80 HH12 ARG 80 74.472 35.697 -28.318 436 HH21 ARG 80 HH21 ARG 80 73.421 32.473 -27.748 437 HH22 ARG 80 HH22 ARG 80 74.577 33.506 -28.555 438 H VAL 81 H VAL 81 71.175 35.199 -20.693 439 HA VAL 81 HA VAL 81 69.562 37.571 -20.865 440 HB VAL 81 HB VAL 81 69.601 35.249 -18.903 441 HG11 VAL 81 HG11 VAL 81 67.532 37.481 -19.129 442 HG12 VAL 81 HG12 VAL 81 67.329 35.972 -18.216 443 HG13 VAL 81 HG13 VAL 81 68.548 37.131 -17.710 444 HG21 VAL 81 HG21 VAL 81 68.962 34.803 -21.277 445 HG22 VAL 81 HG22 VAL 81 67.630 34.540 -20.150 446 HG23 VAL 81 HG23 VAL 81 67.681 36.018 -21.145 447 H LEU 82 H LEU 82 71.784 36.460 -18.277 448 HA LEU 82 HA LEU 82 71.431 38.768 -16.611 449 HB2 LEU 82 HB2 LEU 82 73.812 36.904 -16.943 450 HB3 LEU 82 HB3 LEU 82 73.763 38.201 -15.755 451 HG LEU 82 HG LEU 82 71.866 35.826 -15.812 452 HD11 LEU 82 HD11 LEU 82 73.999 36.559 -13.776 453 HD12 LEU 82 HD12 LEU 82 73.108 35.026 -13.954 454 HD13 LEU 82 HD13 LEU 82 74.315 35.500 -15.157 455 HD21 LEU 82 HD21 LEU 82 70.676 37.718 -14.852 456 HD22 LEU 82 HD22 LEU 82 71.163 36.612 -13.571 457 HD23 LEU 82 HD23 LEU 82 72.077 38.116 -13.825 458 H ILE 83 H ILE 83 73.900 38.257 -19.223 459 HA ILE 83 HA ILE 83 75.119 40.820 -19.003 460 HB ILE 83 HB ILE 83 74.679 38.984 -21.378 461 HG12 ILE 83 HG12 ILE 83 77.238 39.812 -19.927 462 HG13 ILE 83 HG13 ILE 83 76.277 38.421 -19.442 463 HG21 ILE 83 HG21 ILE 83 76.224 41.627 -21.374 464 HG22 ILE 83 HG22 ILE 83 76.279 40.414 -22.665 465 HG23 ILE 83 HG23 ILE 83 74.785 41.266 -22.346 466 HD11 ILE 83 HD11 ILE 83 77.693 38.757 -22.113 467 HD12 ILE 83 HD12 ILE 83 78.090 37.636 -20.804 468 HD13 ILE 83 HD13 ILE 83 76.582 37.423 -21.713 469 H PHE 84 H PHE 84 72.262 39.880 -21.018 470 HA PHE 84 HA PHE 84 71.819 42.498 -21.979 471 HB2 PHE 84 HB2 PHE 84 70.849 40.295 -22.846 472 HB3 PHE 84 HB3 PHE 84 69.682 40.380 -21.539 473 HD1 PHE 84 HD1 PHE 84 71.105 42.848 -24.046 474 HD2 PHE 84 HD2 PHE 84 67.559 41.125 -22.285 475 HE1 PHE 84 HE1 PHE 84 69.732 44.168 -25.570 476 HE2 PHE 84 HE2 PHE 84 66.158 42.532 -23.778 477 HZ PHE 84 HZ PHE 84 67.230 44.048 -25.436 478 H ASN 85 H ASN 85 70.277 40.905 -19.146 479 HA ASN 85 HA ASN 85 68.553 43.110 -18.544 480 HB2 ASN 85 HB2 ASN 85 69.531 40.723 -16.912 481 HB3 ASN 85 HB3 ASN 85 68.348 41.878 -16.319 482 HD21 ASN 85 HD22 ASN 85 67.298 39.556 -16.200 483 HD22 ASN 85 HD21 ASN 85 66.265 39.196 -17.574 484 H GLU 86 H GLU 86 71.748 42.173 -17.123 485 HA GLU 86 HA GLU 86 71.843 44.363 -15.248 486 HB2 GLU 86 HB2 GLU 86 74.033 42.677 -16.540 487 HB3 GLU 86 HB3 GLU 86 74.330 43.973 -15.401 488 HG2 GLU 86 HG2 GLU 86 72.899 42.842 -13.705 489 HG3 GLU 86 HG3 GLU 86 72.707 41.475 -14.808 490 H TRP 87 H TRP 87 73.123 44.047 -18.658 491 HA TRP 87 HA TRP 87 74.144 46.723 -18.727 492 HB2 TRP 87 HB2 TRP 87 74.818 45.133 -20.391 493 HB3 TRP 87 HB3 TRP 87 73.150 44.835 -20.862 494 HD1 TRP 87 HD1 TRP 87 75.782 47.667 -21.137 495 HE1 TRP 87 HE1 TRP 87 75.292 48.953 -23.302 496 HE3 TRP 87 HE3 TRP 87 71.421 45.354 -22.505 497 HZ2 TRP 87 HZ2 TRP 87 73.335 48.928 -25.389 498 HZ3 TRP 87 HZ3 TRP 87 70.359 45.927 -24.625 499 HH2 TRP 87 HH2 TRP 87 71.260 47.726 -26.091 500 H GLU 88 H GLU 88 70.848 45.454 -19.705 501 HA GLU 88 HA GLU 88 69.809 47.914 -20.547 502 HB2 GLU 88 HB2 GLU 88 68.592 45.431 -19.333 503 HB3 GLU 88 HB3 GLU 88 67.588 46.843 -19.567 504 HG2 GLU 88 HG2 GLU 88 69.218 45.763 -21.877 505 HG3 GLU 88 HG3 GLU 88 67.671 45.055 -21.432 506 H GLU 89 H GLU 89 69.822 46.687 -17.122 507 HA GLU 89 HA GLU 89 68.517 49.065 -16.097 508 HB2 GLU 89 HB2 GLU 89 70.295 47.002 -14.732 509 HB3 GLU 89 HB3 GLU 89 69.450 48.310 -13.893 510 HG2 GLU 89 HG2 GLU 89 67.280 47.459 -14.783 511 HG3 GLU 89 HG3 GLU 89 68.129 46.098 -15.512 512 H ARG 90 H ARG 90 72.013 48.152 -16.102 513 HA ARG 90 HA ARG 90 72.824 50.667 -14.903 514 HB2 ARG 90 HB2 ARG 90 74.476 48.655 -16.509 515 HB3 ARG 90 HB3 ARG 90 75.122 50.046 -15.604 516 HG2 ARG 90 HG2 ARG 90 73.769 49.110 -13.608 517 HG3 ARG 90 HG3 ARG 90 73.656 47.629 -14.552 518 HD2 ARG 90 HD2 ARG 90 76.315 48.988 -13.888 519 HD3 ARG 90 HD3 ARG 90 75.558 47.883 -12.761 520 HE ARG 90 HE ARG 90 76.857 47.204 -15.323 521 HH11 ARG 90 HH11 ARG 90 74.902 45.908 -12.657 522 HH12 ARG 90 HH12 ARG 90 75.409 44.265 -13.074 523 HH21 ARG 90 HH21 ARG 90 77.434 45.002 -15.611 524 HH22 ARG 90 HH22 ARG 90 76.658 43.820 -14.551 525 H LYS 91 H LYS 91 72.503 49.678 -18.195 526 HA LYS 91 HA LYS 91 73.443 52.202 -19.308 527 HB2 LYS 91 HB2 LYS 91 73.453 49.992 -20.535 528 HB3 LYS 91 HB3 LYS 91 71.710 50.089 -20.695 529 HG2 LYS 91 HG2 LYS 91 73.320 52.405 -21.749 530 HG3 LYS 91 HG3 LYS 91 73.465 50.866 -22.585 531 HD2 LYS 91 HD2 LYS 91 71.002 50.746 -22.864 532 HD3 LYS 91 HD3 LYS 91 70.846 52.349 -22.114 533 HE2 LYS 91 HE2 LYS 91 72.293 53.317 -23.894 534 HE3 LYS 91 HE3 LYS 91 72.478 51.717 -24.621 535 HZ1 LYS 91 HZ1 LYS 91 69.886 53.179 -24.366 536 HZ2 LYS 91 HZ2 LYS 91 70.740 53.000 -25.745 537 HZ3 LYS 91 HZ3 LYS 91 70.063 51.695 -25.037 538 H LYS 92 H LYS 92 70.132 51.109 -18.384 539 HA LYS 92 HA LYS 92 68.831 53.507 -19.293 540 HB2 LYS 92 HB2 LYS 92 67.651 51.469 -18.539 541 HB3 LYS 92 HB3 LYS 92 68.183 51.762 -16.875 542 HG2 LYS 92 HG2 LYS 92 66.937 53.881 -16.834 543 HG3 LYS 92 HG3 LYS 92 66.488 53.664 -18.541 544 HD2 LYS 92 HD2 LYS 92 65.248 51.593 -17.944 545 HD3 LYS 92 HD3 LYS 92 65.698 51.816 -16.238 546 HE2 LYS 92 HE2 LYS 92 64.524 54.010 -16.218 547 HE3 LYS 92 HE3 LYS 92 64.087 53.797 -17.917 548 HZ1 LYS 92 HZ1 LYS 92 63.191 52.022 -15.696 549 HZ2 LYS 92 HZ2 LYS 92 62.265 53.134 -16.447 550 HZ3 LYS 92 HZ3 LYS 92 62.787 51.827 -17.270 551 H SER 93 H SER 93 70.721 52.807 -16.323 552 HA SER 93 HA SER 93 70.555 55.579 -15.401 553 HB2 SER 93 HB2 SER 93 71.065 53.580 -13.967 554 HB3 SER 93 HB3 SER 93 72.687 53.550 -14.682 555 HG SER 93 HG SER 93 72.562 54.771 -12.699 556 H GLU 94 H GLU 94 72.859 53.862 -17.476 557 HA GLU 94 HA GLU 94 74.468 56.326 -17.985 558 HB2 GLU 94 HB2 GLU 94 75.424 53.438 -17.800 559 HB3 GLU 94 HB3 GLU 94 76.402 54.876 -18.045 560 HG2 GLU 94 HG2 GLU 94 75.587 55.689 -15.778 561 HG3 GLU 94 HG3 GLU 94 74.834 54.098 -15.581 562 HA PRO 95 HA PRO 95 72.594 54.693 -21.893 563 HB2 PRO 95 HB2 PRO 95 72.517 57.086 -23.340 564 HB3 PRO 95 HB3 PRO 95 71.264 56.485 -22.217 565 HG2 PRO 95 HG2 PRO 95 73.525 58.418 -21.633 566 HG3 PRO 95 HG3 PRO 95 71.790 58.573 -21.201 567 HD2 PRO 95 HD2 PRO 95 73.555 57.695 -19.380 568 HD3 PRO 95 HD3 PRO 95 71.973 56.879 -19.528 569 H TRP 96 H TRP 96 75.717 55.827 -21.404 570 HA TRP 96 HA TRP 96 76.723 55.393 -24.148 571 HB2 TRP 96 HB2 TRP 96 78.874 56.090 -23.101 572 HB3 TRP 96 HB3 TRP 96 77.590 57.277 -22.974 573 HD1 TRP 96 HD1 TRP 96 79.651 54.880 -20.822 574 HE1 TRP 96 HE1 TRP 96 79.437 55.533 -18.345 575 HE3 TRP 96 HE3 TRP 96 76.039 58.494 -21.241 576 HZ2 TRP 96 HZ2 TRP 96 77.870 57.355 -16.747 577 HZ3 TRP 96 HZ3 TRP 96 75.195 59.662 -19.216 578 HH2 TRP 96 HH2 TRP 96 76.093 59.098 -16.970 579 H LEU 97 H LEU 97 75.983 53.267 -21.555 580 HA LEU 97 HA LEU 97 78.335 51.771 -21.393 581 HB2 LEU 97 HB2 LEU 97 76.242 51.836 -19.858 582 HB3 LEU 97 HB3 LEU 97 75.520 50.722 -20.994 583 HG LEU 97 HG LEU 97 77.360 49.139 -20.558 584 HD11 LEU 97 HD11 LEU 97 78.193 51.133 -18.409 585 HD12 LEU 97 HD12 LEU 97 78.769 49.457 -18.507 586 HD13 LEU 97 HD13 LEU 97 79.180 50.594 -19.786 587 HD21 LEU 97 HD21 LEU 97 75.214 49.045 -19.272 588 HD22 LEU 97 HD22 LEU 97 76.582 48.472 -18.303 589 HD23 LEU 97 HD23 LEU 97 75.931 50.108 -18.046 590 H ARG 98 H ARG 98 79.226 50.115 -22.510 591 HA ARG 98 HA ARG 98 78.108 49.335 -25.101 592 HB2 ARG 98 HB2 ARG 98 80.438 50.038 -24.767 593 HB3 ARG 98 HB3 ARG 98 80.723 48.648 -23.710 594 HG2 ARG 98 HG2 ARG 98 80.442 47.103 -25.575 595 HG3 ARG 98 HG3 ARG 98 79.857 48.410 -26.623 596 HD2 ARG 98 HD2 ARG 98 82.162 47.858 -27.189 597 HD3 ARG 98 HD3 ARG 98 82.045 49.501 -26.544 598 HE ARG 98 HE ARG 98 82.730 47.407 -24.572 599 HH11 ARG 98 HH11 ARG 98 84.068 49.756 -26.802 600 HH12 ARG 98 HH12 ARG 98 85.502 49.981 -25.871 601 HH21 ARG 98 HH21 ARG 98 84.692 47.643 -23.474 602 HH22 ARG 98 HH22 ARG 98 85.925 48.667 -24.152 603 H LEU 99 H LEU 99 77.847 47.222 -25.846 604 HA LEU 99 HA LEU 99 77.142 45.117 -23.849 605 HB2 LEU 99 HB2 LEU 99 75.273 46.510 -24.563 606 HB3 LEU 99 HB3 LEU 99 75.568 46.189 -26.235 607 HG LEU 99 HG LEU 99 73.592 45.063 -25.215 608 HD11 LEU 99 HD11 LEU 99 75.508 42.939 -26.189 609 HD12 LEU 99 HD12 LEU 99 73.776 43.158 -26.541 610 HD13 LEU 99 HD13 LEU 99 74.947 44.238 -27.257 611 HD21 LEU 99 HD21 LEU 99 74.800 44.564 -23.016 612 HD22 LEU 99 HD22 LEU 99 73.565 43.493 -23.637 613 HD23 LEU 99 HD23 LEU 99 75.306 43.065 -23.819 614 H ASP 100 H ASP 100 77.966 43.122 -24.389 615 HA ASP 100 HA ASP 100 78.494 42.427 -27.218 616 HB2 ASP 100 HB2 ASP 100 80.592 43.429 -26.146 617 HB3 ASP 100 HB3 ASP 100 80.631 42.014 -25.098 618 H MET 101 H MET 101 78.079 40.311 -27.661 619 HA MET 101 HA MET 101 77.547 38.407 -25.426 620 HB2 MET 101 HB2 MET 101 75.671 38.974 -27.754 621 HB3 MET 101 HB3 MET 101 75.467 37.693 -26.550 622 HG2 MET 101 HG2 MET 101 75.288 39.357 -24.755 623 HG3 MET 101 HG3 MET 101 75.470 40.662 -25.937 624 HE1 MET 101 HE1 MET 101 73.181 41.847 -25.081 625 HE2 MET 101 HE2 MET 101 71.690 40.902 -24.923 626 HE3 MET 101 HE3 MET 101 73.079 40.534 -23.878 627 H SER 102 H SER 102 79.695 38.748 -27.686 628 HA SER 102 HA SER 102 79.462 36.264 -29.225 629 HB2 SER 102 HB2 SER 102 81.815 38.111 -28.675 630 HB3 SER 102 HB3 SER 102 81.863 36.698 -29.746 631 HG SER 102 HG SER 102 81.417 38.673 -30.884 632 H ASP 103 H ASP 103 80.790 34.359 -28.898 633 HA ASP 103 HA ASP 103 80.412 33.297 -26.379 634 HB2 ASP 103 HB2 ASP 103 82.422 32.384 -28.473 635 HB3 ASP 103 HB3 ASP 103 81.833 31.414 -27.124 636 H LYS 104 H LYS 104 83.411 34.844 -27.491 637 HA LYS 104 HA LYS 104 85.063 34.095 -25.249 638 HB2 LYS 104 HB2 LYS 104 85.219 36.297 -27.335 639 HB3 LYS 104 HB3 LYS 104 86.261 36.344 -25.925 640 HG2 LYS 104 HG2 LYS 104 87.545 35.288 -27.568 641 HG3 LYS 104 HG3 LYS 104 87.088 34.057 -26.408 642 HD2 LYS 104 HD2 LYS 104 86.975 33.082 -28.565 643 HD3 LYS 104 HD3 LYS 104 85.303 33.270 -28.037 644 HE2 LYS 104 HE2 LYS 104 85.095 35.329 -29.439 645 HE3 LYS 104 HE3 LYS 104 86.809 35.229 -29.849 646 HZ1 LYS 104 HZ1 LYS 104 84.776 33.184 -30.621 647 HZ2 LYS 104 HZ2 LYS 104 85.429 34.298 -31.622 648 HZ3 LYS 104 HZ3 LYS 104 86.368 33.124 -30.997 649 H ALA 105 H ALA 105 82.650 36.680 -25.525 650 HA ALA 105 HA ALA 105 83.388 38.075 -23.109 651 HB1 ALA 105 HB1 ALA 105 80.665 37.829 -24.457 652 HB2 ALA 105 HB2 ALA 105 81.141 39.046 -23.272 653 HB3 ALA 105 HB3 ALA 105 81.917 39.022 -24.865 654 H ILE 106 H ILE 106 81.335 35.273 -23.754 655 HA ILE 106 HA ILE 106 80.406 34.998 -21.003 656 HB ILE 106 HB ILE 106 80.170 33.314 -23.516 657 HG12 ILE 106 HG12 ILE 106 77.774 33.717 -23.208 658 HG13 ILE 106 HG13 ILE 106 78.079 34.609 -21.717 659 HG21 ILE 106 HG21 ILE 106 79.174 32.538 -20.735 660 HG22 ILE 106 HG22 ILE 106 78.676 31.770 -22.258 661 HG23 ILE 106 HG23 ILE 106 80.351 31.649 -21.735 662 HD11 ILE 106 HD11 ILE 106 79.026 35.500 -24.473 663 HD12 ILE 106 HD12 ILE 106 77.531 36.043 -23.680 664 HD13 ILE 106 HD13 ILE 106 79.098 36.446 -22.966 665 H PHE 107 H PHE 107 82.850 33.241 -23.004 666 HA PHE 107 HA PHE 107 83.832 31.510 -21.006 667 HB2 PHE 107 HB2 PHE 107 85.552 33.051 -22.989 668 HB3 PHE 107 HB3 PHE 107 85.971 31.550 -22.190 669 HD1 PHE 107 HD2 PHE 107 82.924 30.428 -22.876 670 HD2 PHE 107 HD1 PHE 107 86.278 32.058 -25.034 671 HE1 PHE 107 HE2 PHE 107 82.257 29.133 -24.881 672 HE2 PHE 107 HE1 PHE 107 85.606 30.752 -27.056 673 HZ PHE 107 HZ PHE 107 83.597 29.286 -26.971 674 H ARG 108 H ARG 108 84.880 34.882 -21.647 675 HA ARG 108 HA ARG 108 86.866 34.904 -19.588 676 HB2 ARG 108 HB2 ARG 108 86.750 36.075 -21.822 677 HB3 ARG 108 HB3 ARG 108 85.637 37.246 -21.115 678 HG2 ARG 108 HG2 ARG 108 88.429 36.652 -20.044 679 HG3 ARG 108 HG3 ARG 108 88.110 37.828 -21.320 680 HD2 ARG 108 HD2 ARG 108 86.646 39.117 -19.775 681 HD3 ARG 108 HD3 ARG 108 87.079 37.996 -18.465 682 HE ARG 108 HE ARG 108 89.470 38.990 -19.652 683 HH11 ARG 108 HH11 ARG 108 86.902 40.180 -17.576 684 HH12 ARG 108 HH12 ARG 108 87.934 41.370 -16.833 685 HH21 ARG 108 HH21 ARG 108 90.726 40.527 -18.662 686 HH22 ARG 108 HH22 ARG 108 90.045 41.557 -17.437 687 H ARG 109 H ARG 109 83.502 36.189 -19.656 688 HA ARG 109 HA ARG 109 83.618 37.229 -16.914 689 HB2 ARG 109 HB2 ARG 109 81.337 36.456 -18.778 690 HB3 ARG 109 HB3 ARG 109 81.067 37.039 -17.132 691 HG2 ARG 109 HG2 ARG 109 82.078 39.156 -17.562 692 HG3 ARG 109 HG3 ARG 109 82.709 38.630 -19.128 693 HD2 ARG 109 HD2 ARG 109 80.427 38.454 -20.039 694 HD3 ARG 109 HD3 ARG 109 79.743 38.776 -18.446 695 HE ARG 109 HE ARG 109 80.004 41.019 -18.767 696 HH11 ARG 109 HH11 ARG 109 82.262 39.540 -21.007 697 HH12 ARG 109 HH12 ARG 109 82.667 41.073 -21.741 698 HH21 ARG 109 HH21 ARG 109 80.559 42.919 -19.749 699 HH22 ARG 109 HH22 ARG 109 81.713 42.934 -21.045 700 H TYR 110 H TYR 110 82.694 34.112 -18.302 701 HA TYR 110 HA TYR 110 82.159 32.992 -15.586 702 HB2 TYR 110 HB2 TYR 110 80.666 32.455 -18.165 703 HB3 TYR 110 HB3 TYR 110 80.277 31.870 -16.568 704 HD1 TYR 110 HD2 TYR 110 80.211 33.981 -14.723 705 HD2 TYR 110 HD1 TYR 110 79.283 34.149 -18.934 706 HE1 TYR 110 HE2 TYR 110 78.898 36.074 -14.369 707 HE2 TYR 110 HE1 TYR 110 77.929 36.210 -18.561 708 HH TYR 110 HH TYR 110 77.188 37.766 -17.014 709 HA PRO 111 HA PRO 111 85.481 30.549 -17.642 710 HB2 PRO 111 HB2 PRO 111 86.947 29.877 -15.416 711 HB3 PRO 111 HB3 PRO 111 87.036 31.471 -16.228 712 HG2 PRO 111 HG2 PRO 111 85.363 30.702 -13.811 713 HG3 PRO 111 HG3 PRO 111 86.465 32.110 -13.991 714 HD2 PRO 111 HD2 PRO 111 83.808 32.355 -14.389 715 HD3 PRO 111 HD3 PRO 111 84.963 33.208 -15.460 716 H HIS 112 H HIS 112 82.990 29.557 -15.537 717 HA HIS 112 HA HIS 112 83.594 26.672 -15.702 718 HB2 HIS 112 HB2 HIS 112 81.657 26.405 -14.367 719 HB3 HIS 112 HB3 HIS 112 82.540 27.772 -13.707 720 HD2 HIS 112 HD2 HIS 112 79.175 26.822 -14.100 721 HE1 HIS 112 HE1 HIS 112 78.875 30.909 -15.239 722 HE2 HIS 112 HE2 HIS 112 77.602 28.954 -14.395 723 H LEU 113 H LEU 113 81.859 29.066 -17.585 724 HA LEU 113 HA LEU 113 80.065 27.166 -18.830 725 HB2 LEU 113 HB2 LEU 113 80.025 29.848 -18.049 726 HB3 LEU 113 HB3 LEU 113 80.252 29.988 -19.772 727 HG LEU 113 HG LEU 113 77.934 30.164 -19.099 728 HD11 LEU 113 HD11 LEU 113 78.348 27.511 -20.534 729 HD12 LEU 113 HD12 LEU 113 76.947 28.576 -20.662 730 HD13 LEU 113 HD13 LEU 113 78.512 29.109 -21.296 731 HD21 LEU 113 HD21 LEU 113 78.020 28.728 -17.086 732 HD22 LEU 113 HD22 LEU 113 76.647 28.390 -18.130 733 HD23 LEU 113 HD23 LEU 113 78.028 27.283 -18.113 734 H ARG 114 H ARG 114 83.200 28.251 -19.556 735 HA ARG 114 HA ARG 114 83.187 28.098 -22.445 736 HB2 ARG 114 HB2 ARG 114 85.601 28.087 -22.277 737 HB3 ARG 114 HB3 ARG 114 84.926 29.297 -21.181 738 HG2 ARG 114 HG2 ARG 114 85.153 27.597 -19.305 739 HG3 ARG 114 HG3 ARG 114 86.020 26.545 -20.430 740 HD2 ARG 114 HD2 ARG 114 87.781 28.183 -20.701 741 HD3 ARG 114 HD3 ARG 114 86.883 29.382 -19.753 742 HE ARG 114 HE ARG 114 87.002 27.736 -17.833 743 HH11 ARG 114 HH11 ARG 114 89.623 27.805 -20.175 744 HH12 ARG 114 HH12 ARG 114 90.765 27.136 -19.040 745 HH21 ARG 114 HH21 ARG 114 88.497 26.894 -16.464 746 HH22 ARG 114 HH22 ARG 114 90.138 26.644 -16.986 Start of MODEL 13 1 H1 MET 1 H1 MET 1 109.468 23.864 -98.841 2 H2 MET 1 H2 MET 1 109.537 25.349 -98.173 3 H3 MET 1 H3 MET 1 108.398 25.009 -99.301 4 HA MET 1 HA MET 1 108.556 23.798 -96.602 5 HB2 MET 1 HB2 MET 1 106.573 25.839 -97.724 6 HB3 MET 1 HB3 MET 1 106.316 24.925 -96.240 7 HG2 MET 1 HG2 MET 1 108.351 25.909 -95.242 8 HG3 MET 1 HG3 MET 1 108.636 26.828 -96.720 9 HE1 MET 1 HE1 MET 1 106.551 26.464 -93.447 10 HE2 MET 1 HE2 MET 1 105.274 27.684 -93.641 11 HE3 MET 1 HE3 MET 1 105.230 26.201 -94.612 12 H ARG 2 H ARG 2 106.849 22.350 -96.033 13 HA ARG 2 HA ARG 2 105.658 20.442 -96.345 14 HB2 ARG 2 HB2 ARG 2 104.093 22.458 -96.639 15 HB3 ARG 2 HB3 ARG 2 104.054 22.043 -98.354 16 HG2 ARG 2 HG2 ARG 2 103.227 19.724 -97.679 17 HG3 ARG 2 HG3 ARG 2 103.240 20.266 -95.999 18 HD2 ARG 2 HD2 ARG 2 100.976 20.433 -96.828 19 HD3 ARG 2 HD3 ARG 2 101.606 22.054 -96.572 20 HE ARG 2 HE ARG 2 101.492 22.491 -98.845 21 HH11 ARG 2 HH11 ARG 2 100.947 19.042 -98.468 22 HH12 ARG 2 HH12 ARG 2 100.489 18.845-100.137 23 HH21 ARG 2 HH21 ARG 2 100.913 22.160-100.956 24 HH22 ARG 2 HH22 ARG 2 100.470 20.571-101.504 25 H GLY 3 H GLY 3 107.916 20.027 -97.640 26 HA2 GLY 3 HA2 GLY 3 107.596 19.038-100.370 27 HA3 GLY 3 HA3 GLY 3 108.966 18.768 -99.296 28 H SER 4 H SER 4 105.932 17.551-100.430 29 HA SER 4 HA SER 4 104.740 15.651-100.244 30 HB2 SER 4 HB2 SER 4 107.300 14.343 -99.274 31 HB3 SER 4 HB3 SER 4 105.842 13.507 -99.821 32 HG SER 4 HG SER 4 107.417 13.721-101.499 33 H HIS 5 H HIS 5 103.960 13.839 -98.734 34 HA HIS 5 HA HIS 5 103.356 14.961 -96.080 35 HB2 HIS 5 HB2 HIS 5 101.847 13.105 -95.839 36 HB3 HIS 5 HB3 HIS 5 101.601 13.851 -97.410 37 HD2 HIS 5 HD2 HIS 5 102.038 12.353 -99.575 38 HE1 HIS 5 HE1 HIS 5 103.110 8.730 -97.592 39 HE2 HIS 5 HE2 HIS 5 102.537 9.777 -99.841 40 H HIS 6 H HIS 6 103.571 13.598 -94.128 41 HA HIS 6 HA HIS 6 106.344 12.537 -93.995 42 HB2 HIS 6 HB2 HIS 6 104.595 13.561 -91.742 43 HB3 HIS 6 HB3 HIS 6 106.302 13.123 -91.659 44 HD2 HIS 6 HD2 HIS 6 108.060 14.807 -92.949 45 HE1 HIS 6 HE1 HIS 6 105.318 18.039 -93.447 46 HE2 HIS 6 HE2 HIS 6 107.767 17.352 -93.577 47 H HIS 7 H HIS 7 103.716 11.785 -91.752 48 HA HIS 7 HA HIS 7 103.587 8.951 -92.607 49 HB2 HIS 7 HB2 HIS 7 104.434 9.783 -89.796 50 HB3 HIS 7 HB3 HIS 7 103.868 8.176 -90.235 51 HD2 HIS 7 HD2 HIS 7 106.954 10.383 -90.326 52 HE1 HIS 7 HE1 HIS 7 108.095 6.702 -92.159 53 HE2 HIS 7 HE2 HIS 7 108.949 8.920 -91.246 54 H HIS 8 H HIS 8 102.565 11.061 -89.877 55 HA HIS 8 HA HIS 8 99.750 10.969 -90.689 56 HB2 HIS 8 HB2 HIS 8 100.038 8.870 -89.373 57 HB3 HIS 8 HB3 HIS 8 100.685 9.805 -88.026 58 HD2 HIS 8 HD2 HIS 8 97.382 9.489 -90.091 59 HE1 HIS 8 HE1 HIS 8 96.313 10.810 -86.177 60 HE2 HIS 8 HE2 HIS 8 95.409 10.091 -88.447 61 H HIS 9 H HIS 9 98.510 12.607 -89.703 62 HA HIS 9 HA HIS 9 99.779 14.432 -87.739 63 HB2 HIS 9 HB2 HIS 9 98.649 15.279 -90.434 64 HB3 HIS 9 HB3 HIS 9 98.841 16.382 -89.076 65 HD2 HIS 9 HD2 HIS 9 100.775 14.953 -91.953 66 HE1 HIS 9 HE1 HIS 9 103.676 16.890 -89.495 67 HE2 HIS 9 HE2 HIS 9 103.263 15.845 -91.770 68 H HIS 10 H HIS 10 98.337 15.559 -86.437 69 HA HIS 10 HA HIS 10 95.427 15.039 -86.670 70 HB2 HIS 10 HB2 HIS 10 96.353 13.124 -85.405 71 HB3 HIS 10 HB3 HIS 10 97.121 14.231 -84.267 72 HD2 HIS 10 HD2 HIS 10 93.538 13.233 -85.470 73 HE1 HIS 10 HE1 HIS 10 93.156 14.799 -81.518 74 HE2 HIS 10 HE2 HIS 10 91.905 13.722 -83.456 75 H GLY 11 H GLY 11 94.113 16.409 -85.441 76 HA2 GLY 11 HA2 GLY 11 94.973 18.237 -83.470 77 HA3 GLY 11 HA3 GLY 11 94.873 19.114 -85.001 78 H SER 28 H SER 28 93.271 19.530 -82.636 79 HA SER 28 HA SER 28 90.514 19.091 -83.699 80 HB2 SER 28 HB2 SER 28 91.404 18.561 -80.836 81 HB3 SER 28 HB3 SER 28 89.729 18.561 -81.416 82 HG SER 28 HG SER 28 90.576 16.439 -81.339 83 H VAL 29 H VAL 29 89.012 20.643 -83.176 84 HA VAL 29 HA VAL 29 89.748 22.933 -81.441 85 HB VAL 29 HB VAL 29 88.832 24.551 -83.067 86 HG11 VAL 29 HG11 VAL 29 91.251 23.072 -84.164 87 HG12 VAL 29 HG12 VAL 29 90.807 24.766 -84.446 88 HG13 VAL 29 HG13 VAL 29 91.275 24.238 -82.822 89 HG21 VAL 29 HG21 VAL 29 87.529 23.045 -84.542 90 HG22 VAL 29 HG22 VAL 29 88.686 24.021 -85.453 91 HG23 VAL 29 HG23 VAL 29 89.039 22.314 -85.131 92 H SER 30 H SER 30 87.990 24.127 -80.625 93 HA SER 30 HA SER 30 85.236 23.317 -81.208 94 HB2 SER 30 HB2 SER 30 85.998 21.677 -79.469 95 HB3 SER 30 HB3 SER 30 86.325 23.038 -78.378 96 HG SER 30 HG SER 30 84.211 22.099 -78.083 97 H PHE 31 H PHE 31 83.714 24.869 -80.528 98 HA PHE 31 HA PHE 31 84.745 27.451 -79.459 99 HB2 PHE 31 HB2 PHE 31 83.189 27.176 -82.057 100 HB3 PHE 31 HB3 PHE 31 83.733 28.673 -81.317 101 HD1 PHE 31 HD2 PHE 31 86.264 29.099 -81.089 102 HD2 PHE 31 HD1 PHE 31 84.620 25.946 -83.535 103 HE1 PHE 31 HE2 PHE 31 88.414 28.933 -82.325 104 HE2 PHE 31 HE1 PHE 31 86.769 25.788 -84.770 105 HZ PHE 31 HZ PHE 31 88.671 27.276 -84.164 106 H GLY 32 H GLY 32 83.226 28.821 -78.565 107 HA2 GLY 32 HA2 GLY 32 81.208 29.513 -77.642 108 HA3 GLY 32 HA3 GLY 32 80.374 28.129 -78.335 109 H ALA 33 H ALA 33 80.868 29.469 -75.515 110 HA ALA 33 HA ALA 33 80.748 26.965 -73.947 111 HB1 ALA 33 HB1 ALA 33 82.896 29.085 -73.515 112 HB2 ALA 33 HB2 ALA 33 82.561 27.708 -72.440 113 HB3 ALA 33 HB3 ALA 33 83.150 27.423 -74.087 114 HA PRO 34 HA PRO 34 77.900 30.414 -72.568 115 HB2 PRO 34 HB2 PRO 34 75.581 28.965 -72.375 116 HB3 PRO 34 HB3 PRO 34 76.180 29.676 -73.906 117 HG2 PRO 34 HG2 PRO 34 76.550 26.833 -72.906 118 HG3 PRO 34 HG3 PRO 34 75.987 27.372 -74.520 119 HD2 PRO 34 HD2 PRO 34 78.572 26.680 -74.075 120 HD3 PRO 34 HD3 PRO 34 78.163 28.047 -75.156 121 H SER 35 H SER 35 77.263 30.882 -70.495 122 HA SER 35 HA SER 35 77.415 28.837 -68.346 123 HB2 SER 35 HB2 SER 35 79.038 30.265 -67.098 124 HB3 SER 35 HB3 SER 35 79.678 29.487 -68.547 125 HG SER 35 HG SER 35 80.319 31.697 -68.399 126 HA PRO 36 HA PRO 36 74.094 32.107 -67.654 127 HB2 PRO 36 HB2 PRO 36 71.949 30.416 -67.370 128 HB3 PRO 36 HB3 PRO 36 72.505 31.058 -68.948 129 HG2 PRO 36 HG2 PRO 36 73.179 28.374 -67.691 130 HG3 PRO 36 HG3 PRO 36 72.597 28.703 -69.357 131 HD2 PRO 36 HD2 PRO 36 75.232 28.368 -68.828 132 HD3 PRO 36 HD3 PRO 36 74.688 29.596 -70.010 133 H LEU 37 H LEU 37 73.436 32.708 -65.645 134 HA LEU 37 HA LEU 37 74.051 30.932 -63.333 135 HB2 LEU 37 HB2 LEU 37 75.537 32.429 -62.388 136 HB3 LEU 37 HB3 LEU 37 76.008 32.311 -64.069 137 HG LEU 37 HG LEU 37 74.539 34.645 -62.748 138 HD11 LEU 37 HD11 LEU 37 77.347 34.406 -63.895 139 HD12 LEU 37 HD12 LEU 37 76.626 35.854 -63.157 140 HD13 LEU 37 HD13 LEU 37 76.927 34.418 -62.167 141 HD21 LEU 37 HD21 LEU 37 73.786 34.597 -65.055 142 HD22 LEU 37 HD22 LEU 37 74.988 35.869 -64.884 143 HD23 LEU 37 HD23 LEU 37 75.454 34.329 -65.636 144 H SER 38 H SER 38 71.463 32.247 -64.474 145 HA SER 38 HA SER 38 70.324 32.844 -61.815 146 HB2 SER 38 HB2 SER 38 71.002 35.057 -62.662 147 HB3 SER 38 HB3 SER 38 70.073 34.778 -64.148 148 HG SER 38 HG SER 38 68.906 36.004 -62.548 149 H SER 39 H SER 39 68.220 32.353 -61.608 150 HA SER 39 HA SER 39 66.509 31.826 -63.957 151 HB2 SER 39 HB2 SER 39 67.657 29.648 -63.097 152 HB3 SER 39 HB3 SER 39 66.545 29.781 -61.723 153 HG SER 39 HG SER 39 65.699 28.499 -63.463 154 H GLU 40 H GLU 40 66.856 33.809 -61.693 155 HA GLU 40 HA GLU 40 64.394 33.442 -60.060 156 HB2 GLU 40 HB2 GLU 40 66.944 35.047 -59.651 157 HB3 GLU 40 HB3 GLU 40 65.523 35.190 -58.624 158 HG2 GLU 40 HG2 GLU 40 67.100 33.725 -57.559 159 HG3 GLU 40 HG3 GLU 40 65.645 32.839 -57.991 160 H SER 41 H SER 41 62.997 35.120 -59.585 161 HA SER 41 HA SER 41 63.033 37.571 -61.282 162 HB2 SER 41 HB2 SER 41 61.649 35.704 -62.320 163 HB3 SER 41 HB3 SER 41 60.542 35.870 -60.947 164 HG SER 41 HG SER 41 59.925 37.167 -62.775 165 H GLU 42 H GLU 42 63.952 37.810 -58.914 166 HA GLU 42 HA GLU 42 63.852 38.669 -56.825 167 HB2 GLU 42 HB2 GLU 42 61.338 40.069 -57.775 168 HB3 GLU 42 HB3 GLU 42 62.320 40.500 -56.374 169 HG2 GLU 42 HG2 GLU 42 64.275 40.894 -57.864 170 HG3 GLU 42 HG3 GLU 42 63.260 40.560 -59.270 171 H ASP 43 H ASP 43 62.169 36.131 -57.417 172 HA ASP 43 HA ASP 43 60.127 36.110 -55.396 173 HB2 ASP 43 HB2 ASP 43 59.767 33.820 -56.177 174 HB3 ASP 43 HB3 ASP 43 59.905 34.940 -57.524 175 H GLU 44 H GLU 44 63.437 35.454 -55.223 176 HA GLU 44 HA GLU 44 63.141 34.381 -52.442 177 HB2 GLU 44 HB2 GLU 44 63.803 32.690 -54.262 178 HB3 GLU 44 HB3 GLU 44 65.353 33.530 -54.343 179 HG2 GLU 44 HG2 GLU 44 65.804 32.946 -51.989 180 HG3 GLU 44 HG3 GLU 44 64.165 32.317 -51.803 181 H ILE 45 H ILE 45 64.007 37.071 -54.017 182 HA ILE 45 HA ILE 45 66.655 37.510 -52.768 183 HB ILE 45 HB ILE 45 65.258 39.329 -54.739 184 HG12 ILE 45 HG12 ILE 45 65.433 37.194 -55.879 185 HG13 ILE 45 HG13 ILE 45 66.605 38.319 -56.523 186 HG21 ILE 45 HG21 ILE 45 68.181 39.017 -53.894 187 HG22 ILE 45 HG22 ILE 45 67.609 40.051 -55.219 188 HG23 ILE 45 HG23 ILE 45 67.123 40.396 -53.561 189 HD11 ILE 45 HD11 ILE 45 67.235 36.044 -54.583 190 HD12 ILE 45 HD12 ILE 45 67.531 36.056 -56.328 191 HD13 ILE 45 HD13 ILE 45 68.423 37.169 -55.283 192 H ASN 46 H ASN 46 65.264 37.311 -50.745 193 HA ASN 46 HA ASN 46 64.915 40.039 -49.622 194 HB2 ASN 46 HB2 ASN 46 62.665 39.294 -50.379 195 HB3 ASN 46 HB3 ASN 46 62.818 37.829 -49.409 196 HD21 ASN 46 HD22 ASN 46 60.668 38.889 -48.654 197 HD22 ASN 46 HD21 ASN 46 60.819 39.970 -47.275 198 H TYR 47 H TYR 47 66.462 40.040 -48.112 199 HA TYR 47 HA TYR 47 66.596 38.008 -46.001 200 HB2 TYR 47 HB2 TYR 47 68.934 37.448 -46.403 201 HB3 TYR 47 HB3 TYR 47 67.955 36.994 -47.776 202 HD1 TYR 47 HD2 TYR 47 68.087 38.280 -49.928 203 HD2 TYR 47 HD1 TYR 47 70.710 39.094 -46.599 204 HE1 TYR 47 HE2 TYR 47 69.613 39.554 -51.436 205 HE2 TYR 47 HE1 TYR 47 72.228 40.364 -48.105 206 HH TYR 47 HH TYR 47 72.625 41.100 -50.250 207 H MET 48 H MET 48 68.343 38.569 -44.392 208 HA MET 48 HA MET 48 69.041 39.952 -42.768 209 HB2 MET 48 HB2 MET 48 70.651 40.420 -44.666 210 HB3 MET 48 HB3 MET 48 69.807 41.952 -44.909 211 HG2 MET 48 HG2 MET 48 70.304 42.522 -42.504 212 HG3 MET 48 HG3 MET 48 71.202 41.014 -42.362 213 HE1 MET 48 HE1 MET 48 72.878 40.840 -45.135 214 HE2 MET 48 HE2 MET 48 74.361 41.642 -44.584 215 HE3 MET 48 HE3 MET 48 73.508 40.521 -43.501 216 H THR 49 H THR 49 66.418 39.957 -42.869 217 HA THR 49 HA THR 49 65.579 42.736 -42.136 218 HB THR 49 HB THR 49 63.272 42.027 -42.933 219 HG1 THR 49 HG1 THR 49 63.273 40.380 -44.508 220 HG21 THR 49 HG21 THR 49 65.446 42.224 -45.050 221 HG22 THR 49 HG22 THR 49 63.718 42.575 -45.262 222 HG23 THR 49 HG23 THR 49 64.702 43.591 -44.197 223 HA PRO 50 HA PRO 50 64.814 39.761 -38.567 224 HB2 PRO 50 HB2 PRO 50 66.415 40.860 -36.647 225 HB3 PRO 50 HB3 PRO 50 67.022 39.691 -37.861 226 HG2 PRO 50 HG2 PRO 50 67.161 42.728 -37.975 227 HG3 PRO 50 HG3 PRO 50 68.497 41.554 -38.210 228 HD2 PRO 50 HD2 PRO 50 67.150 42.612 -40.318 229 HD3 PRO 50 HD3 PRO 50 67.684 40.903 -40.321 230 HA PRO 51 HA PRO 51 61.902 42.708 -36.887 231 HB2 PRO 51 HB2 PRO 51 61.121 41.554 -34.550 232 HB3 PRO 51 HB3 PRO 51 60.723 40.854 -36.151 233 HG2 PRO 51 HG2 PRO 51 63.010 40.088 -34.302 234 HG3 PRO 51 HG3 PRO 51 61.832 39.004 -35.109 235 HD2 PRO 51 HD2 PRO 51 64.308 39.487 -36.154 236 HD3 PRO 51 HD3 PRO 51 62.876 39.277 -37.207 237 H GLU 52 H GLU 52 61.700 44.432 -35.449 238 HA GLU 52 HA GLU 52 64.107 45.084 -33.848 239 HB2 GLU 52 HB2 GLU 52 63.374 47.359 -33.951 240 HB3 GLU 52 HB3 GLU 52 63.350 46.648 -35.563 241 HG2 GLU 52 HG2 GLU 52 60.871 46.348 -35.377 242 HG3 GLU 52 HG3 GLU 52 60.911 47.091 -33.778 243 H GLN 53 H GLN 53 60.865 44.095 -33.223 244 HA GLN 53 HA GLN 53 61.255 44.386 -30.314 245 HB2 GLN 53 HB2 GLN 53 60.214 46.525 -31.362 246 HB3 GLN 53 HB3 GLN 53 58.752 45.566 -31.573 247 HG2 GLN 53 HG2 GLN 53 58.720 45.160 -29.087 248 HG3 GLN 53 HG3 GLN 53 60.212 46.087 -28.933 249 HE21 GLN 53 HE22 GLN 53 60.114 48.459 -29.503 250 HE22 GLN 53 HE21 GLN 53 58.562 49.270 -29.342 251 H GLU 54 H GLU 54 61.259 42.040 -31.855 252 HA GLU 54 HA GLU 54 58.995 40.553 -30.727 253 HB2 GLU 54 HB2 GLU 54 58.667 41.449 -33.279 254 HB3 GLU 54 HB3 GLU 54 59.581 39.977 -33.617 255 HG2 GLU 54 HG2 GLU 54 57.889 38.675 -32.317 256 HG3 GLU 54 HG3 GLU 54 57.019 40.170 -31.979 257 H ALA 55 H ALA 55 59.369 38.110 -31.511 258 HA ALA 55 HA ALA 55 60.512 36.230 -31.069 259 HB1 ALA 55 HB1 ALA 55 62.771 37.608 -32.555 260 HB2 ALA 55 HB2 ALA 55 62.525 35.860 -32.362 261 HB3 ALA 55 HB3 ALA 55 61.365 36.816 -33.300 262 H GLN 56 H GLN 56 60.495 38.008 -28.887 263 HA GLN 56 HA GLN 56 62.606 36.773 -27.255 264 HB2 GLN 56 HB2 GLN 56 63.602 38.914 -28.088 265 HB3 GLN 56 HB3 GLN 56 62.296 39.806 -27.307 266 HG2 GLN 56 HG2 GLN 56 63.028 38.837 -25.090 267 HG3 GLN 56 HG3 GLN 56 64.333 37.990 -25.922 268 HE21 GLN 56 HE22 GLN 56 66.154 39.281 -26.764 269 HE22 GLN 56 HE21 GLN 56 66.376 40.924 -26.181 270 HA PRO 57 HA PRO 57 58.313 37.155 -25.554 271 HB2 PRO 57 HB2 PRO 57 57.562 34.583 -25.358 272 HB3 PRO 57 HB3 PRO 57 57.791 35.376 -26.951 273 HG2 PRO 57 HG2 PRO 57 59.811 33.647 -25.467 274 HG3 PRO 57 HG3 PRO 57 59.213 33.447 -27.147 275 HD2 PRO 57 HD2 PRO 57 61.513 34.822 -26.550 276 HD3 PRO 57 HD3 PRO 57 60.446 35.278 -27.911 277 H GLY 58 H GLY 58 60.049 38.024 -23.923 278 HA2 GLY 58 HA2 GLY 58 60.533 38.299 -21.651 279 HA3 GLY 58 HA3 GLY 58 59.705 36.794 -21.265 280 H ALA 59 H ALA 59 61.940 37.196 -19.927 281 HA ALA 59 HA ALA 59 63.814 35.151 -20.945 282 HB1 ALA 59 HB1 ALA 59 64.680 37.985 -20.209 283 HB2 ALA 59 HB2 ALA 59 65.768 36.622 -20.538 284 HB3 ALA 59 HB3 ALA 59 64.731 37.256 -21.830 285 H LEU 60 H LEU 60 64.549 33.866 -19.388 286 HA LEU 60 HA LEU 60 64.521 34.687 -16.515 287 HB2 LEU 60 HB2 LEU 60 63.605 32.040 -17.739 288 HB3 LEU 60 HB3 LEU 60 64.014 32.236 -16.054 289 HG LEU 60 HG LEU 60 61.704 32.181 -16.171 290 HD11 LEU 60 HD11 LEU 60 62.379 35.124 -15.826 291 HD12 LEU 60 HD12 LEU 60 60.993 34.249 -15.151 292 HD13 LEU 60 HD13 LEU 60 62.630 33.857 -14.601 293 HD21 LEU 60 HD21 LEU 60 61.420 32.819 -18.576 294 HD22 LEU 60 HD22 LEU 60 60.236 33.519 -17.460 295 HD23 LEU 60 HD23 LEU 60 61.546 34.524 -18.083 296 H ALA 61 H ALA 61 66.140 33.677 -15.217 297 HA ALA 61 HA ALA 61 68.135 31.988 -16.542 298 HB1 ALA 61 HB1 ALA 61 68.852 34.578 -15.102 299 HB2 ALA 61 HB2 ALA 61 70.014 33.356 -15.653 300 HB3 ALA 61 HB3 ALA 61 69.042 34.247 -16.838 301 H ALA 62 H ALA 62 69.198 30.576 -15.242 302 HA ALA 62 HA ALA 62 68.459 30.395 -12.364 303 HB1 ALA 62 HB1 ALA 62 69.897 28.421 -14.178 304 HB2 ALA 62 HB2 ALA 62 69.445 28.150 -12.483 305 HB3 ALA 62 HB3 ALA 62 68.183 28.358 -13.712 306 H LEU 63 H LEU 63 70.143 30.061 -10.788 307 HA LEU 63 HA LEU 63 72.744 31.396 -11.404 308 HB2 LEU 63 HB2 LEU 63 70.924 31.932 -9.025 309 HB3 LEU 63 HB3 LEU 63 72.510 32.648 -9.286 310 HG LEU 63 HG LEU 63 70.048 33.142 -11.024 311 HD11 LEU 63 HD11 LEU 63 71.478 34.906 -8.991 312 HD12 LEU 63 HD12 LEU 63 70.088 35.374 -9.996 313 HD13 LEU 63 HD13 LEU 63 69.901 34.122 -8.759 314 HD21 LEU 63 HD21 LEU 63 72.108 33.418 -12.351 315 HD22 LEU 63 HD22 LEU 63 71.411 34.995 -11.963 316 HD23 LEU 63 HD23 LEU 63 72.825 34.402 -11.065 317 H HIS 64 H HIS 64 74.440 31.011 -9.904 318 HA HIS 64 HA HIS 64 74.278 28.531 -8.257 319 HB2 HIS 64 HB2 HIS 64 76.507 30.410 -9.042 320 HB3 HIS 64 HB3 HIS 64 76.721 29.158 -7.823 321 HD2 HIS 64 HD2 HIS 64 77.072 29.761 -11.459 322 HE1 HIS 64 HE1 HIS 64 76.964 25.510 -11.080 323 HE2 HIS 64 HE2 HIS 64 77.532 27.435 -12.626 324 H ALA 65 H ALA 65 74.311 28.579 -6.014 325 HA ALA 65 HA ALA 65 73.482 31.167 -4.826 326 HB1 ALA 65 HB1 ALA 65 73.155 28.303 -3.855 327 HB2 ALA 65 HB2 ALA 65 72.401 29.752 -3.156 328 HB3 ALA 65 HB3 ALA 65 71.959 29.232 -4.792 329 H GLU 66 H GLU 66 76.340 29.285 -4.787 330 HA GLU 66 HA GLU 66 77.359 30.635 -2.360 331 HB2 GLU 66 HB2 GLU 66 78.026 28.563 -1.290 332 HB3 GLU 66 HB3 GLU 66 76.282 28.608 -1.508 333 HG2 GLU 66 HG2 GLU 66 76.488 27.104 -3.487 334 HG3 GLU 66 HG3 GLU 66 78.239 27.059 -3.262 335 H GLY 67 H GLY 67 79.691 30.133 -1.947 336 HA2 GLY 67 HA2 GLY 67 81.901 29.988 -2.609 337 HA3 GLY 67 HA3 GLY 67 81.370 29.062 -4.008 338 HA PRO 68 HA PRO 68 83.111 33.149 -5.428 339 HB2 PRO 68 HB2 PRO 68 84.564 32.232 -7.569 340 HB3 PRO 68 HB3 PRO 68 85.147 32.174 -5.878 341 HG2 PRO 68 HG2 PRO 68 83.793 29.956 -7.452 342 HG3 PRO 68 HG3 PRO 68 85.319 29.872 -6.511 343 HD2 PRO 68 HD2 PRO 68 82.971 29.063 -5.448 344 HD3 PRO 68 HD3 PRO 68 84.156 29.955 -4.446 345 H LEU 69 H LEU 69 81.105 30.748 -6.957 346 HA LEU 69 HA LEU 69 80.317 32.566 -9.157 347 HB2 LEU 69 HB2 LEU 69 79.539 29.700 -8.555 348 HB3 LEU 69 HB3 LEU 69 78.971 30.626 -9.937 349 HG LEU 69 HG LEU 69 81.878 29.886 -9.441 350 HD11 LEU 69 HD11 LEU 69 79.853 28.801 -11.428 351 HD12 LEU 69 HD12 LEU 69 81.555 28.307 -11.273 352 HD13 LEU 69 HD13 LEU 69 80.413 27.962 -9.966 353 HD21 LEU 69 HD21 LEU 69 81.810 31.918 -10.761 354 HD22 LEU 69 HD22 LEU 69 82.168 30.569 -11.838 355 HD23 LEU 69 HD23 LEU 69 80.531 31.250 -11.813 356 H ALA 70 H ALA 70 79.397 32.574 -5.974 357 HA ALA 70 HA ALA 70 76.611 32.303 -6.076 358 HB1 ALA 70 HB1 ALA 70 78.270 34.211 -4.367 359 HB2 ALA 70 HB2 ALA 70 76.600 33.702 -4.037 360 HB3 ALA 70 HB3 ALA 70 77.915 32.513 -3.990 361 H GLY 71 H GLY 71 75.097 33.277 -7.120 362 HA2 GLY 71 HA2 GLY 71 73.762 34.975 -8.019 363 HA3 GLY 71 HA3 GLY 71 75.020 36.169 -7.704 364 H LEU 72 H LEU 72 76.346 33.491 -9.364 365 HA LEU 72 HA LEU 72 76.283 34.930 -11.972 366 HB2 LEU 72 HB2 LEU 72 78.298 32.911 -10.913 367 HB3 LEU 72 HB3 LEU 72 78.442 33.790 -12.380 368 HG LEU 72 HG LEU 72 78.716 34.866 -9.576 369 HD11 LEU 72 HD11 LEU 72 80.475 35.134 -12.055 370 HD12 LEU 72 HD12 LEU 72 80.884 35.593 -10.387 371 HD13 LEU 72 HD13 LEU 72 80.682 33.892 -10.814 372 HD21 LEU 72 HD21 LEU 72 77.377 36.596 -10.693 373 HD22 LEU 72 HD22 LEU 72 79.044 37.135 -10.539 374 HD23 LEU 72 HD23 LEU 72 78.448 36.552 -12.104 375 HA PRO 73 HA PRO 73 73.854 32.054 -13.994 376 HB2 PRO 73 HB2 PRO 73 74.952 31.686 -16.499 377 HB3 PRO 73 HB3 PRO 73 74.274 33.248 -15.942 378 HG2 PRO 73 HG2 PRO 73 77.157 32.311 -15.951 379 HG3 PRO 73 HG3 PRO 73 76.507 33.871 -16.540 380 HD2 PRO 73 HD2 PRO 73 77.614 33.610 -14.145 381 HD3 PRO 73 HD3 PRO 73 76.211 34.693 -14.363 382 H VAL 74 H VAL 74 73.440 29.898 -14.946 383 HA VAL 74 HA VAL 74 75.583 27.910 -14.311 384 HB VAL 74 HB VAL 74 72.621 27.357 -14.535 385 HG11 VAL 74 HG11 VAL 74 74.928 25.797 -13.302 386 HG12 VAL 74 HG12 VAL 74 73.212 25.348 -13.216 387 HG13 VAL 74 HG13 VAL 74 74.029 25.366 -14.775 388 HG21 VAL 74 HG21 VAL 74 72.915 28.915 -12.658 389 HG22 VAL 74 HG22 VAL 74 72.606 27.293 -12.050 390 HG23 VAL 74 HG23 VAL 74 74.260 27.942 -12.028 391 H THR 75 H THR 75 73.419 28.996 -16.921 392 HA THR 75 HA THR 75 74.903 27.217 -18.831 393 HB THR 75 HB THR 75 72.948 27.014 -20.158 394 HG1 THR 75 HG1 THR 75 70.970 28.030 -19.277 395 HG21 THR 75 HG21 THR 75 72.003 26.676 -17.292 396 HG22 THR 75 HG22 THR 75 71.465 25.791 -18.739 397 HG23 THR 75 HG23 THR 75 73.115 25.560 -18.119 398 H ARG 76 H ARG 76 74.737 27.972 -21.197 399 HA ARG 76 HA ARG 76 75.874 30.640 -21.478 400 HB2 ARG 76 HB2 ARG 76 74.743 28.704 -23.566 401 HB3 ARG 76 HB3 ARG 76 75.577 30.220 -23.940 402 HG2 ARG 76 HG2 ARG 76 77.590 29.403 -22.719 403 HG3 ARG 76 HG3 ARG 76 76.775 27.843 -22.465 404 HD2 ARG 76 HD2 ARG 76 76.618 27.556 -24.929 405 HD3 ARG 76 HD3 ARG 76 77.501 29.086 -25.142 406 HE ARG 76 HE ARG 76 78.985 27.340 -23.404 407 HH11 ARG 76 HH11 ARG 76 78.252 27.669 -26.810 408 HH12 ARG 76 HH12 ARG 76 79.612 26.696 -27.297 409 HH21 ARG 76 HH21 ARG 76 80.744 26.168 -24.081 410 HH22 ARG 76 HH22 ARG 76 81.002 25.887 -25.776 411 H SER 77 H SER 77 72.601 29.340 -21.953 412 HA SER 77 HA SER 77 71.336 31.755 -22.794 413 HB2 SER 77 HB2 SER 77 70.175 29.516 -21.090 414 HB3 SER 77 HB3 SER 77 69.266 30.732 -22.009 415 HG SER 77 HG SER 77 69.476 28.741 -23.169 416 H ASP 78 H ASP 78 71.861 30.432 -19.432 417 HA ASP 78 HA ASP 78 70.688 32.652 -18.072 418 HB2 ASP 78 HB2 ASP 78 73.055 30.950 -17.233 419 HB3 ASP 78 HB3 ASP 78 72.155 32.033 -16.178 420 H ALA 79 H ALA 79 74.114 32.134 -19.090 421 HA ALA 79 HA ALA 79 75.113 34.570 -18.048 422 HB1 ALA 79 HB1 ALA 79 76.094 32.827 -20.363 423 HB2 ALA 79 HB2 ALA 79 77.049 34.070 -19.547 424 HB3 ALA 79 HB3 ALA 79 76.531 32.635 -18.647 425 H ARG 80 H ARG 80 73.793 33.939 -21.332 426 HA ARG 80 HA ARG 80 74.233 36.657 -22.278 427 HB2 ARG 80 HB2 ARG 80 72.433 34.379 -23.195 428 HB3 ARG 80 HB3 ARG 80 72.484 35.947 -24.015 429 HG2 ARG 80 HG2 ARG 80 74.823 35.718 -24.554 430 HG3 ARG 80 HG3 ARG 80 74.996 34.292 -23.526 431 HD2 ARG 80 HD2 ARG 80 74.929 33.613 -25.858 432 HD3 ARG 80 HD3 ARG 80 73.534 32.993 -24.989 433 HE ARG 80 HE ARG 80 72.090 34.463 -26.134 434 HH11 ARG 80 HH11 ARG 80 75.373 35.010 -27.346 435 HH12 ARG 80 HH12 ARG 80 74.767 35.589 -28.868 436 HH21 ARG 80 HH21 ARG 80 71.448 35.360 -28.034 437 HH22 ARG 80 HH22 ARG 80 72.621 35.868 -29.208 438 H VAL 81 H VAL 81 71.413 35.138 -20.660 439 HA VAL 81 HA VAL 81 69.736 37.492 -20.761 440 HB VAL 81 HB VAL 81 69.794 35.137 -18.838 441 HG11 VAL 81 HG11 VAL 81 67.737 37.388 -19.049 442 HG12 VAL 81 HG12 VAL 81 67.464 35.848 -18.207 443 HG13 VAL 81 HG13 VAL 81 68.699 36.958 -17.616 444 HG21 VAL 81 HG21 VAL 81 69.179 34.686 -21.207 445 HG22 VAL 81 HG22 VAL 81 67.827 34.432 -20.098 446 HG23 VAL 81 HG23 VAL 81 67.906 35.903 -21.104 447 H LEU 82 H LEU 82 71.966 36.330 -18.172 448 HA LEU 82 HA LEU 82 71.682 38.608 -16.504 449 HB2 LEU 82 HB2 LEU 82 73.721 36.424 -16.843 450 HB3 LEU 82 HB3 LEU 82 74.244 37.880 -16.006 451 HG LEU 82 HG LEU 82 72.434 37.721 -14.396 452 HD11 LEU 82 HD11 LEU 82 71.682 35.089 -15.710 453 HD12 LEU 82 HD12 LEU 82 71.036 35.723 -14.185 454 HD13 LEU 82 HD13 LEU 82 70.681 36.561 -15.696 455 HD21 LEU 82 HD21 LEU 82 74.636 36.551 -14.068 456 HD22 LEU 82 HD22 LEU 82 73.299 35.799 -13.188 457 HD23 LEU 82 HD23 LEU 82 73.873 35.070 -14.704 458 H ILE 83 H ILE 83 74.082 38.150 -19.177 459 HA ILE 83 HA ILE 83 75.302 40.721 -18.982 460 HB ILE 83 HB ILE 83 74.769 38.881 -21.330 461 HG12 ILE 83 HG12 ILE 83 77.401 39.752 -20.055 462 HG13 ILE 83 HG13 ILE 83 76.477 38.380 -19.454 463 HG21 ILE 83 HG21 ILE 83 76.257 41.551 -21.431 464 HG22 ILE 83 HG22 ILE 83 76.288 40.318 -22.704 465 HG23 ILE 83 HG23 ILE 83 74.786 41.136 -22.335 466 HD11 ILE 83 HD11 ILE 83 77.702 38.617 -22.229 467 HD12 ILE 83 HD12 ILE 83 78.187 37.537 -20.914 468 HD13 ILE 83 HD13 ILE 83 76.621 37.301 -21.708 469 H PHE 84 H PHE 84 72.354 39.775 -20.850 470 HA PHE 84 HA PHE 84 71.874 42.369 -21.836 471 HB2 PHE 84 HB2 PHE 84 70.880 40.149 -22.617 472 HB3 PHE 84 HB3 PHE 84 69.755 40.261 -21.280 473 HD1 PHE 84 HD1 PHE 84 71.072 42.732 -23.847 474 HD2 PHE 84 HD2 PHE 84 67.609 40.887 -22.050 475 HE1 PHE 84 HE1 PHE 84 69.645 43.912 -25.437 476 HE2 PHE 84 HE2 PHE 84 66.149 42.170 -23.595 477 HZ PHE 84 HZ PHE 84 67.151 43.673 -25.307 478 H ASN 85 H ASN 85 70.320 40.827 -18.937 479 HA ASN 85 HA ASN 85 68.764 43.158 -18.357 480 HB2 ASN 85 HB2 ASN 85 68.158 40.924 -17.542 481 HB3 ASN 85 HB3 ASN 85 69.613 40.860 -16.535 482 HD21 ASN 85 HD22 ASN 85 69.669 42.141 -14.576 483 HD22 ASN 85 HD21 ASN 85 68.335 43.185 -14.112 484 H GLU 86 H GLU 86 71.964 42.102 -17.073 485 HA GLU 86 HA GLU 86 72.361 44.219 -15.191 486 HB2 GLU 86 HB2 GLU 86 73.783 42.181 -15.360 487 HB3 GLU 86 HB3 GLU 86 74.379 42.738 -16.933 488 HG2 GLU 86 HG2 GLU 86 75.259 44.820 -15.739 489 HG3 GLU 86 HG3 GLU 86 74.852 44.021 -14.219 490 H TRP 87 H TRP 87 73.354 43.970 -18.686 491 HA TRP 87 HA TRP 87 74.332 46.632 -18.855 492 HB2 TRP 87 HB2 TRP 87 74.896 45.037 -20.541 493 HB3 TRP 87 HB3 TRP 87 73.205 44.724 -20.902 494 HD1 TRP 87 HD1 TRP 87 75.780 47.585 -21.347 495 HE1 TRP 87 HE1 TRP 87 75.157 48.860 -23.486 496 HE3 TRP 87 HE3 TRP 87 71.393 45.201 -22.465 497 HZ2 TRP 87 HZ2 TRP 87 73.136 48.718 -25.521 498 HZ3 TRP 87 HZ3 TRP 87 70.220 45.719 -24.543 499 HH2 TRP 87 HH2 TRP 87 71.043 47.483 -26.095 500 H GLU 88 H GLU 88 70.962 45.409 -19.613 501 HA GLU 88 HA GLU 88 69.949 47.889 -20.459 502 HB2 GLU 88 HB2 GLU 88 68.657 45.495 -19.114 503 HB3 GLU 88 HB3 GLU 88 67.742 46.948 -19.480 504 HG2 GLU 88 HG2 GLU 88 68.439 46.783 -21.872 505 HG3 GLU 88 HG3 GLU 88 69.136 45.202 -21.533 506 H GLU 89 H GLU 89 69.969 46.663 -17.026 507 HA GLU 89 HA GLU 89 68.671 49.063 -16.026 508 HB2 GLU 89 HB2 GLU 89 70.353 46.945 -14.615 509 HB3 GLU 89 HB3 GLU 89 69.508 48.270 -13.800 510 HG2 GLU 89 HG2 GLU 89 67.351 47.460 -14.799 511 HG3 GLU 89 HG3 GLU 89 68.214 46.076 -15.469 512 H ARG 90 H ARG 90 72.110 48.061 -16.130 513 HA ARG 90 HA ARG 90 73.149 50.465 -14.891 514 HB2 ARG 90 HB2 ARG 90 74.437 48.539 -16.859 515 HB3 ARG 90 HB3 ARG 90 75.320 49.763 -15.935 516 HG2 ARG 90 HG2 ARG 90 73.690 47.565 -14.644 517 HG3 ARG 90 HG3 ARG 90 75.364 47.355 -15.135 518 HD2 ARG 90 HD2 ARG 90 75.441 47.830 -12.807 519 HD3 ARG 90 HD3 ARG 90 75.994 49.278 -13.627 520 HE ARG 90 HE ARG 90 74.248 50.446 -12.707 521 HH11 ARG 90 HH11 ARG 90 73.384 47.058 -12.349 522 HH12 ARG 90 HH12 ARG 90 71.968 47.432 -11.408 523 HH21 ARG 90 HH21 ARG 90 72.414 50.837 -11.520 524 HH22 ARG 90 HH22 ARG 90 71.440 49.516 -10.956 525 H LYS 91 H LYS 91 72.709 49.608 -18.274 526 HA LYS 91 HA LYS 91 73.515 52.110 -19.413 527 HB2 LYS 91 HB2 LYS 91 73.197 50.018 -20.769 528 HB3 LYS 91 HB3 LYS 91 71.480 50.031 -20.381 529 HG2 LYS 91 HG2 LYS 91 71.652 50.626 -22.609 530 HG3 LYS 91 HG3 LYS 91 71.166 52.077 -21.746 531 HD2 LYS 91 HD2 LYS 91 73.549 52.856 -21.823 532 HD3 LYS 91 HD3 LYS 91 73.975 51.433 -22.773 533 HE2 LYS 91 HE2 LYS 91 71.912 53.540 -23.595 534 HE3 LYS 91 HE3 LYS 91 73.604 53.560 -24.096 535 HZ1 LYS 91 HZ1 LYS 91 71.674 51.395 -24.788 536 HZ2 LYS 91 HZ2 LYS 91 72.223 52.548 -25.797 537 HZ3 LYS 91 HZ3 LYS 91 73.263 51.431 -25.227 538 H LYS 92 H LYS 92 70.259 51.146 -18.198 539 HA LYS 92 HA LYS 92 68.962 53.598 -18.910 540 HB2 LYS 92 HB2 LYS 92 67.868 51.466 -18.137 541 HB3 LYS 92 HB3 LYS 92 68.376 51.848 -16.482 542 HG2 LYS 92 HG2 LYS 92 67.069 53.941 -16.564 543 HG3 LYS 92 HG3 LYS 92 66.625 53.604 -18.253 544 HD2 LYS 92 HD2 LYS 92 65.523 51.485 -17.504 545 HD3 LYS 92 HD3 LYS 92 65.870 51.902 -15.825 546 HE2 LYS 92 HE2 LYS 92 64.192 53.584 -17.755 547 HE3 LYS 92 HE3 LYS 92 63.527 52.416 -16.614 548 HZ1 LYS 92 HZ1 LYS 92 65.043 54.864 -15.844 549 HZ2 LYS 92 HZ2 LYS 92 63.439 54.635 -15.680 550 HZ3 LYS 92 HZ3 LYS 92 64.473 53.748 -14.787 551 H SER 93 H SER 93 70.998 52.766 -16.086 552 HA SER 93 HA SER 93 70.915 55.522 -15.061 553 HB2 SER 93 HB2 SER 93 71.367 53.457 -13.699 554 HB3 SER 93 HB3 SER 93 72.977 53.393 -14.440 555 HG SER 93 HG SER 93 72.923 54.551 -12.412 556 H GLU 94 H GLU 94 72.996 53.829 -17.333 557 HA GLU 94 HA GLU 94 74.871 56.132 -17.647 558 HB2 GLU 94 HB2 GLU 94 75.470 53.148 -17.803 559 HB3 GLU 94 HB3 GLU 94 76.612 54.475 -17.948 560 HG2 GLU 94 HG2 GLU 94 75.950 55.136 -15.573 561 HG3 GLU 94 HG3 GLU 94 75.047 53.612 -15.520 562 HA PRO 95 HA PRO 95 72.795 55.172 -21.674 563 HB2 PRO 95 HB2 PRO 95 72.838 57.726 -22.795 564 HB3 PRO 95 HB3 PRO 95 71.604 57.087 -21.674 565 HG2 PRO 95 HG2 PRO 95 74.065 58.729 -21.000 566 HG3 PRO 95 HG3 PRO 95 72.371 58.999 -20.470 567 HD2 PRO 95 HD2 PRO 95 74.097 57.742 -18.849 568 HD3 PRO 95 HD3 PRO 95 72.435 57.110 -19.018 569 H TRP 96 H TRP 96 75.958 55.496 -21.134 570 HA TRP 96 HA TRP 96 76.851 55.496 -23.985 571 HB2 TRP 96 HB2 TRP 96 79.098 55.886 -22.959 572 HB3 TRP 96 HB3 TRP 96 77.930 57.164 -22.676 573 HD1 TRP 96 HD1 TRP 96 79.775 54.363 -20.819 574 HE1 TRP 96 HE1 TRP 96 79.691 54.805 -18.288 575 HE3 TRP 96 HE3 TRP 96 76.607 58.391 -20.800 576 HZ2 TRP 96 HZ2 TRP 96 78.383 56.640 -16.486 577 HZ3 TRP 96 HZ3 TRP 96 75.958 59.467 -18.655 578 HH2 TRP 96 HH2 TRP 96 76.828 58.596 -16.498 579 H LEU 97 H LEU 97 76.071 53.211 -21.546 580 HA LEU 97 HA LEU 97 78.312 51.592 -21.541 581 HB2 LEU 97 HB2 LEU 97 76.190 51.719 -20.003 582 HB3 LEU 97 HB3 LEU 97 75.476 50.594 -21.127 583 HG LEU 97 HG LEU 97 77.351 49.026 -20.673 584 HD11 LEU 97 HD11 LEU 97 78.094 51.027 -18.498 585 HD12 LEU 97 HD12 LEU 97 78.699 49.361 -18.594 586 HD13 LEU 97 HD13 LEU 97 79.126 50.516 -19.852 587 HD21 LEU 97 HD21 LEU 97 75.166 48.919 -19.463 588 HD22 LEU 97 HD22 LEU 97 76.508 48.359 -18.446 589 HD23 LEU 97 HD23 LEU 97 75.838 49.994 -18.223 590 H ARG 98 H ARG 98 79.008 49.748 -22.540 591 HA ARG 98 HA ARG 98 77.811 49.082 -25.185 592 HB2 ARG 98 HB2 ARG 98 80.534 48.264 -24.126 593 HB3 ARG 98 HB3 ARG 98 79.975 48.257 -25.797 594 HG2 ARG 98 HG2 ARG 98 80.589 50.690 -24.069 595 HG3 ARG 98 HG3 ARG 98 81.528 50.102 -25.430 596 HD2 ARG 98 HD2 ARG 98 79.816 50.756 -27.016 597 HD3 ARG 98 HD3 ARG 98 78.650 51.057 -25.729 598 HE ARG 98 HE ARG 98 79.622 53.042 -25.138 599 HH11 ARG 98 HH11 ARG 98 81.633 51.616 -27.647 600 HH12 ARG 98 HH12 ARG 98 82.511 53.097 -27.910 601 HH21 ARG 98 HH21 ARG 98 80.774 54.885 -25.533 602 HH22 ARG 98 HH22 ARG 98 82.031 54.905 -26.737 603 H LEU 99 H LEU 99 77.858 46.909 -25.960 604 HA LEU 99 HA LEU 99 77.069 44.861 -23.937 605 HB2 LEU 99 HB2 LEU 99 75.220 46.298 -24.614 606 HB3 LEU 99 HB3 LEU 99 75.483 45.978 -26.296 607 HG LEU 99 HG LEU 99 73.493 44.893 -25.242 608 HD11 LEU 99 HD11 LEU 99 75.346 42.741 -26.284 609 HD12 LEU 99 HD12 LEU 99 73.605 42.975 -26.569 610 HD13 LEU 99 HD13 LEU 99 74.757 44.050 -27.325 611 HD21 LEU 99 HD21 LEU 99 74.766 44.355 -23.084 612 HD22 LEU 99 HD22 LEU 99 73.470 43.332 -23.667 613 HD23 LEU 99 HD23 LEU 99 75.187 42.841 -23.912 614 H ASP 100 H ASP 100 77.856 42.848 -24.466 615 HA ASP 100 HA ASP 100 78.238 42.061 -27.286 616 HB2 ASP 100 HB2 ASP 100 80.389 43.095 -26.563 617 HB3 ASP 100 HB3 ASP 100 80.481 41.938 -25.233 618 H MET 101 H MET 101 77.784 39.945 -27.625 619 HA MET 101 HA MET 101 77.265 38.161 -25.269 620 HB2 MET 101 HB2 MET 101 75.429 38.683 -27.639 621 HB3 MET 101 HB3 MET 101 75.158 37.473 -26.380 622 HG2 MET 101 HG2 MET 101 75.042 39.217 -24.665 623 HG3 MET 101 HG3 MET 101 75.289 40.462 -25.903 624 HE1 MET 101 HE1 MET 101 72.961 41.718 -25.072 625 HE2 MET 101 HE2 MET 101 71.490 40.751 -24.847 626 HE3 MET 101 HE3 MET 101 72.919 40.429 -23.839 627 H SER 102 H SER 102 79.145 38.329 -27.969 628 HA SER 102 HA SER 102 78.880 35.671 -29.078 629 HB2 SER 102 HB2 SER 102 81.250 37.579 -28.948 630 HB3 SER 102 HB3 SER 102 81.208 36.070 -29.884 631 HG SER 102 HG SER 102 80.627 37.938 -31.146 632 H ASP 103 H ASP 103 80.265 33.828 -28.680 633 HA ASP 103 HA ASP 103 80.078 33.017 -26.065 634 HB2 ASP 103 HB2 ASP 103 81.954 31.921 -28.193 635 HB3 ASP 103 HB3 ASP 103 81.485 31.083 -26.716 636 H LYS 104 H LYS 104 83.008 34.481 -27.477 637 HA LYS 104 HA LYS 104 84.801 33.976 -25.313 638 HB2 LYS 104 HB2 LYS 104 84.686 36.292 -27.292 639 HB3 LYS 104 HB3 LYS 104 86.024 35.982 -26.177 640 HG2 LYS 104 HG2 LYS 104 86.282 33.686 -27.175 641 HG3 LYS 104 HG3 LYS 104 85.091 34.120 -28.405 642 HD2 LYS 104 HD2 LYS 104 87.755 35.529 -27.919 643 HD3 LYS 104 HD3 LYS 104 87.429 34.343 -29.189 644 HE2 LYS 104 HE2 LYS 104 85.687 35.852 -30.149 645 HE3 LYS 104 HE3 LYS 104 86.058 37.060 -28.910 646 HZ1 LYS 104 HZ1 LYS 104 87.987 36.072 -30.955 647 HZ2 LYS 104 HZ2 LYS 104 87.251 37.527 -30.978 648 HZ3 LYS 104 HZ3 LYS 104 88.333 37.184 -29.806 649 H ALA 105 H ALA 105 82.294 36.498 -25.585 650 HA ALA 105 HA ALA 105 83.105 37.999 -23.249 651 HB1 ALA 105 HB1 ALA 105 80.354 37.703 -24.516 652 HB2 ALA 105 HB2 ALA 105 80.865 38.954 -23.371 653 HB3 ALA 105 HB3 ALA 105 81.590 38.888 -24.986 654 H ILE 106 H ILE 106 81.054 35.163 -23.737 655 HA ILE 106 HA ILE 106 80.147 35.016 -20.980 656 HB ILE 106 HB ILE 106 79.969 33.150 -23.370 657 HG12 ILE 106 HG12 ILE 106 77.552 33.538 -23.107 658 HG13 ILE 106 HG13 ILE 106 77.849 34.602 -21.733 659 HG21 ILE 106 HG21 ILE 106 78.961 32.592 -20.545 660 HG22 ILE 106 HG22 ILE 106 78.473 31.699 -22.002 661 HG23 ILE 106 HG23 ILE 106 80.148 31.642 -21.467 662 HD11 ILE 106 HD11 ILE 106 78.800 35.158 -24.571 663 HD12 ILE 106 HD12 ILE 106 77.302 35.791 -23.860 664 HD13 ILE 106 HD13 ILE 106 78.862 36.286 -23.195 665 H PHE 107 H PHE 107 82.638 33.219 -22.869 666 HA PHE 107 HA PHE 107 83.699 31.668 -20.750 667 HB2 PHE 107 HB2 PHE 107 85.313 33.075 -22.912 668 HB3 PHE 107 HB3 PHE 107 85.794 31.655 -22.007 669 HD1 PHE 107 HD1 PHE 107 82.774 30.390 -22.475 670 HD2 PHE 107 HD2 PHE 107 85.960 31.964 -24.912 671 HE1 PHE 107 HE1 PHE 107 82.063 28.924 -24.344 672 HE2 PHE 107 HE2 PHE 107 85.245 30.485 -26.793 673 HZ PHE 107 HZ PHE 107 83.303 28.959 -26.500 674 H ARG 108 H ARG 108 84.643 35.008 -21.710 675 HA ARG 108 HA ARG 108 86.705 35.209 -19.748 676 HB2 ARG 108 HB2 ARG 108 86.488 36.221 -22.037 677 HB3 ARG 108 HB3 ARG 108 85.368 37.417 -21.381 678 HG2 ARG 108 HG2 ARG 108 88.193 36.966 -20.328 679 HG3 ARG 108 HG3 ARG 108 87.843 38.007 -21.709 680 HD2 ARG 108 HD2 ARG 108 86.400 39.441 -20.300 681 HD3 ARG 108 HD3 ARG 108 86.805 38.446 -18.885 682 HE ARG 108 HE ARG 108 89.221 39.309 -20.129 683 HH11 ARG 108 HH11 ARG 108 86.639 40.705 -18.207 684 HH12 ARG 108 HH12 ARG 108 87.676 41.942 -17.553 685 HH21 ARG 108 HH21 ARG 108 90.483 40.909 -19.258 686 HH22 ARG 108 HH22 ARG 108 89.799 42.052 -18.140 687 H ARG 109 H ARG 109 83.314 36.403 -19.718 688 HA ARG 109 HA ARG 109 83.548 37.574 -17.031 689 HB2 ARG 109 HB2 ARG 109 81.170 36.695 -18.725 690 HB3 ARG 109 HB3 ARG 109 81.016 37.320 -17.081 691 HG2 ARG 109 HG2 ARG 109 82.102 39.439 -17.731 692 HG3 ARG 109 HG3 ARG 109 82.308 38.845 -19.383 693 HD2 ARG 109 HD2 ARG 109 80.390 40.330 -19.283 694 HD3 ARG 109 HD3 ARG 109 79.859 38.694 -19.651 695 HE ARG 109 HE ARG 109 79.173 38.440 -17.279 696 HH11 ARG 109 HH11 ARG 109 79.547 41.819 -18.263 697 HH12 ARG 109 HH12 ARG 109 78.414 42.330 -17.014 698 HH21 ARG 109 HH21 ARG 109 77.795 39.255 -15.756 699 HH22 ARG 109 HH22 ARG 109 77.595 40.989 -15.608 700 H TYR 110 H TYR 110 82.629 34.378 -18.262 701 HA TYR 110 HA TYR 110 82.342 33.345 -15.474 702 HB2 TYR 110 HB2 TYR 110 80.684 32.562 -17.879 703 HB3 TYR 110 HB3 TYR 110 80.442 32.144 -16.202 704 HD1 TYR 110 HD2 TYR 110 80.182 34.288 -14.552 705 HD2 TYR 110 HD1 TYR 110 79.380 34.220 -18.789 706 HE1 TYR 110 HE2 TYR 110 78.663 36.269 -14.319 707 HE2 TYR 110 HE1 TYR 110 77.804 36.139 -18.532 708 HH TYR 110 HH TYR 110 76.706 37.509 -17.047 709 HA PRO 111 HA PRO 111 85.566 30.932 -17.732 710 HB2 PRO 111 HB2 PRO 111 87.169 30.266 -15.596 711 HB3 PRO 111 HB3 PRO 111 87.218 31.844 -16.436 712 HG2 PRO 111 HG2 PRO 111 85.710 31.136 -13.898 713 HG3 PRO 111 HG3 PRO 111 86.795 32.537 -14.186 714 HD2 PRO 111 HD2 PRO 111 84.116 32.784 -14.400 715 HD3 PRO 111 HD3 PRO 111 85.191 33.606 -15.574 716 H HIS 112 H HIS 112 83.430 29.929 -15.139 717 HA HIS 112 HA HIS 112 84.000 27.080 -15.296 718 HB2 HIS 112 HB2 HIS 112 82.164 26.837 -13.852 719 HB3 HIS 112 HB3 HIS 112 82.936 28.334 -13.349 720 HD2 HIS 112 HD2 HIS 112 79.641 26.992 -13.784 721 HE1 HIS 112 HE1 HIS 112 79.003 30.963 -15.145 722 HE2 HIS 112 HE2 HIS 112 77.881 28.936 -14.280 723 H LEU 113 H LEU 113 82.028 29.312 -17.168 724 HA LEU 113 HA LEU 113 80.324 27.301 -18.324 725 HB2 LEU 113 HB2 LEU 113 80.256 30.058 -17.796 726 HB3 LEU 113 HB3 LEU 113 80.482 30.015 -19.526 727 HG LEU 113 HG LEU 113 78.188 30.221 -19.049 728 HD11 LEU 113 HD11 LEU 113 78.588 27.279 -19.747 729 HD12 LEU 113 HD12 LEU 113 77.198 28.287 -20.150 730 HD13 LEU 113 HD13 LEU 113 78.774 28.636 -20.885 731 HD21 LEU 113 HD21 LEU 113 77.942 29.521 -16.827 732 HD22 LEU 113 HD22 LEU 113 76.879 28.519 -17.793 733 HD23 LEU 113 HD23 LEU 113 78.408 27.838 -17.196 734 H ARG 114 H ARG 114 83.483 28.333 -19.081 735 HA ARG 114 HA ARG 114 83.396 28.092 -21.971 736 HB2 ARG 114 HB2 ARG 114 85.027 29.492 -20.731 737 HB3 ARG 114 HB3 ARG 114 85.803 28.039 -20.099 738 HG2 ARG 114 HG2 ARG 114 85.453 28.415 -23.093 739 HG3 ARG 114 HG3 ARG 114 86.731 29.284 -22.250 740 HD2 ARG 114 HD2 ARG 114 87.838 27.301 -21.572 741 HD3 ARG 114 HD3 ARG 114 86.495 26.263 -22.013 742 HE ARG 114 HE ARG 114 88.524 27.366 -23.788 743 HH11 ARG 114 HH11 ARG 114 85.286 25.944 -23.741 744 HH12 ARG 114 HH12 ARG 114 85.426 25.430 -25.406 745 HH21 ARG 114 HH21 ARG 114 88.584 26.688 -25.894 746 HH22 ARG 114 HH22 ARG 114 87.230 25.849 -26.588 Start of MODEL 14 1 H1 MET 1 H1 MET 1 -8.991 26.502 -43.588 2 H2 MET 1 H2 MET 1 -9.548 25.651 -44.867 3 H3 MET 1 H3 MET 1 -9.741 25.069 -43.349 4 HA MET 1 HA MET 1 -11.002 27.517 -44.420 5 HB2 MET 1 HB2 MET 1 -11.950 25.408 -45.369 6 HB3 MET 1 HB3 MET 1 -12.326 24.848 -43.738 7 HG2 MET 1 HG2 MET 1 -13.889 26.752 -43.444 8 HG3 MET 1 HG3 MET 1 -13.425 27.380 -45.028 9 HE1 MET 1 HE1 MET 1 -15.474 24.751 -43.006 10 HE2 MET 1 HE2 MET 1 -16.076 23.649 -44.262 11 HE3 MET 1 HE3 MET 1 -14.357 23.631 -43.824 12 H ARG 2 H ARG 2 -12.140 28.787 -43.001 13 HA ARG 2 HA ARG 2 -12.734 29.846 -41.124 14 HB2 ARG 2 HB2 ARG 2 -13.905 27.484 -40.818 15 HB3 ARG 2 HB3 ARG 2 -12.741 27.292 -39.524 16 HG2 ARG 2 HG2 ARG 2 -14.572 28.057 -38.395 17 HG3 ARG 2 HG3 ARG 2 -13.716 29.571 -38.615 18 HD2 ARG 2 HD2 ARG 2 -16.034 28.535 -40.311 19 HD3 ARG 2 HD3 ARG 2 -16.164 29.712 -39.018 20 HE ARG 2 HE ARG 2 -14.917 31.329 -40.301 21 HH11 ARG 2 HH11 ARG 2 -16.150 28.662 -42.223 22 HH12 ARG 2 HH12 ARG 2 -16.086 29.585 -43.698 23 HH21 ARG 2 HH21 ARG 2 -14.832 32.426 -42.218 24 HH22 ARG 2 HH22 ARG 2 -15.352 31.660 -43.688 25 H GLY 3 H GLY 3 -12.111 30.655 -39.042 26 HA2 GLY 3 HA2 GLY 3 -10.629 31.225 -37.358 27 HA3 GLY 3 HA3 GLY 3 -9.516 29.964 -37.864 28 H SER 4 H SER 4 -8.933 32.683 -37.077 29 HA SER 4 HA SER 4 -7.094 33.433 -39.215 30 HB2 SER 4 HB2 SER 4 -9.226 34.605 -39.860 31 HB3 SER 4 HB3 SER 4 -9.186 35.455 -38.304 32 HG SER 4 HG SER 4 -8.218 36.660 -40.049 33 H HIS 5 H HIS 5 -5.441 34.850 -38.479 34 HA HIS 5 HA HIS 5 -5.473 35.951 -35.781 35 HB2 HIS 5 HB2 HIS 5 -3.540 34.818 -34.924 36 HB3 HIS 5 HB3 HIS 5 -4.730 33.605 -35.362 37 HD2 HIS 5 HD2 HIS 5 -4.189 32.092 -37.599 38 HE1 HIS 5 HE1 HIS 5 -0.047 33.094 -37.817 39 HE2 HIS 5 HE2 HIS 5 -1.850 31.513 -38.673 40 H HIS 6 H HIS 6 -3.730 37.400 -35.352 41 HA HIS 6 HA HIS 6 -1.714 37.995 -37.362 42 HB2 HIS 6 HB2 HIS 6 -2.344 40.289 -37.783 43 HB3 HIS 6 HB3 HIS 6 -3.674 39.249 -38.263 44 HD2 HIS 6 HD2 HIS 6 -5.931 39.317 -36.719 45 HE1 HIS 6 HE1 HIS 6 -4.917 42.853 -34.555 46 HE2 HIS 6 HE2 HIS 6 -6.791 41.217 -35.102 47 H HIS 7 H HIS 7 -0.156 39.604 -36.611 48 HA HIS 7 HA HIS 7 -0.371 40.684 -33.919 49 HB2 HIS 7 HB2 HIS 7 1.609 39.680 -32.984 50 HB3 HIS 7 HB3 HIS 7 0.500 38.400 -33.444 51 HD2 HIS 7 HD2 HIS 7 1.194 36.882 -35.626 52 HE1 HIS 7 HE1 HIS 7 5.277 38.117 -35.750 53 HE2 HIS 7 HE2 HIS 7 3.593 36.418 -36.623 54 H HIS 8 H HIS 8 1.222 42.261 -33.428 55 HA HIS 8 HA HIS 8 3.365 42.908 -35.293 56 HB2 HIS 8 HB2 HIS 8 1.493 44.086 -36.389 57 HB3 HIS 8 HB3 HIS 8 1.081 44.884 -34.871 58 HD2 HIS 8 HD2 HIS 8 1.995 47.291 -34.725 59 HE1 HIS 8 HE1 HIS 8 5.555 46.908 -37.048 60 HE2 HIS 8 HE2 HIS 8 4.119 48.519 -35.693 61 H HIS 9 H HIS 9 4.976 44.149 -34.329 62 HA HIS 9 HA HIS 9 4.545 45.606 -31.862 63 HB2 HIS 9 HB2 HIS 9 6.124 44.428 -30.465 64 HB3 HIS 9 HB3 HIS 9 4.853 43.320 -30.948 65 HD2 HIS 9 HD2 HIS 9 5.529 41.397 -32.815 66 HE1 HIS 9 HE1 HIS 9 9.746 41.748 -32.259 67 HE2 HIS 9 HE2 HIS 9 7.894 40.318 -33.266 68 H HIS 10 H HIS 10 6.250 46.989 -31.304 69 HA HIS 10 HA HIS 10 8.807 46.938 -32.679 70 HB2 HIS 10 HB2 HIS 10 7.344 48.190 -34.310 71 HB3 HIS 10 HB3 HIS 10 7.031 49.391 -33.054 72 HD2 HIS 10 HD2 HIS 10 8.736 51.367 -32.960 73 HE1 HIS 10 HE1 HIS 10 12.074 49.562 -34.910 74 HE2 HIS 10 HE2 HIS 10 11.227 51.676 -33.793 75 H GLY 11 H GLY 11 10.378 48.379 -31.648 76 HA2 GLY 11 HA2 GLY 11 9.672 50.006 -29.354 77 HA3 GLY 11 HA3 GLY 11 10.226 48.409 -28.854 78 H SER 28 H SER 28 11.569 50.263 -31.633 79 HA SER 28 HA SER 28 14.000 50.926 -30.065 80 HB2 SER 28 HB2 SER 28 15.484 49.914 -31.728 81 HB3 SER 28 HB3 SER 28 14.455 48.708 -30.942 82 HG SER 28 HG SER 28 14.549 48.402 -33.222 83 H VAL 29 H VAL 29 15.429 52.411 -31.007 84 HA VAL 29 HA VAL 29 14.921 53.625 -33.573 85 HB VAL 29 HB VAL 29 13.200 54.826 -32.332 86 HG11 VAL 29 HG11 VAL 29 15.364 56.083 -30.605 87 HG12 VAL 29 HG12 VAL 29 13.628 56.421 -30.594 88 HG13 VAL 29 HG13 VAL 29 14.206 54.843 -30.052 89 HG21 VAL 29 HG21 VAL 29 14.372 55.932 -34.202 90 HG22 VAL 29 HG22 VAL 29 13.763 57.074 -32.992 91 HG23 VAL 29 HG23 VAL 29 15.493 56.685 -33.043 92 H SER 30 H SER 30 16.601 53.969 -30.457 93 HA SER 30 HA SER 30 18.671 54.441 -29.810 94 HB2 SER 30 HB2 SER 30 19.581 53.693 -32.599 95 HB3 SER 30 HB3 SER 30 20.618 53.912 -31.182 96 HG SER 30 HG SER 30 20.039 51.698 -31.508 97 H PHE 31 H PHE 31 20.205 56.040 -29.569 98 HA PHE 31 HA PHE 31 20.032 58.425 -31.369 99 HB2 PHE 31 HB2 PHE 31 18.342 58.466 -29.481 100 HB3 PHE 31 HB3 PHE 31 19.684 58.502 -28.349 101 HD1 PHE 31 HD2 PHE 31 18.233 60.311 -31.312 102 HD2 PHE 31 HD1 PHE 31 20.575 60.626 -27.703 103 HE1 PHE 31 HE2 PHE 31 18.267 62.786 -31.547 104 HE2 PHE 31 HE1 PHE 31 20.603 63.099 -27.939 105 HZ PHE 31 HZ PHE 31 19.452 64.181 -29.861 106 H GLY 32 H GLY 32 22.092 56.436 -29.402 107 HA2 GLY 32 HA2 GLY 32 24.058 58.351 -28.620 108 HA3 GLY 32 HA3 GLY 32 24.294 56.613 -28.735 109 H ALA 33 H ALA 33 25.734 59.255 -29.641 110 HA ALA 33 HA ALA 33 26.901 58.130 -32.118 111 HB1 ALA 33 HB1 ALA 33 25.640 60.902 -31.963 112 HB2 ALA 33 HB2 ALA 33 26.594 60.265 -33.323 113 HB3 ALA 33 HB3 ALA 33 25.041 59.522 -32.907 114 HA PRO 34 HA PRO 34 29.930 60.075 -29.113 115 HB2 PRO 34 HB2 PRO 34 31.618 57.961 -28.748 116 HB3 PRO 34 HB3 PRO 34 30.080 58.143 -27.850 117 HG2 PRO 34 HG2 PRO 34 30.580 56.506 -30.361 118 HG3 PRO 34 HG3 PRO 34 29.788 55.981 -28.841 119 HD2 PRO 34 HD2 PRO 34 28.344 56.811 -30.991 120 HD3 PRO 34 HD3 PRO 34 27.831 57.208 -29.324 121 H SER 35 H SER 35 32.023 60.820 -29.519 122 HA SER 35 HA SER 35 33.261 60.264 -32.190 123 HB2 SER 35 HB2 SER 35 32.630 63.001 -31.036 124 HB3 SER 35 HB3 SER 35 33.604 62.689 -32.487 125 HG SER 35 HG SER 35 31.399 63.167 -32.984 126 HA PRO 36 HA PRO 36 36.439 60.291 -28.738 127 HB2 PRO 36 HB2 PRO 36 37.653 57.901 -29.300 128 HB3 PRO 36 HB3 PRO 36 36.192 58.046 -28.276 129 HG2 PRO 36 HG2 PRO 36 36.328 57.366 -31.233 130 HG3 PRO 36 HG3 PRO 36 35.424 56.510 -29.942 131 HD2 PRO 36 HD2 PRO 36 34.221 58.334 -31.556 132 HD3 PRO 36 HD3 PRO 36 33.799 58.218 -29.822 133 H LEU 37 H LEU 37 38.468 61.076 -29.022 134 HA LEU 37 HA LEU 37 39.624 61.196 -31.780 135 HB2 LEU 37 HB2 LEU 37 38.153 63.129 -31.147 136 HB3 LEU 37 HB3 LEU 37 39.246 63.490 -29.816 137 HG LEU 37 HG LEU 37 41.045 64.050 -31.415 138 HD11 LEU 37 HD11 LEU 37 38.979 63.394 -33.568 139 HD12 LEU 37 HD12 LEU 37 40.521 64.233 -33.848 140 HD13 LEU 37 HD13 LEU 37 40.526 62.556 -33.299 141 HD21 LEU 37 HD21 LEU 37 39.445 65.784 -30.711 142 HD22 LEU 37 HD22 LEU 37 40.031 66.065 -32.357 143 HD23 LEU 37 HD23 LEU 37 38.404 65.396 -32.099 144 H SER 38 H SER 38 40.350 60.461 -28.524 145 HA SER 38 HA SER 38 43.093 61.445 -28.517 146 HB2 SER 38 HB2 SER 38 43.227 60.209 -26.348 147 HB3 SER 38 HB3 SER 38 41.980 61.461 -26.438 148 HG SER 38 HG SER 38 41.196 59.502 -25.488 149 H SER 39 H SER 39 44.951 60.368 -28.783 150 HA SER 39 HA SER 39 44.938 57.490 -29.602 151 HB2 SER 39 HB2 SER 39 46.253 59.777 -31.117 152 HB3 SER 39 HB3 SER 39 46.353 58.056 -31.531 153 HG SER 39 HG SER 39 44.752 59.153 -32.766 154 H GLU 40 H GLU 40 45.970 58.983 -27.138 155 HA GLU 40 HA GLU 40 47.807 59.235 -25.827 156 HB2 GLU 40 HB2 GLU 40 48.733 56.663 -27.143 157 HB3 GLU 40 HB3 GLU 40 49.307 57.334 -25.614 158 HG2 GLU 40 HG2 GLU 40 47.003 57.165 -24.680 159 HG3 GLU 40 HG3 GLU 40 46.463 56.402 -26.177 160 H SER 41 H SER 41 47.901 60.726 -28.250 161 HA SER 41 HA SER 41 50.701 60.828 -29.120 162 HB2 SER 41 HB2 SER 41 49.827 62.612 -30.650 163 HB3 SER 41 HB3 SER 41 49.097 61.012 -30.852 164 HG SER 41 HG SER 41 47.539 62.753 -30.825 165 H GLU 42 H GLU 42 51.947 62.740 -29.118 166 HA GLU 42 HA GLU 42 53.082 64.394 -28.080 167 HB2 GLU 42 HB2 GLU 42 50.352 65.596 -27.542 168 HB3 GLU 42 HB3 GLU 42 51.900 66.442 -27.544 169 HG2 GLU 42 HG2 GLU 42 52.217 65.837 -29.943 170 HG3 GLU 42 HG3 GLU 42 50.613 65.103 -29.955 171 H ASP 43 H ASP 43 52.034 62.127 -26.239 172 HA ASP 43 HA ASP 43 52.502 63.316 -23.593 173 HB2 ASP 43 HB2 ASP 43 52.268 60.456 -24.584 174 HB3 ASP 43 HB3 ASP 43 52.681 60.879 -22.923 175 H GLU 44 H GLU 44 54.404 64.354 -23.596 176 HA GLU 44 HA GLU 44 56.605 64.780 -23.466 177 HB2 GLU 44 HB2 GLU 44 56.861 61.869 -22.663 178 HB3 GLU 44 HB3 GLU 44 58.006 63.157 -22.310 179 HG2 GLU 44 HG2 GLU 44 55.161 62.955 -21.239 180 HG3 GLU 44 HG3 GLU 44 56.640 62.608 -20.362 181 H ILE 45 H ILE 45 55.716 63.701 -26.218 182 HA ILE 45 HA ILE 45 57.719 62.086 -27.265 183 HB ILE 45 HB ILE 45 56.937 62.734 -29.458 184 HG12 ILE 45 HG12 ILE 45 55.275 64.911 -28.122 185 HG13 ILE 45 HG13 ILE 45 56.723 65.191 -29.081 186 HG21 ILE 45 HG21 ILE 45 54.596 62.468 -27.530 187 HG22 ILE 45 HG22 ILE 45 54.664 61.951 -29.231 188 HG23 ILE 45 HG23 ILE 45 55.666 61.146 -28.024 189 HD11 ILE 45 HD11 ILE 45 54.135 63.996 -30.143 190 HD12 ILE 45 HD12 ILE 45 54.786 65.614 -30.452 191 HD13 ILE 45 HD13 ILE 45 55.641 64.187 -31.070 192 H ASN 46 H ASN 46 58.122 65.438 -26.555 193 HA ASN 46 HA ASN 46 60.311 65.944 -28.410 194 HB2 ASN 46 HB2 ASN 46 59.349 67.360 -25.884 195 HB3 ASN 46 HB3 ASN 46 60.651 67.951 -26.906 196 HD21 ASN 46 HD22 ASN 46 58.553 69.613 -26.466 197 HD22 ASN 46 HD21 ASN 46 57.613 69.758 -27.944 198 H TYR 47 H TYR 47 60.152 64.185 -25.423 199 HA TYR 47 HA TYR 47 63.140 64.069 -25.318 200 HB2 TYR 47 HB2 TYR 47 62.131 65.713 -23.668 201 HB3 TYR 47 HB3 TYR 47 61.357 64.346 -22.879 202 HD1 TYR 47 HD1 TYR 47 64.688 65.691 -23.967 203 HD2 TYR 47 HD2 TYR 47 62.582 63.113 -21.219 204 HE1 TYR 47 HE1 TYR 47 66.796 65.333 -22.692 205 HE2 TYR 47 HE2 TYR 47 64.696 62.756 -19.943 206 HH TYR 47 HH TYR 47 67.799 64.281 -20.900 207 H MET 48 H MET 48 60.111 62.337 -24.979 208 HA MET 48 HA MET 48 61.258 59.952 -23.806 209 HB2 MET 48 HB2 MET 48 58.913 60.785 -23.513 210 HB3 MET 48 HB3 MET 48 58.564 60.294 -25.172 211 HG2 MET 48 HG2 MET 48 59.123 57.947 -24.565 212 HG3 MET 48 HG3 MET 48 59.551 58.470 -22.934 213 HE1 MET 48 HE1 MET 48 57.983 56.528 -22.005 214 HE2 MET 48 HE2 MET 48 56.274 56.346 -22.452 215 HE3 MET 48 HE3 MET 48 57.539 56.078 -23.670 216 H THR 49 H THR 49 62.979 60.346 -25.652 217 HA THR 49 HA THR 49 62.557 58.349 -27.839 218 HB THR 49 HB THR 49 63.929 59.911 -29.294 219 HG1 THR 49 HG1 THR 49 63.944 62.079 -28.713 220 HG21 THR 49 HG21 THR 49 61.213 60.984 -28.424 221 HG22 THR 49 HG22 THR 49 62.027 61.259 -29.976 222 HG23 THR 49 HG23 THR 49 61.469 59.634 -29.550 223 HA PRO 50 HA PRO 50 66.426 57.730 -25.252 224 HB2 PRO 50 HB2 PRO 50 66.051 55.144 -24.423 225 HB3 PRO 50 HB3 PRO 50 65.302 56.551 -23.608 226 HG2 PRO 50 HG2 PRO 50 64.062 54.758 -25.731 227 HG3 PRO 50 HG3 PRO 50 63.379 55.209 -24.134 228 HD2 PRO 50 HD2 PRO 50 62.686 56.554 -26.380 229 HD3 PRO 50 HD3 PRO 50 62.948 57.422 -24.837 230 HA PRO 51 HA PRO 51 68.587 55.527 -28.504 231 HB2 PRO 51 HB2 PRO 51 71.002 55.016 -27.397 232 HB3 PRO 51 HB3 PRO 51 70.396 56.683 -27.603 233 HG2 PRO 51 HG2 PRO 51 70.220 54.960 -25.099 234 HG3 PRO 51 HG3 PRO 51 70.874 56.625 -25.246 235 HD2 PRO 51 HD2 PRO 51 68.297 56.131 -24.473 236 HD3 PRO 51 HD3 PRO 51 68.729 57.552 -25.470 237 H GLU 52 H GLU 52 66.684 53.915 -27.858 238 HA GLU 52 HA GLU 52 67.772 51.191 -27.237 239 HB2 GLU 52 HB2 GLU 52 65.133 52.472 -26.424 240 HB3 GLU 52 HB3 GLU 52 65.498 50.763 -26.218 241 HG2 GLU 52 HG2 GLU 52 67.187 52.947 -24.922 242 HG3 GLU 52 HG3 GLU 52 65.733 52.297 -24.187 243 H GLN 53 H GLN 53 66.782 49.440 -28.314 244 HA GLN 53 HA GLN 53 65.073 50.113 -30.679 245 HB2 GLN 53 HB2 GLN 53 67.503 49.910 -31.225 246 HB3 GLN 53 HB3 GLN 53 67.453 48.224 -30.685 247 HG2 GLN 53 HG2 GLN 53 65.801 47.697 -32.451 248 HG3 GLN 53 HG3 GLN 53 65.733 49.399 -32.920 249 HE21 GLN 53 HE22 GLN 53 66.229 48.051 -35.052 250 HE22 GLN 53 HE21 GLN 53 67.942 47.951 -35.437 251 H GLU 54 H GLU 54 65.943 47.584 -28.340 252 HA GLU 54 HA GLU 54 63.279 46.412 -28.631 253 HB2 GLU 54 HB2 GLU 54 64.050 44.134 -28.996 254 HB3 GLU 54 HB3 GLU 54 64.492 45.183 -30.338 255 HG2 GLU 54 HG2 GLU 54 66.827 45.338 -29.390 256 HG3 GLU 54 HG3 GLU 54 66.358 44.169 -28.151 257 H ALA 55 H ALA 55 62.556 45.309 -26.863 258 HA ALA 55 HA ALA 55 64.257 44.918 -24.474 259 HB1 ALA 55 HB1 ALA 55 61.914 46.877 -24.576 260 HB2 ALA 55 HB2 ALA 55 62.850 46.439 -23.128 261 HB3 ALA 55 HB3 ALA 55 63.632 47.313 -24.453 262 H GLN 56 H GLN 56 63.209 42.834 -25.856 263 HA GLN 56 HA GLN 56 60.997 41.802 -24.184 264 HB2 GLN 56 HB2 GLN 56 59.632 41.185 -26.149 265 HB3 GLN 56 HB3 GLN 56 59.738 42.912 -25.845 266 HG2 GLN 56 HG2 GLN 56 61.331 43.206 -27.696 267 HG3 GLN 56 HG3 GLN 56 61.352 41.471 -27.996 268 HE21 GLN 56 HE22 GLN 56 60.769 42.583 -30.228 269 HE22 GLN 56 HE21 GLN 56 59.041 42.691 -30.535 270 HA PRO 57 HA PRO 57 64.345 38.891 -25.590 271 HB2 PRO 57 HB2 PRO 57 65.684 38.344 -23.314 272 HB3 PRO 57 HB3 PRO 57 65.829 39.925 -24.160 273 HG2 PRO 57 HG2 PRO 57 64.006 39.271 -21.809 274 HG3 PRO 57 HG3 PRO 57 65.210 40.593 -21.924 275 HD2 PRO 57 HD2 PRO 57 62.592 41.003 -22.552 276 HD3 PRO 57 HD3 PRO 57 63.909 41.786 -23.469 277 H GLY 58 H GLY 58 61.894 38.461 -23.098 278 HA2 GLY 58 HA2 GLY 58 60.470 36.719 -22.697 279 HA3 GLY 58 HA3 GLY 58 61.056 35.990 -24.191 280 H ALA 59 H ALA 59 63.372 36.490 -21.580 281 HA ALA 59 HA ALA 59 63.173 33.694 -20.653 282 HB1 ALA 59 HB1 ALA 59 65.635 34.866 -22.021 283 HB2 ALA 59 HB2 ALA 59 65.555 33.283 -21.215 284 HB3 ALA 59 HB3 ALA 59 64.584 33.589 -22.666 285 H LEU 60 H LEU 60 64.264 33.241 -18.788 286 HA LEU 60 HA LEU 60 65.234 35.501 -17.106 287 HB2 LEU 60 HB2 LEU 60 64.283 34.562 -15.241 288 HB3 LEU 60 HB3 LEU 60 63.043 34.390 -16.463 289 HG LEU 60 HG LEU 60 64.877 32.177 -15.410 290 HD11 LEU 60 HD11 LEU 60 61.900 32.675 -15.019 291 HD12 LEU 60 HD12 LEU 60 62.834 31.308 -14.371 292 HD13 LEU 60 HD13 LEU 60 63.170 32.953 -13.808 293 HD21 LEU 60 HD21 LEU 60 64.288 31.595 -17.702 294 HD22 LEU 60 HD22 LEU 60 63.329 30.616 -16.600 295 HD23 LEU 60 HD23 LEU 60 62.577 32.008 -17.405 296 H ALA 61 H ALA 61 66.778 34.767 -15.315 297 HA ALA 61 HA ALA 61 68.696 32.758 -16.354 298 HB1 ALA 61 HB1 ALA 61 69.304 35.346 -14.893 299 HB2 ALA 61 HB2 ALA 61 70.492 34.121 -15.386 300 HB3 ALA 61 HB3 ALA 61 69.579 35.010 -16.616 301 H ALA 62 H ALA 62 69.129 31.079 -15.102 302 HA ALA 62 HA ALA 62 68.490 31.078 -12.204 303 HB1 ALA 62 HB1 ALA 62 69.508 28.871 -14.035 304 HB2 ALA 62 HB2 ALA 62 69.055 28.691 -12.328 305 HB3 ALA 62 HB3 ALA 62 67.821 29.120 -13.530 306 H LEU 63 H LEU 63 70.078 30.746 -10.613 307 HA LEU 63 HA LEU 63 72.844 31.581 -11.387 308 HB2 LEU 63 HB2 LEU 63 71.241 32.578 -9.009 309 HB3 LEU 63 HB3 LEU 63 72.852 33.101 -9.486 310 HG LEU 63 HG LEU 63 70.279 33.618 -11.043 311 HD11 LEU 63 HD11 LEU 63 72.075 35.485 -9.444 312 HD12 LEU 63 HD12 LEU 63 70.624 35.947 -10.361 313 HD13 LEU 63 HD13 LEU 63 70.474 34.899 -8.941 314 HD21 LEU 63 HD21 LEU 63 72.249 33.480 -12.563 315 HD22 LEU 63 HD22 LEU 63 71.620 35.116 -12.427 316 HD23 LEU 63 HD23 LEU 63 73.099 34.659 -11.548 317 H HIS 64 H HIS 64 74.515 31.162 -9.890 318 HA HIS 64 HA HIS 64 74.253 28.726 -8.230 319 HB2 HIS 64 HB2 HIS 64 76.500 30.653 -8.843 320 HB3 HIS 64 HB3 HIS 64 76.678 29.329 -7.702 321 HD2 HIS 64 HD2 HIS 64 77.020 30.139 -11.336 322 HE1 HIS 64 HE1 HIS 64 77.211 25.882 -11.095 323 HE2 HIS 64 HE2 HIS 64 77.671 27.910 -12.564 324 H ALA 65 H ALA 65 74.064 28.697 -6.011 325 HA ALA 65 HA ALA 65 73.365 31.253 -4.712 326 HB1 ALA 65 HB1 ALA 65 73.043 28.366 -3.805 327 HB2 ALA 65 HB2 ALA 65 72.324 29.799 -3.044 328 HB3 ALA 65 HB3 ALA 65 71.826 29.329 -4.679 329 H GLU 66 H GLU 66 76.160 29.235 -4.751 330 HA GLU 66 HA GLU 66 77.330 30.572 -2.388 331 HB2 GLU 66 HB2 GLU 66 77.886 28.486 -1.280 332 HB3 GLU 66 HB3 GLU 66 76.144 28.639 -1.454 333 HG2 GLU 66 HG2 GLU 66 76.200 27.078 -3.400 334 HG3 GLU 66 HG3 GLU 66 77.949 26.923 -3.218 335 H GLY 67 H GLY 67 79.641 29.842 -2.019 336 HA2 GLY 67 HA2 GLY 67 81.804 29.444 -2.744 337 HA3 GLY 67 HA3 GLY 67 81.144 28.671 -4.180 338 HA PRO 68 HA PRO 68 83.328 32.640 -5.312 339 HB2 PRO 68 HB2 PRO 68 84.761 31.715 -7.465 340 HB3 PRO 68 HB3 PRO 68 85.279 31.511 -5.764 341 HG2 PRO 68 HG2 PRO 68 83.784 29.518 -7.501 342 HG3 PRO 68 HG3 PRO 68 85.262 29.241 -6.522 343 HD2 PRO 68 HD2 PRO 68 82.816 28.595 -5.574 344 HD3 PRO 68 HD3 PRO 68 84.040 29.324 -4.490 345 H LEU 69 H LEU 69 81.179 30.535 -7.071 346 HA LEU 69 HA LEU 69 80.621 32.583 -9.143 347 HB2 LEU 69 HB2 LEU 69 79.604 29.745 -8.814 348 HB3 LEU 69 HB3 LEU 69 79.175 30.819 -10.137 349 HG LEU 69 HG LEU 69 81.990 29.815 -9.587 350 HD11 LEU 69 HD11 LEU 69 80.008 29.044 -11.756 351 HD12 LEU 69 HD12 LEU 69 81.641 28.382 -11.505 352 HD13 LEU 69 HD13 LEU 69 80.372 28.067 -10.316 353 HD21 LEU 69 HD21 LEU 69 82.101 31.954 -10.757 354 HD22 LEU 69 HD22 LEU 69 82.456 30.652 -11.893 355 HD23 LEU 69 HD23 LEU 69 80.856 31.420 -11.921 356 H ALA 70 H ALA 70 79.603 32.430 -6.014 357 HA ALA 70 HA ALA 70 76.830 32.274 -6.127 358 HB1 ALA 70 HB1 ALA 70 78.541 34.072 -4.355 359 HB2 ALA 70 HB2 ALA 70 76.855 33.601 -4.043 360 HB3 ALA 70 HB3 ALA 70 78.132 32.372 -4.041 361 H GLY 71 H GLY 71 75.302 33.351 -7.037 362 HA2 GLY 71 HA2 GLY 71 74.004 35.118 -7.851 363 HA3 GLY 71 HA3 GLY 71 75.320 36.252 -7.557 364 H LEU 72 H LEU 72 76.594 33.658 -9.313 365 HA LEU 72 HA LEU 72 76.365 35.105 -11.906 366 HB2 LEU 72 HB2 LEU 72 78.435 33.045 -11.067 367 HB3 LEU 72 HB3 LEU 72 78.488 34.072 -12.464 368 HG LEU 72 HG LEU 72 78.881 34.940 -9.599 369 HD11 LEU 72 HD11 LEU 72 80.641 35.194 -12.076 370 HD12 LEU 72 HD12 LEU 72 81.075 35.593 -10.400 371 HD13 LEU 72 HD13 LEU 72 80.790 33.912 -10.867 372 HD21 LEU 72 HD21 LEU 72 77.588 36.741 -10.689 373 HD22 LEU 72 HD22 LEU 72 79.269 37.223 -10.475 374 HD23 LEU 72 HD23 LEU 72 78.696 36.715 -12.075 375 HA PRO 73 HA PRO 73 73.833 32.269 -13.759 376 HB2 PRO 73 HB2 PRO 73 74.729 31.868 -16.325 377 HB3 PRO 73 HB3 PRO 73 74.168 33.454 -15.719 378 HG2 PRO 73 HG2 PRO 73 76.978 32.385 -16.040 379 HG3 PRO 73 HG3 PRO 73 76.371 34.017 -16.439 380 HD2 PRO 73 HD2 PRO 73 77.710 33.347 -14.163 381 HD3 PRO 73 HD3 PRO 73 76.561 34.725 -14.232 382 H VAL 74 H VAL 74 73.232 30.114 -14.428 383 HA VAL 74 HA VAL 74 75.336 28.079 -13.941 384 HB VAL 74 HB VAL 74 72.359 27.670 -14.273 385 HG11 VAL 74 HG11 VAL 74 74.566 25.820 -13.277 386 HG12 VAL 74 HG12 VAL 74 72.823 25.486 -13.201 387 HG13 VAL 74 HG13 VAL 74 73.615 25.620 -14.768 388 HG21 VAL 74 HG21 VAL 74 72.836 28.997 -12.251 389 HG22 VAL 74 HG22 VAL 74 72.384 27.353 -11.810 390 HG23 VAL 74 HG23 VAL 74 74.092 27.841 -11.765 391 H THR 75 H THR 75 73.175 29.076 -16.643 392 HA THR 75 HA THR 75 74.777 27.332 -18.481 393 HB THR 75 HB THR 75 72.870 27.045 -19.838 394 HG1 THR 75 HG1 THR 75 70.848 28.054 -19.044 395 HG21 THR 75 HG21 THR 75 71.888 26.775 -16.984 396 HG22 THR 75 HG22 THR 75 71.406 25.825 -18.409 397 HG23 THR 75 HG23 THR 75 73.054 25.679 -17.758 398 H ARG 76 H ARG 76 74.654 27.956 -20.847 399 HA ARG 76 HA ARG 76 75.738 30.582 -21.307 400 HB2 ARG 76 HB2 ARG 76 75.686 30.036 -23.648 401 HB3 ARG 76 HB3 ARG 76 76.208 28.625 -22.745 402 HG2 ARG 76 HG2 ARG 76 73.828 27.705 -22.963 403 HG3 ARG 76 HG3 ARG 76 73.459 29.100 -23.981 404 HD2 ARG 76 HD2 ARG 76 73.899 27.320 -25.446 405 HD3 ARG 76 HD3 ARG 76 75.309 28.386 -25.536 406 HE ARG 76 HE ARG 76 75.903 26.428 -23.582 407 HH11 ARG 76 HH11 ARG 76 75.262 26.391 -27.030 408 HH12 ARG 76 HH12 ARG 76 76.165 24.922 -27.276 409 HH21 ARG 76 HH21 ARG 76 77.051 24.561 -23.971 410 HH22 ARG 76 HH22 ARG 76 77.153 23.924 -25.585 411 H SER 77 H SER 77 72.419 29.359 -21.586 412 HA SER 77 HA SER 77 71.242 31.783 -22.588 413 HB2 SER 77 HB2 SER 77 69.981 29.630 -20.844 414 HB3 SER 77 HB3 SER 77 69.131 30.834 -21.833 415 HG SER 77 HG SER 77 69.322 28.803 -22.921 416 H ASP 78 H ASP 78 71.752 30.543 -19.207 417 HA ASP 78 HA ASP 78 70.592 32.815 -17.912 418 HB2 ASP 78 HB2 ASP 78 72.876 31.045 -17.000 419 HB3 ASP 78 HB3 ASP 78 71.967 32.151 -15.972 420 H ALA 79 H ALA 79 73.989 32.236 -18.976 421 HA ALA 79 HA ALA 79 75.044 34.708 -18.038 422 HB1 ALA 79 HB1 ALA 79 75.937 32.883 -20.327 423 HB2 ALA 79 HB2 ALA 79 76.912 34.168 -19.608 424 HB3 ALA 79 HB3 ALA 79 76.448 32.762 -18.625 425 H ARG 80 H ARG 80 73.683 33.931 -21.289 426 HA ARG 80 HA ARG 80 74.107 36.593 -22.360 427 HB2 ARG 80 HB2 ARG 80 72.237 34.311 -23.127 428 HB3 ARG 80 HB3 ARG 80 72.318 35.831 -24.028 429 HG2 ARG 80 HG2 ARG 80 74.675 35.493 -24.558 430 HG3 ARG 80 HG3 ARG 80 74.764 34.080 -23.506 431 HD2 ARG 80 HD2 ARG 80 74.628 33.329 -25.787 432 HD3 ARG 80 HD3 ARG 80 73.136 32.890 -24.936 433 HE ARG 80 HE ARG 80 72.894 35.443 -26.313 434 HH11 ARG 80 HH11 ARG 80 72.843 32.005 -27.008 435 HH12 ARG 80 HH12 ARG 80 71.836 32.213 -28.414 436 HH21 ARG 80 HH21 ARG 80 71.593 35.630 -28.111 437 HH22 ARG 80 HH22 ARG 80 71.164 34.215 -29.022 438 H VAL 81 H VAL 81 71.277 35.170 -20.684 439 HA VAL 81 HA VAL 81 69.630 37.536 -20.835 440 HB VAL 81 HB VAL 81 69.683 35.254 -18.829 441 HG11 VAL 81 HG11 VAL 81 67.658 37.525 -19.141 442 HG12 VAL 81 HG12 VAL 81 67.353 36.036 -18.237 443 HG13 VAL 81 HG13 VAL 81 68.607 37.145 -17.685 444 HG21 VAL 81 HG21 VAL 81 69.043 34.736 -21.194 445 HG22 VAL 81 HG22 VAL 81 67.749 34.463 -20.020 446 HG23 VAL 81 HG23 VAL 81 67.727 35.915 -21.062 447 H LEU 82 H LEU 82 71.913 36.429 -18.266 448 HA LEU 82 HA LEU 82 71.657 38.745 -16.622 449 HB2 LEU 82 HB2 LEU 82 73.960 36.834 -17.132 450 HB3 LEU 82 HB3 LEU 82 74.177 38.243 -16.106 451 HG LEU 82 HG LEU 82 72.212 35.988 -15.569 452 HD11 LEU 82 HD11 LEU 82 74.728 36.896 -14.105 453 HD12 LEU 82 HD12 LEU 82 73.768 35.428 -13.803 454 HD13 LEU 82 HD13 LEU 82 74.692 35.600 -15.309 455 HD21 LEU 82 HD21 LEU 82 71.235 38.003 -14.626 456 HD22 LEU 82 HD22 LEU 82 72.032 37.147 -13.308 457 HD23 LEU 82 HD23 LEU 82 72.823 38.555 -14.033 458 H ILE 83 H ILE 83 73.996 38.248 -19.336 459 HA ILE 83 HA ILE 83 75.196 40.811 -19.210 460 HB ILE 83 HB ILE 83 74.693 38.905 -21.511 461 HG12 ILE 83 HG12 ILE 83 77.297 39.803 -20.192 462 HG13 ILE 83 HG13 ILE 83 76.353 38.450 -19.585 463 HG21 ILE 83 HG21 ILE 83 76.211 41.556 -21.659 464 HG22 ILE 83 HG22 ILE 83 76.244 40.288 -22.897 465 HG23 ILE 83 HG23 ILE 83 74.748 41.135 -22.573 466 HD11 ILE 83 HD11 ILE 83 77.634 38.604 -22.338 467 HD12 ILE 83 HD12 ILE 83 78.125 37.594 -20.972 468 HD13 ILE 83 HD13 ILE 83 76.571 37.292 -21.774 469 H PHE 84 H PHE 84 72.248 39.861 -21.082 470 HA PHE 84 HA PHE 84 71.790 42.482 -22.066 471 HB2 PHE 84 HB2 PHE 84 70.818 40.249 -22.872 472 HB3 PHE 84 HB3 PHE 84 69.658 40.378 -21.568 473 HD1 PHE 84 HD1 PHE 84 71.090 42.712 -24.197 474 HD2 PHE 84 HD2 PHE 84 67.543 41.157 -22.299 475 HE1 PHE 84 HE1 PHE 84 69.713 43.948 -25.795 476 HE2 PHE 84 HE2 PHE 84 66.145 42.498 -23.856 477 HZ PHE 84 HZ PHE 84 67.216 43.879 -25.624 478 H ASN 85 H ASN 85 70.235 40.872 -19.220 479 HA ASN 85 HA ASN 85 68.601 43.126 -18.573 480 HB2 ASN 85 HB2 ASN 85 68.116 40.814 -17.875 481 HB3 ASN 85 HB3 ASN 85 69.557 40.788 -16.857 482 HD21 ASN 85 HD22 ASN 85 69.459 41.813 -14.776 483 HD22 ASN 85 HD21 ASN 85 67.967 42.524 -14.191 484 H GLU 86 H GLU 86 71.830 42.140 -17.306 485 HA GLU 86 HA GLU 86 72.062 44.294 -15.408 486 HB2 GLU 86 HB2 GLU 86 73.495 42.302 -15.310 487 HB3 GLU 86 HB3 GLU 86 74.229 42.727 -16.874 488 HG2 GLU 86 HG2 GLU 86 75.222 44.715 -15.971 489 HG3 GLU 86 HG3 GLU 86 74.274 44.594 -14.486 490 H TRP 87 H TRP 87 73.231 44.000 -18.873 491 HA TRP 87 HA TRP 87 74.230 46.641 -19.040 492 HB2 TRP 87 HB2 TRP 87 74.706 45.008 -20.732 493 HB3 TRP 87 HB3 TRP 87 72.997 44.781 -21.075 494 HD1 TRP 87 HD1 TRP 87 75.666 47.535 -21.456 495 HE1 TRP 87 HE1 TRP 87 75.208 48.737 -23.700 496 HE3 TRP 87 HE3 TRP 87 71.227 45.311 -22.705 497 HZ2 TRP 87 HZ2 TRP 87 73.277 48.648 -25.790 498 HZ3 TRP 87 HZ3 TRP 87 70.210 45.778 -24.877 499 HH2 TRP 87 HH2 TRP 87 71.172 47.455 -26.439 500 H GLU 88 H GLU 88 70.839 45.498 -19.747 501 HA GLU 88 HA GLU 88 69.800 47.996 -20.538 502 HB2 GLU 88 HB2 GLU 88 68.561 45.596 -19.148 503 HB3 GLU 88 HB3 GLU 88 67.640 47.039 -19.533 504 HG2 GLU 88 HG2 GLU 88 68.152 46.810 -21.917 505 HG3 GLU 88 HG3 GLU 88 69.015 45.309 -21.607 506 H GLU 89 H GLU 89 69.837 46.650 -17.133 507 HA GLU 89 HA GLU 89 68.619 49.073 -16.101 508 HB2 GLU 89 HB2 GLU 89 70.161 46.878 -14.669 509 HB3 GLU 89 HB3 GLU 89 69.245 48.159 -13.874 510 HG2 GLU 89 HG2 GLU 89 68.110 46.002 -15.702 511 HG3 GLU 89 HG3 GLU 89 67.958 46.077 -13.954 512 H ARG 90 H ARG 90 72.021 47.965 -16.153 513 HA ARG 90 HA ARG 90 73.200 50.242 -14.832 514 HB2 ARG 90 HB2 ARG 90 74.327 48.583 -17.129 515 HB3 ARG 90 HB3 ARG 90 75.261 49.657 -16.087 516 HG2 ARG 90 HG2 ARG 90 73.704 47.378 -14.880 517 HG3 ARG 90 HG3 ARG 90 75.228 47.080 -15.712 518 HD2 ARG 90 HD2 ARG 90 76.376 48.609 -14.132 519 HD3 ARG 90 HD3 ARG 90 74.844 48.892 -13.299 520 HE ARG 90 HE ARG 90 76.332 46.282 -13.478 521 HH11 ARG 90 HH11 ARG 90 74.018 48.189 -11.652 522 HH12 ARG 90 HH12 ARG 90 73.732 46.900 -10.520 523 HH21 ARG 90 HH21 ARG 90 75.790 44.657 -12.171 524 HH22 ARG 90 HH22 ARG 90 74.801 44.952 -10.751 525 H LYS 91 H LYS 91 72.442 49.652 -18.260 526 HA LYS 91 HA LYS 91 73.299 52.248 -19.119 527 HB2 LYS 91 HB2 LYS 91 73.076 50.260 -20.641 528 HB3 LYS 91 HB3 LYS 91 71.319 50.352 -20.470 529 HG2 LYS 91 HG2 LYS 91 71.386 52.619 -21.552 530 HG3 LYS 91 HG3 LYS 91 73.135 52.411 -21.796 531 HD2 LYS 91 HD2 LYS 91 72.715 50.441 -23.211 532 HD3 LYS 91 HD3 LYS 91 70.980 50.518 -22.840 533 HE2 LYS 91 HE2 LYS 91 70.987 52.873 -23.836 534 HE3 LYS 91 HE3 LYS 91 72.620 52.539 -24.436 535 HZ1 LYS 91 HZ1 LYS 91 70.166 50.954 -25.073 536 HZ2 LYS 91 HZ2 LYS 91 70.835 52.025 -26.082 537 HZ3 LYS 91 HZ3 LYS 91 71.663 50.651 -25.700 538 H LYS 92 H LYS 92 70.040 51.198 -18.041 539 HA LYS 92 HA LYS 92 68.748 53.729 -18.551 540 HB2 LYS 92 HB2 LYS 92 68.308 51.630 -16.399 541 HB3 LYS 92 HB3 LYS 92 67.318 53.080 -16.536 542 HG2 LYS 92 HG2 LYS 92 66.486 52.467 -18.700 543 HG3 LYS 92 HG3 LYS 92 67.660 51.162 -18.872 544 HD2 LYS 92 HD2 LYS 92 66.630 50.064 -16.830 545 HD3 LYS 92 HD3 LYS 92 65.346 51.288 -16.890 546 HE2 LYS 92 HE2 LYS 92 64.721 50.531 -19.163 547 HE3 LYS 92 HE3 LYS 92 66.079 49.395 -19.173 548 HZ1 LYS 92 HZ1 LYS 92 63.748 49.260 -17.325 549 HZ2 LYS 92 HZ2 LYS 92 64.056 48.227 -18.555 550 HZ3 LYS 92 HZ3 LYS 92 65.049 48.264 -17.241 551 H SER 93 H SER 93 70.925 52.713 -15.874 552 HA SER 93 HA SER 93 70.947 55.460 -14.801 553 HB2 SER 93 HB2 SER 93 72.783 53.115 -14.239 554 HB3 SER 93 HB3 SER 93 72.810 54.676 -13.402 555 HG SER 93 HG SER 93 71.531 53.116 -12.276 556 H GLU 94 H GLU 94 72.805 53.845 -17.288 557 HA GLU 94 HA GLU 94 74.733 56.111 -17.590 558 HB2 GLU 94 HB2 GLU 94 75.405 53.142 -17.543 559 HB3 GLU 94 HB3 GLU 94 76.520 54.477 -17.751 560 HG2 GLU 94 HG2 GLU 94 75.886 55.243 -15.420 561 HG3 GLU 94 HG3 GLU 94 74.923 53.758 -15.289 562 HA PRO 95 HA PRO 95 72.624 54.749 -21.499 563 HB2 PRO 95 HB2 PRO 95 72.732 57.171 -22.900 564 HB3 PRO 95 HB3 PRO 95 71.451 56.650 -21.769 565 HG2 PRO 95 HG2 PRO 95 73.875 58.374 -21.184 566 HG3 PRO 95 HG3 PRO 95 72.167 58.660 -20.712 567 HD2 PRO 95 HD2 PRO 95 73.886 57.598 -18.948 568 HD3 PRO 95 HD3 PRO 95 72.241 56.913 -19.083 569 H TRP 96 H TRP 96 75.853 55.624 -21.099 570 HA TRP 96 HA TRP 96 76.746 55.229 -23.879 571 HB2 TRP 96 HB2 TRP 96 78.978 55.680 -22.849 572 HB3 TRP 96 HB3 TRP 96 77.800 56.957 -22.633 573 HD1 TRP 96 HD1 TRP 96 79.669 54.275 -20.645 574 HE1 TRP 96 HE1 TRP 96 79.560 54.824 -18.134 575 HE3 TRP 96 HE3 TRP 96 76.414 58.233 -20.814 576 HZ2 TRP 96 HZ2 TRP 96 78.230 56.726 -16.424 577 HZ3 TRP 96 HZ3 TRP 96 75.731 59.383 -18.720 578 HH2 TRP 96 HH2 TRP 96 76.623 58.637 -16.525 579 H LEU 97 H LEU 97 75.884 53.026 -21.428 580 HA LEU 97 HA LEU 97 77.981 51.289 -21.199 581 HB2 LEU 97 HB2 LEU 97 75.339 51.424 -20.385 582 HB3 LEU 97 HB3 LEU 97 75.264 50.074 -21.457 583 HG LEU 97 HG LEU 97 75.575 49.066 -19.466 584 HD11 LEU 97 HD11 LEU 97 78.554 49.489 -19.976 585 HD12 LEU 97 HD12 LEU 97 77.773 48.150 -19.125 586 HD13 LEU 97 HD13 LEU 97 77.560 48.313 -20.861 587 HD21 LEU 97 HD21 LEU 97 75.771 51.008 -18.116 588 HD22 LEU 97 HD22 LEU 97 77.035 49.861 -17.646 589 HD23 LEU 97 HD23 LEU 97 77.452 51.282 -18.636 590 H ARG 98 H ARG 98 78.966 49.692 -22.362 591 HA ARG 98 HA ARG 98 78.136 49.110 -25.145 592 HB2 ARG 98 HB2 ARG 98 80.598 48.288 -23.555 593 HB3 ARG 98 HB3 ARG 98 80.322 47.948 -25.269 594 HG2 ARG 98 HG2 ARG 98 80.250 50.378 -25.762 595 HG3 ARG 98 HG3 ARG 98 80.540 50.740 -24.049 596 HD2 ARG 98 HD2 ARG 98 82.690 49.506 -24.157 597 HD3 ARG 98 HD3 ARG 98 82.419 49.208 -25.889 598 HE ARG 98 HE ARG 98 82.197 51.996 -25.482 599 HH11 ARG 98 HH11 ARG 98 84.759 49.612 -25.261 600 HH12 ARG 98 HH12 ARG 98 86.006 50.785 -25.588 601 HH21 ARG 98 HH21 ARG 98 83.836 53.441 -25.893 602 HH22 ARG 98 HH22 ARG 98 85.486 52.899 -25.940 603 H LEU 99 H LEU 99 77.916 47.006 -26.002 604 HA LEU 99 HA LEU 99 77.036 44.878 -24.094 605 HB2 LEU 99 HB2 LEU 99 75.223 46.333 -24.923 606 HB3 LEU 99 HB3 LEU 99 75.582 45.922 -26.564 607 HG LEU 99 HG LEU 99 73.553 44.842 -25.562 608 HD11 LEU 99 HD11 LEU 99 75.505 42.676 -26.343 609 HD12 LEU 99 HD12 LEU 99 73.785 42.863 -26.761 610 HD13 LEU 99 HD13 LEU 99 74.974 43.906 -27.504 611 HD21 LEU 99 HD21 LEU 99 74.696 44.472 -23.298 612 HD22 LEU 99 HD22 LEU 99 73.457 43.391 -23.894 613 HD23 LEU 99 HD23 LEU 99 75.197 42.923 -24.001 614 H ASP 100 H ASP 100 77.906 42.898 -24.590 615 HA ASP 100 HA ASP 100 78.403 42.138 -27.398 616 HB2 ASP 100 HB2 ASP 100 80.533 43.161 -26.398 617 HB3 ASP 100 HB3 ASP 100 80.594 41.766 -25.326 618 H MET 101 H MET 101 77.932 40.010 -27.770 619 HA MET 101 HA MET 101 77.416 38.199 -25.447 620 HB2 MET 101 HB2 MET 101 75.580 38.697 -27.821 621 HB3 MET 101 HB3 MET 101 75.345 37.441 -26.599 622 HG2 MET 101 HG2 MET 101 75.149 39.132 -24.835 623 HG3 MET 101 HG3 MET 101 75.387 40.420 -26.025 624 HE1 MET 101 HE1 MET 101 73.073 41.664 -25.249 625 HE2 MET 101 HE2 MET 101 71.585 40.716 -25.064 626 HE3 MET 101 HE3 MET 101 72.980 40.374 -24.019 627 H SER 102 H SER 102 79.550 38.423 -27.793 628 HA SER 102 HA SER 102 79.282 35.879 -29.200 629 HB2 SER 102 HB2 SER 102 81.676 37.697 -28.730 630 HB3 SER 102 HB3 SER 102 81.690 36.248 -29.751 631 HG SER 102 HG SER 102 81.270 38.201 -30.949 632 H ASP 103 H ASP 103 80.564 33.960 -28.832 633 HA ASP 103 HA ASP 103 80.230 32.954 -26.285 634 HB2 ASP 103 HB2 ASP 103 82.209 32.011 -28.397 635 HB3 ASP 103 HB3 ASP 103 81.675 31.067 -27.009 636 H LYS 104 H LYS 104 83.245 34.409 -27.512 637 HA LYS 104 HA LYS 104 84.918 33.784 -25.278 638 HB2 LYS 104 HB2 LYS 104 85.019 36.093 -27.264 639 HB3 LYS 104 HB3 LYS 104 86.290 35.718 -26.091 640 HG2 LYS 104 HG2 LYS 104 86.490 33.419 -27.056 641 HG3 LYS 104 HG3 LYS 104 85.339 33.861 -28.319 642 HD2 LYS 104 HD2 LYS 104 88.032 35.208 -27.825 643 HD3 LYS 104 HD3 LYS 104 87.706 33.977 -29.051 644 HE2 LYS 104 HE2 LYS 104 86.013 35.485 -30.107 645 HE3 LYS 104 HE3 LYS 104 86.403 36.738 -28.920 646 HZ1 LYS 104 HZ1 LYS 104 88.327 35.596 -30.888 647 HZ2 LYS 104 HZ2 LYS 104 87.638 37.070 -30.990 648 HZ3 LYS 104 HZ3 LYS 104 88.693 36.750 -29.788 649 H ALA 105 H ALA 105 82.513 36.382 -25.609 650 HA ALA 105 HA ALA 105 83.324 37.849 -23.245 651 HB1 ALA 105 HB1 ALA 105 80.588 37.672 -24.559 652 HB2 ALA 105 HB2 ALA 105 81.143 38.896 -23.406 653 HB3 ALA 105 HB3 ALA 105 81.882 38.802 -25.014 654 H ILE 106 H ILE 106 81.153 35.101 -23.806 655 HA ILE 106 HA ILE 106 80.231 34.961 -21.054 656 HB ILE 106 HB ILE 106 79.975 33.154 -23.476 657 HG12 ILE 106 HG12 ILE 106 77.580 33.623 -23.184 658 HG13 ILE 106 HG13 ILE 106 77.918 34.603 -21.757 659 HG21 ILE 106 HG21 ILE 106 78.985 32.549 -20.653 660 HG22 ILE 106 HG22 ILE 106 78.438 31.719 -22.128 661 HG23 ILE 106 HG23 ILE 106 80.119 31.582 -21.629 662 HD11 ILE 106 HD11 ILE 106 78.864 35.279 -24.569 663 HD12 ILE 106 HD12 ILE 106 77.399 35.925 -23.802 664 HD13 ILE 106 HD13 ILE 106 78.990 36.324 -23.135 665 H PHE 107 H PHE 107 82.655 33.078 -22.936 666 HA PHE 107 HA PHE 107 83.641 31.450 -20.848 667 HB2 PHE 107 HB2 PHE 107 85.309 32.858 -22.969 668 HB3 PHE 107 HB3 PHE 107 85.775 31.434 -22.068 669 HD1 PHE 107 HD1 PHE 107 82.750 30.187 -22.558 670 HD2 PHE 107 HD2 PHE 107 85.973 31.731 -24.970 671 HE1 PHE 107 HE1 PHE 107 82.033 28.740 -24.433 672 HE2 PHE 107 HE2 PHE 107 85.243 30.279 -26.865 673 HZ PHE 107 HZ PHE 107 83.277 28.777 -26.589 674 H ARG 108 H ARG 108 84.756 34.771 -21.713 675 HA ARG 108 HA ARG 108 86.765 34.812 -19.676 676 HB2 ARG 108 HB2 ARG 108 86.691 35.851 -21.975 677 HB3 ARG 108 HB3 ARG 108 85.650 37.122 -21.334 678 HG2 ARG 108 HG2 ARG 108 88.396 36.444 -20.202 679 HG3 ARG 108 HG3 ARG 108 88.176 37.512 -21.588 680 HD2 ARG 108 HD2 ARG 108 86.797 39.046 -20.217 681 HD3 ARG 108 HD3 ARG 108 87.093 38.026 -18.793 682 HE ARG 108 HE ARG 108 89.604 38.684 -19.943 683 HH11 ARG 108 HH11 ARG 108 87.057 40.352 -18.201 684 HH12 ARG 108 HH12 ARG 108 88.156 41.538 -17.550 685 HH21 ARG 108 HH21 ARG 108 90.947 40.224 -19.081 686 HH22 ARG 108 HH22 ARG 108 90.305 41.461 -18.042 687 H ARG 109 H ARG 109 83.467 36.204 -19.785 688 HA ARG 109 HA ARG 109 83.724 37.474 -17.163 689 HB2 ARG 109 HB2 ARG 109 82.196 38.180 -19.053 690 HB3 ARG 109 HB3 ARG 109 81.171 36.785 -18.679 691 HG2 ARG 109 HG2 ARG 109 80.734 37.690 -16.427 692 HG3 ARG 109 HG3 ARG 109 81.912 38.981 -16.688 693 HD2 ARG 109 HD2 ARG 109 80.497 39.808 -18.622 694 HD3 ARG 109 HD3 ARG 109 79.309 38.576 -18.226 695 HE ARG 109 HE ARG 109 78.555 39.849 -16.437 696 HH11 ARG 109 HH11 ARG 109 81.675 41.210 -17.334 697 HH12 ARG 109 HH12 ARG 109 81.420 42.633 -16.373 698 HH21 ARG 109 HH21 ARG 109 78.212 41.837 -15.423 699 HH22 ARG 109 HH22 ARG 109 79.565 42.911 -15.250 700 H TYR 110 H TYR 110 82.545 34.326 -18.284 701 HA TYR 110 HA TYR 110 82.151 33.437 -15.458 702 HB2 TYR 110 HB2 TYR 110 80.485 32.609 -17.844 703 HB3 TYR 110 HB3 TYR 110 80.231 32.224 -16.155 704 HD1 TYR 110 HD2 TYR 110 80.058 34.420 -14.551 705 HD2 TYR 110 HD1 TYR 110 79.187 34.276 -18.772 706 HE1 TYR 110 HE2 TYR 110 78.635 36.474 -14.347 707 HE2 TYR 110 HE1 TYR 110 77.737 36.295 -18.553 708 HH TYR 110 HH TYR 110 76.851 37.869 -17.119 709 HA PRO 111 HA PRO 111 85.420 30.995 -17.534 710 HB2 PRO 111 HB2 PRO 111 86.851 30.179 -15.331 711 HB3 PRO 111 HB3 PRO 111 86.962 31.809 -16.060 712 HG2 PRO 111 HG2 PRO 111 85.262 30.940 -13.699 713 HG3 PRO 111 HG3 PRO 111 86.362 32.354 -13.809 714 HD2 PRO 111 HD2 PRO 111 83.709 32.622 -14.213 715 HD3 PRO 111 HD3 PRO 111 84.868 33.513 -15.249 716 H HIS 112 H HIS 112 83.119 29.777 -15.181 717 HA HIS 112 HA HIS 112 83.758 26.953 -15.546 718 HB2 HIS 112 HB2 HIS 112 81.840 26.565 -14.221 719 HB3 HIS 112 HB3 HIS 112 82.628 27.983 -13.538 720 HD2 HIS 112 HD2 HIS 112 79.320 26.797 -14.121 721 HE1 HIS 112 HE1 HIS 112 78.819 30.875 -15.219 722 HE2 HIS 112 HE2 HIS 112 77.621 28.796 -14.587 723 H LEU 113 H LEU 113 81.876 29.320 -17.322 724 HA LEU 113 HA LEU 113 80.298 27.391 -18.774 725 HB2 LEU 113 HB2 LEU 113 80.095 30.087 -17.961 726 HB3 LEU 113 HB3 LEU 113 80.346 30.205 -19.681 727 HG LEU 113 HG LEU 113 78.024 30.254 -19.144 728 HD11 LEU 113 HD11 LEU 113 78.682 27.520 -20.341 729 HD12 LEU 113 HD12 LEU 113 77.164 28.393 -20.536 730 HD13 LEU 113 HD13 LEU 113 78.649 29.061 -21.228 731 HD21 LEU 113 HD21 LEU 113 77.818 29.196 -17.072 732 HD22 LEU 113 HD22 LEU 113 76.852 28.236 -18.179 733 HD23 LEU 113 HD23 LEU 113 78.433 27.636 -17.665 734 H ARG 114 H ARG 114 83.454 27.949 -19.107 735 HA ARG 114 HA ARG 114 83.575 27.939 -22.072 736 HB2 ARG 114 HB2 ARG 114 85.154 29.363 -20.831 737 HB3 ARG 114 HB3 ARG 114 85.799 27.958 -20.000 738 HG2 ARG 114 HG2 ARG 114 85.840 27.540 -22.916 739 HG3 ARG 114 HG3 ARG 114 86.602 29.071 -22.507 740 HD2 ARG 114 HD2 ARG 114 88.245 27.269 -22.602 741 HD3 ARG 114 HD3 ARG 114 88.148 27.954 -20.967 742 HE ARG 114 HE ARG 114 86.377 25.856 -20.860 743 HH11 ARG 114 HH11 ARG 114 89.799 25.919 -21.669 744 HH12 ARG 114 HH12 ARG 114 90.015 24.270 -21.148 745 HH21 ARG 114 HH21 ARG 114 86.698 23.864 -20.259 746 HH22 ARG 114 HH22 ARG 114 88.275 23.112 -20.346 Start of MODEL 15 1 H1 MET 1 H1 MET 1 31.741 6.655 -91.882 2 H2 MET 1 H2 MET 1 30.361 5.962 -92.421 3 H3 MET 1 H3 MET 1 31.615 5.023 -91.954 4 HA MET 1 HA MET 1 29.896 5.007 -90.267 5 HB2 MET 1 HB2 MET 1 32.305 4.780 -89.616 6 HB3 MET 1 HB3 MET 1 32.383 6.520 -89.332 7 HG2 MET 1 HG2 MET 1 30.699 6.309 -87.536 8 HG3 MET 1 HG3 MET 1 30.534 4.581 -87.880 9 HE1 MET 1 HE1 MET 1 30.857 4.055 -85.317 10 HE2 MET 1 HE2 MET 1 32.226 4.648 -84.350 11 HE3 MET 1 HE3 MET 1 31.024 5.795 -84.984 12 H ARG 2 H ARG 2 28.450 6.110 -88.902 13 HA ARG 2 HA ARG 2 28.300 9.093 -89.093 14 HB2 ARG 2 HB2 ARG 2 26.801 8.038 -90.776 15 HB3 ARG 2 HB3 ARG 2 25.993 7.139 -89.487 16 HG2 ARG 2 HG2 ARG 2 25.220 9.275 -88.477 17 HG3 ARG 2 HG3 ARG 2 26.112 10.184 -89.706 18 HD2 ARG 2 HD2 ARG 2 23.765 10.117 -90.328 19 HD3 ARG 2 HD3 ARG 2 24.703 9.178 -91.478 20 HE ARG 2 HE ARG 2 23.651 7.224 -90.800 21 HH11 ARG 2 HH11 ARG 2 22.707 9.717 -88.514 22 HH12 ARG 2 HH12 ARG 2 21.497 8.704 -87.778 23 HH21 ARG 2 HH21 ARG 2 22.101 5.994 -89.811 24 HH22 ARG 2 HH22 ARG 2 21.164 6.651 -88.502 25 H GLY 3 H GLY 3 27.714 10.121 -87.296 26 HA2 GLY 3 HA2 GLY 3 26.904 10.552 -85.170 27 HA3 GLY 3 HA3 GLY 3 26.401 8.879 -84.990 28 H SER 4 H SER 4 28.064 10.953 -83.387 29 HA SER 4 HA SER 4 29.901 8.976 -82.199 30 HB2 SER 4 HB2 SER 4 31.104 10.312 -84.065 31 HB3 SER 4 HB3 SER 4 31.023 11.691 -82.961 32 HG SER 4 HG SER 4 32.985 10.471 -82.746 33 H HIS 5 H HIS 5 27.442 10.080 -81.291 34 HA HIS 5 HA HIS 5 28.031 12.374 -79.536 35 HB2 HIS 5 HB2 HIS 5 25.403 10.961 -80.088 36 HB3 HIS 5 HB3 HIS 5 25.619 12.496 -79.249 37 HD2 HIS 5 HD2 HIS 5 24.744 11.224 -82.564 38 HE1 HIS 5 HE1 HIS 5 26.500 15.016 -83.433 39 HE2 HIS 5 HE2 HIS 5 25.101 13.109 -84.377 40 H HIS 6 H HIS 6 28.136 12.396 -77.373 41 HA HIS 6 HA HIS 6 26.919 10.328 -75.720 42 HB2 HIS 6 HB2 HIS 6 28.921 9.715 -74.493 43 HB3 HIS 6 HB3 HIS 6 29.081 9.263 -76.181 44 HD2 HIS 6 HD2 HIS 6 30.747 10.890 -77.727 45 HE1 HIS 6 HE1 HIS 6 32.997 12.339 -74.404 46 HE2 HIS 6 HE2 HIS 6 32.933 12.136 -76.943 47 H HIS 7 H HIS 7 26.449 11.015 -73.673 48 HA HIS 7 HA HIS 7 27.490 13.564 -72.600 49 HB2 HIS 7 HB2 HIS 7 24.525 13.049 -73.096 50 HB3 HIS 7 HB3 HIS 7 25.170 14.348 -72.102 51 HD2 HIS 7 HD2 HIS 7 24.501 13.409 -75.724 52 HE1 HIS 7 HE1 HIS 7 26.205 17.320 -75.820 53 HE2 HIS 7 HE2 HIS 7 25.038 15.528 -77.202 54 H HIS 8 H HIS 8 27.591 13.545 -70.388 55 HA HIS 8 HA HIS 8 25.915 11.787 -68.759 56 HB2 HIS 8 HB2 HIS 8 27.929 10.715 -67.652 57 HB3 HIS 8 HB3 HIS 8 27.477 10.114 -69.234 58 HD2 HIS 8 HD2 HIS 8 30.343 11.914 -67.434 59 HE1 HIS 8 HE1 HIS 8 31.709 11.119 -71.399 60 HE2 HIS 8 HE2 HIS 8 32.401 11.931 -69.083 61 H HIS 9 H HIS 9 25.287 12.965 -67.134 62 HA HIS 9 HA HIS 9 27.182 14.585 -65.518 63 HB2 HIS 9 HB2 HIS 9 24.563 15.676 -66.648 64 HB3 HIS 9 HB3 HIS 9 25.599 16.484 -65.476 65 HD2 HIS 9 HD2 HIS 9 28.054 17.363 -66.401 66 HE1 HIS 9 HE1 HIS 9 26.945 17.346 -70.522 67 HE2 HIS 9 HE2 HIS 9 28.674 18.159 -68.838 68 H HIS 10 H HIS 10 26.936 13.755 -63.491 69 HA HIS 10 HA HIS 10 24.262 13.411 -62.317 70 HB2 HIS 10 HB2 HIS 10 24.765 11.273 -63.609 71 HB3 HIS 10 HB3 HIS 10 26.133 11.013 -62.533 72 HD2 HIS 10 HD2 HIS 10 22.257 11.357 -62.432 73 HE1 HIS 10 HE1 HIS 10 23.387 9.059 -59.019 74 HE2 HIS 10 HE2 HIS 10 21.410 9.964 -60.356 75 H GLY 11 H GLY 11 24.241 13.184 -60.072 76 HA2 GLY 11 HA2 GLY 11 24.987 13.012 -57.914 77 HA3 GLY 11 HA3 GLY 11 26.637 12.814 -58.475 78 H SER 28 H SER 28 25.538 14.337 -56.237 79 HA SER 28 HA SER 28 27.176 16.727 -56.494 80 HB2 SER 28 HB2 SER 28 25.423 18.318 -55.811 81 HB3 SER 28 HB3 SER 28 25.084 17.617 -57.397 82 HG SER 28 HG SER 28 23.210 17.652 -56.064 83 H VAL 29 H VAL 29 27.535 17.787 -54.417 84 HA VAL 29 HA VAL 29 26.433 16.594 -51.990 85 HB VAL 29 HB VAL 29 28.259 15.042 -52.477 86 HG11 VAL 29 HG11 VAL 29 30.194 17.371 -52.169 87 HG12 VAL 29 HG12 VAL 29 30.600 15.658 -52.368 88 HG13 VAL 29 HG13 VAL 29 29.821 16.533 -53.692 89 HG21 VAL 29 HG21 VAL 29 27.643 15.540 -50.128 90 HG22 VAL 29 HG22 VAL 29 29.330 15.046 -50.323 91 HG23 VAL 29 HG23 VAL 29 28.945 16.755 -50.060 92 H SER 30 H SER 30 26.410 17.964 -50.278 93 HA SER 30 HA SER 30 28.211 20.240 -50.041 94 HB2 SER 30 HB2 SER 30 26.439 21.947 -49.903 95 HB3 SER 30 HB3 SER 30 26.554 21.245 -51.521 96 HG SER 30 HG SER 30 24.369 21.420 -50.819 97 H PHE 31 H PHE 31 28.135 21.239 -47.967 98 HA PHE 31 HA PHE 31 26.292 20.297 -45.911 99 HB2 PHE 31 HB2 PHE 31 28.043 19.447 -44.406 100 HB3 PHE 31 HB3 PHE 31 27.867 18.465 -45.841 101 HD1 PHE 31 HD2 PHE 31 30.097 20.789 -44.016 102 HD2 PHE 31 HD1 PHE 31 29.653 18.316 -47.523 103 HE1 PHE 31 HE2 PHE 31 32.537 20.957 -44.447 104 HE2 PHE 31 HE1 PHE 31 32.094 18.488 -47.952 105 HZ PHE 31 HZ PHE 31 33.539 19.811 -46.416 106 H GLY 32 H GLY 32 26.449 21.452 -43.927 107 HA2 GLY 32 HA2 GLY 32 26.888 23.244 -42.540 108 HA3 GLY 32 HA3 GLY 32 28.190 23.777 -43.593 109 H ALA 33 H ALA 33 26.072 25.306 -42.248 110 HA ALA 33 HA ALA 33 25.218 26.982 -44.516 111 HB1 ALA 33 HB1 ALA 33 23.203 25.730 -42.594 112 HB2 ALA 33 HB2 ALA 33 22.846 26.973 -43.816 113 HB3 ALA 33 HB3 ALA 33 23.377 25.363 -44.323 114 HA PRO 34 HA PRO 34 26.489 29.191 -40.559 115 HB2 PRO 34 HB2 PRO 34 28.561 30.695 -41.519 116 HB3 PRO 34 HB3 PRO 34 28.746 29.003 -40.967 117 HG2 PRO 34 HG2 PRO 34 28.390 29.999 -43.813 118 HG3 PRO 34 HG3 PRO 34 29.601 28.835 -43.189 119 HD2 PRO 34 HD2 PRO 34 27.293 28.013 -44.386 120 HD3 PRO 34 HD3 PRO 34 27.999 27.120 -43.006 121 H SER 35 H SER 35 25.395 30.955 -40.010 122 HA SER 35 HA SER 35 24.822 33.158 -41.942 123 HB2 SER 35 HB2 SER 35 22.721 31.652 -40.339 124 HB3 SER 35 HB3 SER 35 22.453 33.181 -41.197 125 HG SER 35 HG SER 35 21.822 31.347 -42.446 126 HA PRO 36 HA PRO 36 26.082 34.614 -37.668 127 HB2 PRO 36 HB2 PRO 36 28.096 36.320 -38.367 128 HB3 PRO 36 HB3 PRO 36 28.333 34.556 -38.192 129 HG2 PRO 36 HG2 PRO 36 27.809 36.108 -40.751 130 HG3 PRO 36 HG3 PRO 36 29.104 34.908 -40.432 131 HD2 PRO 36 HD2 PRO 36 26.792 34.205 -41.673 132 HD3 PRO 36 HD3 PRO 36 27.582 33.102 -40.507 133 H LEU 37 H LEU 37 25.665 36.658 -36.701 134 HA LEU 37 HA LEU 37 23.589 38.190 -38.046 135 HB2 LEU 37 HB2 LEU 37 24.843 38.222 -35.283 136 HB3 LEU 37 HB3 LEU 37 23.771 39.510 -35.804 137 HG LEU 37 HG LEU 37 21.951 37.909 -36.236 138 HD11 LEU 37 HD11 LEU 37 23.826 35.833 -35.020 139 HD12 LEU 37 HD12 LEU 37 22.078 35.620 -35.254 140 HD13 LEU 37 HD13 LEU 37 23.123 35.806 -36.658 141 HD21 LEU 37 HD21 LEU 37 22.170 39.069 -34.068 142 HD22 LEU 37 HD22 LEU 37 21.450 37.465 -33.870 143 HD23 LEU 37 HD23 LEU 37 23.156 37.729 -33.444 144 H SER 38 H SER 38 27.008 38.684 -37.681 145 HA SER 38 HA SER 38 26.877 41.103 -39.343 146 HB2 SER 38 HB2 SER 38 26.764 41.902 -36.946 147 HB3 SER 38 HB3 SER 38 28.350 41.152 -36.680 148 HG SER 38 HG SER 38 28.455 43.419 -37.240 149 H SER 39 H SER 39 29.027 41.723 -40.134 150 HA SER 39 HA SER 39 31.237 39.806 -39.879 151 HB2 SER 39 HB2 SER 39 29.763 38.757 -41.598 152 HB3 SER 39 HB3 SER 39 29.911 40.219 -42.591 153 HG SER 39 HG SER 39 31.439 38.568 -43.177 154 H GLU 40 H GLU 40 29.951 42.637 -41.700 155 HA GLU 40 HA GLU 40 32.487 43.637 -42.499 156 HB2 GLU 40 HB2 GLU 40 29.809 45.068 -42.212 157 HB3 GLU 40 HB3 GLU 40 31.230 45.691 -43.034 158 HG2 GLU 40 HG2 GLU 40 29.799 44.886 -44.720 159 HG3 GLU 40 HG3 GLU 40 31.160 43.776 -44.623 160 H SER 41 H SER 41 34.056 44.496 -41.288 161 HA SER 41 HA SER 41 33.445 46.545 -39.244 162 HB2 SER 41 HB2 SER 41 33.520 44.170 -38.225 163 HB3 SER 41 HB3 SER 41 35.263 44.228 -38.518 164 HG SER 41 HG SER 41 34.658 44.974 -36.400 165 H GLU 42 H GLU 42 34.526 46.808 -41.834 166 HA GLU 42 HA GLU 42 37.355 47.651 -41.323 167 HB2 GLU 42 HB2 GLU 42 38.070 46.590 -43.366 168 HB3 GLU 42 HB3 GLU 42 37.327 45.410 -42.295 169 HG2 GLU 42 HG2 GLU 42 35.229 45.497 -43.628 170 HG3 GLU 42 HG3 GLU 42 35.950 46.700 -44.696 171 H ASP 43 H ASP 43 34.464 48.954 -42.136 172 HA ASP 43 HA ASP 43 35.094 50.281 -44.604 173 HB2 ASP 43 HB2 ASP 43 32.805 49.723 -43.799 174 HB3 ASP 43 HB3 ASP 43 32.980 50.935 -42.527 175 H GLU 44 H GLU 44 35.717 51.099 -41.353 176 HA GLU 44 HA GLU 44 37.182 53.565 -42.152 177 HB2 GLU 44 HB2 GLU 44 36.238 54.885 -40.361 178 HB3 GLU 44 HB3 GLU 44 34.964 54.297 -41.417 179 HG2 GLU 44 HG2 GLU 44 34.403 52.515 -39.769 180 HG3 GLU 44 HG3 GLU 44 35.683 53.096 -38.706 181 H ILE 45 H ILE 45 37.874 50.725 -41.174 182 HA ILE 45 HA ILE 45 39.649 51.461 -38.881 183 HB ILE 45 HB ILE 45 38.021 48.903 -39.093 184 HG12 ILE 45 HG12 ILE 45 37.625 51.319 -37.270 185 HG13 ILE 45 HG13 ILE 45 36.546 50.800 -38.567 186 HG21 ILE 45 HG21 ILE 45 39.809 49.958 -36.847 187 HG22 ILE 45 HG22 ILE 45 38.904 48.428 -36.839 188 HG23 ILE 45 HG23 ILE 45 40.232 48.633 -37.957 189 HD11 ILE 45 HD11 ILE 45 37.033 49.335 -35.960 190 HD12 ILE 45 HD12 ILE 45 35.555 50.123 -36.522 191 HD13 ILE 45 HD13 ILE 45 36.130 48.658 -37.341 192 H ASN 46 H ASN 46 41.693 51.020 -39.252 193 HA ASN 46 HA ASN 46 42.543 48.504 -40.438 194 HB2 ASN 46 HB2 ASN 46 43.978 49.451 -42.163 195 HB3 ASN 46 HB3 ASN 46 42.323 49.947 -42.459 196 HD21 ASN 46 HD22 ASN 46 45.571 51.085 -41.517 197 HD22 ASN 46 HD21 ASN 46 45.159 52.780 -41.730 198 H TYR 47 H TYR 47 44.838 48.085 -40.098 199 HA TYR 47 HA TYR 47 45.997 49.429 -37.737 200 HB2 TYR 47 HB2 TYR 47 46.913 47.067 -39.419 201 HB3 TYR 47 HB3 TYR 47 47.806 47.715 -38.056 202 HD1 TYR 47 HD2 TYR 47 46.917 47.599 -35.735 203 HD2 TYR 47 HD1 TYR 47 44.953 45.646 -39.049 204 HE1 TYR 47 HE2 TYR 47 45.624 46.184 -34.142 205 HE2 TYR 47 HE1 TYR 47 43.670 44.232 -37.455 206 HH TYR 47 HH TYR 47 43.253 43.727 -35.245 207 H MET 48 H MET 48 48.148 50.275 -37.736 208 HA MET 48 HA MET 48 49.294 51.123 -40.383 209 HB2 MET 48 HB2 MET 48 49.134 52.770 -37.825 210 HB3 MET 48 HB3 MET 48 50.075 53.201 -39.260 211 HG2 MET 48 HG2 MET 48 47.998 53.205 -40.618 212 HG3 MET 48 HG3 MET 48 47.056 52.847 -39.163 213 HE1 MET 48 HE1 MET 48 45.481 54.904 -39.704 214 HE2 MET 48 HE2 MET 48 46.074 56.557 -39.978 215 HE3 MET 48 HE3 MET 48 46.450 55.278 -41.151 216 H THR 49 H THR 49 49.980 50.300 -36.971 217 HA THR 49 HA THR 49 52.673 49.279 -37.765 218 HB THR 49 HB THR 49 53.432 50.015 -35.465 219 HG1 THR 49 HG1 THR 49 52.258 51.682 -34.507 220 HG21 THR 49 HG21 THR 49 52.634 52.260 -37.362 221 HG22 THR 49 HG22 THR 49 53.927 52.292 -36.144 222 HG23 THR 49 HG23 THR 49 54.062 51.219 -37.546 223 HA PRO 50 HA PRO 50 50.000 46.082 -35.602 224 HB2 PRO 50 HB2 PRO 50 50.094 44.071 -37.458 225 HB3 PRO 50 HB3 PRO 50 48.926 45.423 -37.539 226 HG2 PRO 50 HG2 PRO 50 51.594 45.179 -38.971 227 HG3 PRO 50 HG3 PRO 50 50.000 45.606 -39.674 228 HD2 PRO 50 HD2 PRO 50 51.807 47.510 -38.965 229 HD3 PRO 50 HD3 PRO 50 50.054 47.762 -38.723 230 HA PRO 51 HA PRO 51 53.605 44.085 -34.004 231 HB2 PRO 51 HB2 PRO 51 52.618 41.889 -32.714 232 HB3 PRO 51 HB3 PRO 51 52.305 43.570 -32.185 233 HG2 PRO 51 HG2 PRO 51 50.507 41.785 -33.857 234 HG3 PRO 51 HG3 PRO 51 50.073 42.769 -32.425 235 HD2 PRO 51 HD2 PRO 51 49.662 43.654 -34.976 236 HD3 PRO 51 HD3 PRO 51 50.133 44.770 -33.659 237 H GLU 52 H GLU 52 55.043 43.359 -35.457 238 HA GLU 52 HA GLU 52 54.844 40.538 -36.403 239 HB2 GLU 52 HB2 GLU 52 55.458 41.146 -38.659 240 HB3 GLU 52 HB3 GLU 52 53.978 41.972 -38.196 241 HG2 GLU 52 HG2 GLU 52 55.209 44.076 -37.838 242 HG3 GLU 52 HG3 GLU 52 56.741 43.269 -38.163 243 H GLN 53 H GLN 53 56.630 42.339 -34.479 244 HA GLN 53 HA GLN 53 59.260 41.270 -35.369 245 HB2 GLN 53 HB2 GLN 53 58.748 43.635 -36.222 246 HB3 GLN 53 HB3 GLN 53 58.872 44.168 -34.546 247 HG2 GLN 53 HG2 GLN 53 61.232 43.251 -34.500 248 HG3 GLN 53 HG3 GLN 53 61.037 42.745 -36.180 249 HE21 GLN 53 HE22 GLN 53 61.076 45.658 -34.041 250 HE22 GLN 53 HE21 GLN 53 61.568 46.751 -35.327 251 H GLU 54 H GLU 54 57.953 39.988 -33.456 252 HA GLU 54 HA GLU 54 59.422 40.681 -30.936 253 HB2 GLU 54 HB2 GLU 54 56.603 39.562 -31.163 254 HB3 GLU 54 HB3 GLU 54 57.547 39.681 -29.672 255 HG2 GLU 54 HG2 GLU 54 57.688 42.161 -29.989 256 HG3 GLU 54 HG3 GLU 54 56.639 42.021 -31.403 257 H ALA 55 H ALA 55 60.809 39.173 -30.332 258 HA ALA 55 HA ALA 55 60.386 36.303 -30.989 259 HB1 ALA 55 HB1 ALA 55 62.852 37.928 -31.755 260 HB2 ALA 55 HB2 ALA 55 62.604 36.191 -32.041 261 HB3 ALA 55 HB3 ALA 55 61.591 37.375 -32.878 262 H GLN 56 H GLN 56 60.414 37.880 -28.405 263 HA GLN 56 HA GLN 56 62.234 36.173 -26.877 264 HB2 GLN 56 HB2 GLN 56 63.693 38.080 -27.605 265 HB3 GLN 56 HB3 GLN 56 62.619 39.198 -26.778 266 HG2 GLN 56 HG2 GLN 56 64.542 38.727 -25.369 267 HG3 GLN 56 HG3 GLN 56 63.122 38.027 -24.608 268 HE21 GLN 56 HE22 GLN 56 63.308 35.840 -23.970 269 HE22 GLN 56 HE21 GLN 56 64.548 34.768 -24.611 270 HA PRO 57 HA PRO 57 58.164 37.359 -25.067 271 HB2 PRO 57 HB2 PRO 57 56.980 34.967 -24.813 272 HB3 PRO 57 HB3 PRO 57 57.312 35.698 -26.423 273 HG2 PRO 57 HG2 PRO 57 59.012 33.631 -24.977 274 HG3 PRO 57 HG3 PRO 57 58.351 33.547 -26.642 275 HD2 PRO 57 HD2 PRO 57 60.875 34.484 -26.088 276 HD3 PRO 57 HD3 PRO 57 59.886 35.119 -27.439 277 H GLY 58 H GLY 58 59.835 38.070 -23.475 278 HA2 GLY 58 HA2 GLY 58 60.383 38.308 -21.195 279 HA3 GLY 58 HA3 GLY 58 59.660 36.743 -20.825 280 H ALA 59 H ALA 59 61.993 37.229 -19.667 281 HA ALA 59 HA ALA 59 63.757 35.183 -20.801 282 HB1 ALA 59 HB1 ALA 59 64.765 38.027 -20.312 283 HB2 ALA 59 HB2 ALA 59 65.774 36.619 -20.706 284 HB3 ALA 59 HB3 ALA 59 64.611 37.230 -21.893 285 H LEU 60 H LEU 60 64.780 34.028 -19.238 286 HA LEU 60 HA LEU 60 64.816 34.996 -16.405 287 HB2 LEU 60 HB2 LEU 60 64.055 32.235 -17.469 288 HB3 LEU 60 HB3 LEU 60 64.488 32.548 -15.809 289 HG LEU 60 HG LEU 60 62.184 32.330 -15.867 290 HD11 LEU 60 HD11 LEU 60 62.665 35.324 -15.678 291 HD12 LEU 60 HD12 LEU 60 61.357 34.393 -14.928 292 HD13 LEU 60 HD13 LEU 60 63.028 34.138 -14.400 293 HD21 LEU 60 HD21 LEU 60 61.806 32.832 -18.291 294 HD22 LEU 60 HD22 LEU 60 60.600 33.496 -17.178 295 HD23 LEU 60 HD23 LEU 60 61.819 34.563 -17.877 296 H ALA 61 H ALA 61 66.560 34.267 -15.132 297 HA ALA 61 HA ALA 61 68.645 32.644 -16.438 298 HB1 ALA 61 HB1 ALA 61 69.182 35.214 -14.904 299 HB2 ALA 61 HB2 ALA 61 70.414 34.087 -15.515 300 HB3 ALA 61 HB3 ALA 61 69.381 34.970 -16.653 301 H ALA 62 H ALA 62 69.214 30.944 -15.253 302 HA ALA 62 HA ALA 62 68.594 30.819 -12.357 303 HB1 ALA 62 HB1 ALA 62 69.672 28.710 -14.264 304 HB2 ALA 62 HB2 ALA 62 69.223 28.459 -12.565 305 HB3 ALA 62 HB3 ALA 62 67.980 28.899 -13.752 306 H LEU 63 H LEU 63 70.157 30.571 -10.768 307 HA LEU 63 HA LEU 63 72.930 31.407 -11.508 308 HB2 LEU 63 HB2 LEU 63 71.292 32.410 -9.156 309 HB3 LEU 63 HB3 LEU 63 72.907 32.937 -9.616 310 HG LEU 63 HG LEU 63 70.350 33.441 -11.206 311 HD11 LEU 63 HD11 LEU 63 72.127 35.316 -9.594 312 HD12 LEU 63 HD12 LEU 63 70.686 35.774 -10.529 313 HD13 LEU 63 HD13 LEU 63 70.519 34.733 -9.106 314 HD21 LEU 63 HD21 LEU 63 72.343 33.301 -12.696 315 HD22 LEU 63 HD22 LEU 63 71.709 34.937 -12.579 316 HD23 LEU 63 HD23 LEU 63 73.176 34.485 -11.673 317 H HIS 64 H HIS 64 74.578 30.993 -9.971 318 HA HIS 64 HA HIS 64 74.269 28.552 -8.320 319 HB2 HIS 64 HB2 HIS 64 76.550 30.439 -8.925 320 HB3 HIS 64 HB3 HIS 64 76.704 29.100 -7.798 321 HD2 HIS 64 HD2 HIS 64 77.017 29.959 -11.435 322 HE1 HIS 64 HE1 HIS 64 77.198 25.698 -11.247 323 HE2 HIS 64 HE2 HIS 64 77.642 27.744 -12.699 324 H ALA 65 H ALA 65 74.103 28.544 -6.078 325 HA ALA 65 HA ALA 65 73.372 31.118 -4.839 326 HB1 ALA 65 HB1 ALA 65 73.128 28.250 -3.851 327 HB2 ALA 65 HB2 ALA 65 72.388 29.688 -3.115 328 HB3 ALA 65 HB3 ALA 65 71.880 29.165 -4.732 329 H GLU 66 H GLU 66 76.103 28.934 -4.674 330 HA GLU 66 HA GLU 66 77.261 30.379 -2.329 331 HB2 GLU 66 HB2 GLU 66 76.955 27.358 -2.618 332 HB3 GLU 66 HB3 GLU 66 77.934 28.165 -1.391 333 HG2 GLU 66 HG2 GLU 66 75.881 29.323 -0.545 334 HG3 GLU 66 HG3 GLU 66 74.912 28.376 -1.679 335 H GLY 67 H GLY 67 79.565 29.807 -1.948 336 HA2 GLY 67 HA2 GLY 67 81.753 29.428 -2.600 337 HA3 GLY 67 HA3 GLY 67 81.149 28.577 -4.015 338 HA PRO 68 HA PRO 68 83.290 32.528 -5.268 339 HB2 PRO 68 HB2 PRO 68 84.748 31.544 -7.380 340 HB3 PRO 68 HB3 PRO 68 85.254 31.401 -5.670 341 HG2 PRO 68 HG2 PRO 68 83.790 29.338 -7.349 342 HG3 PRO 68 HG3 PRO 68 85.262 29.107 -6.351 343 HD2 PRO 68 HD2 PRO 68 82.816 28.471 -5.399 344 HD3 PRO 68 HD3 PRO 68 84.023 29.251 -4.331 345 H LEU 69 H LEU 69 81.179 30.346 -6.985 346 HA LEU 69 HA LEU 69 80.619 32.322 -9.122 347 HB2 LEU 69 HB2 LEU 69 79.596 29.500 -8.694 348 HB3 LEU 69 HB3 LEU 69 79.171 30.530 -10.054 349 HG LEU 69 HG LEU 69 81.981 29.532 -9.463 350 HD11 LEU 69 HD11 LEU 69 80.005 28.710 -11.621 351 HD12 LEU 69 HD12 LEU 69 81.636 28.052 -11.352 352 HD13 LEU 69 HD13 LEU 69 80.365 27.770 -10.156 353 HD21 LEU 69 HD21 LEU 69 82.107 31.640 -10.687 354 HD22 LEU 69 HD22 LEU 69 82.464 30.307 -11.787 355 HD23 LEU 69 HD23 LEU 69 80.869 31.081 -11.845 356 H ALA 70 H ALA 70 79.580 32.245 -5.979 357 HA ALA 70 HA ALA 70 76.806 32.106 -6.140 358 HB1 ALA 70 HB1 ALA 70 78.506 33.893 -4.344 359 HB2 ALA 70 HB2 ALA 70 76.807 33.451 -4.063 360 HB3 ALA 70 HB3 ALA 70 78.064 32.201 -4.028 361 H GLY 71 H GLY 71 75.302 33.190 -7.071 362 HA2 GLY 71 HA2 GLY 71 74.025 34.957 -7.913 363 HA3 GLY 71 HA3 GLY 71 75.344 36.087 -7.611 364 H LEU 72 H LEU 72 76.627 33.466 -9.327 365 HA LEU 72 HA LEU 72 76.493 34.935 -11.911 366 HB2 LEU 72 HB2 LEU 72 78.499 32.826 -11.051 367 HB3 LEU 72 HB3 LEU 72 78.607 33.881 -12.424 368 HG LEU 72 HG LEU 72 78.964 34.653 -9.527 369 HD11 LEU 72 HD11 LEU 72 80.750 35.015 -11.969 370 HD12 LEU 72 HD12 LEU 72 81.170 35.312 -10.269 371 HD13 LEU 72 HD13 LEU 72 80.872 33.662 -10.834 372 HD21 LEU 72 HD21 LEU 72 77.697 36.513 -10.525 373 HD22 LEU 72 HD22 LEU 72 79.382 36.969 -10.295 374 HD23 LEU 72 HD23 LEU 72 78.798 36.543 -11.914 375 HA PRO 73 HA PRO 73 73.957 32.170 -13.849 376 HB2 PRO 73 HB2 PRO 73 74.855 31.864 -16.422 377 HB3 PRO 73 HB3 PRO 73 74.317 33.433 -15.753 378 HG2 PRO 73 HG2 PRO 73 77.120 32.338 -16.093 379 HG3 PRO 73 HG3 PRO 73 76.538 33.992 -16.441 380 HD2 PRO 73 HD2 PRO 73 77.846 33.236 -14.176 381 HD3 PRO 73 HD3 PRO 73 76.706 34.620 -14.213 382 H VAL 74 H VAL 74 73.320 30.057 -14.535 383 HA VAL 74 HA VAL 74 75.381 27.971 -14.132 384 HB VAL 74 HB VAL 74 72.389 27.667 -14.454 385 HG11 VAL 74 HG11 VAL 74 74.533 25.678 -13.601 386 HG12 VAL 74 HG12 VAL 74 72.779 25.414 -13.501 387 HG13 VAL 74 HG13 VAL 74 73.543 25.595 -15.078 388 HG21 VAL 74 HG21 VAL 74 72.979 28.871 -12.377 389 HG22 VAL 74 HG22 VAL 74 72.428 27.237 -12.019 390 HG23 VAL 74 HG23 VAL 74 74.164 27.615 -11.972 391 H THR 75 H THR 75 73.242 29.064 -16.822 392 HA THR 75 HA THR 75 74.857 27.364 -18.690 393 HB THR 75 HB THR 75 72.963 27.057 -20.048 394 HG1 THR 75 HG1 THR 75 70.922 28.050 -19.278 395 HG21 THR 75 HG21 THR 75 71.946 26.768 -17.208 396 HG22 THR 75 HG22 THR 75 71.486 25.824 -18.644 397 HG23 THR 75 HG23 THR 75 73.128 25.682 -17.975 398 H ARG 76 H ARG 76 74.677 27.999 -21.029 399 HA ARG 76 HA ARG 76 75.875 30.541 -21.585 400 HB2 ARG 76 HB2 ARG 76 76.017 28.425 -22.935 401 HB3 ARG 76 HB3 ARG 76 74.324 28.613 -23.386 402 HG2 ARG 76 HG2 ARG 76 74.955 30.789 -24.547 403 HG3 ARG 76 HG3 ARG 76 76.655 30.417 -24.173 404 HD2 ARG 76 HD2 ARG 76 76.374 28.213 -25.357 405 HD3 ARG 76 HD3 ARG 76 74.714 28.676 -25.759 406 HE ARG 76 HE ARG 76 76.994 30.410 -26.636 407 HH11 ARG 76 HH11 ARG 76 74.486 28.165 -27.681 408 HH12 ARG 76 HH12 ARG 76 74.783 28.499 -29.362 409 HH21 ARG 76 HH21 ARG 76 77.374 30.701 -28.751 410 HH22 ARG 76 HH22 ARG 76 76.385 29.903 -29.955 411 H SER 77 H SER 77 72.506 29.444 -21.821 412 HA SER 77 HA SER 77 71.364 31.926 -22.723 413 HB2 SER 77 HB2 SER 77 70.216 29.715 -22.785 414 HB3 SER 77 HB3 SER 77 70.077 29.761 -21.015 415 HG SER 77 HG SER 77 68.190 30.580 -22.123 416 H ASP 78 H ASP 78 71.827 30.579 -19.360 417 HA ASP 78 HA ASP 78 70.725 32.834 -18.020 418 HB2 ASP 78 HB2 ASP 78 72.978 31.027 -17.108 419 HB3 ASP 78 HB3 ASP 78 72.040 32.102 -16.076 420 H ALA 79 H ALA 79 74.152 32.260 -19.044 421 HA ALA 79 HA ALA 79 75.164 34.709 -18.003 422 HB1 ALA 79 HB1 ALA 79 76.160 32.970 -20.314 423 HB2 ALA 79 HB2 ALA 79 77.102 34.203 -19.452 424 HB3 ALA 79 HB3 ALA 79 76.568 32.745 -18.596 425 H ARG 80 H ARG 80 73.875 34.012 -21.314 426 HA ARG 80 HA ARG 80 74.301 36.736 -22.248 427 HB2 ARG 80 HB2 ARG 80 72.591 34.412 -23.215 428 HB3 ARG 80 HB3 ARG 80 72.513 36.007 -23.981 429 HG2 ARG 80 HG2 ARG 80 74.916 35.986 -24.427 430 HG3 ARG 80 HG3 ARG 80 75.091 34.404 -23.644 431 HD2 ARG 80 HD2 ARG 80 73.794 33.312 -25.329 432 HD3 ARG 80 HD3 ARG 80 73.228 34.857 -26.004 433 HE ARG 80 HE ARG 80 75.984 35.015 -26.264 434 HH11 ARG 80 HH11 ARG 80 73.605 32.746 -27.526 435 HH12 ARG 80 HH12 ARG 80 74.511 32.511 -28.992 436 HH21 ARG 80 HH21 ARG 80 76.997 34.738 -28.104 437 HH22 ARG 80 HH22 ARG 80 76.463 33.564 -29.292 438 H VAL 81 H VAL 81 71.466 35.235 -20.654 439 HA VAL 81 HA VAL 81 69.825 37.614 -20.810 440 HB VAL 81 HB VAL 81 69.768 35.278 -18.866 441 HG11 VAL 81 HG11 VAL 81 67.769 37.564 -19.254 442 HG12 VAL 81 HG12 VAL 81 67.416 36.063 -18.375 443 HG13 VAL 81 HG13 VAL 81 68.644 37.167 -17.759 444 HG21 VAL 81 HG21 VAL 81 69.281 34.767 -21.240 445 HG22 VAL 81 HG22 VAL 81 67.862 34.568 -20.208 446 HG23 VAL 81 HG23 VAL 81 68.024 36.007 -21.256 447 H LEU 82 H LEU 82 72.059 36.452 -18.233 448 HA LEU 82 HA LEU 82 71.770 38.722 -16.524 449 HB2 LEU 82 HB2 LEU 82 74.106 36.868 -17.099 450 HB3 LEU 82 HB3 LEU 82 74.300 38.250 -16.033 451 HG LEU 82 HG LEU 82 72.376 35.943 -15.549 452 HD11 LEU 82 HD11 LEU 82 74.898 36.844 -14.086 453 HD12 LEU 82 HD12 LEU 82 73.959 35.360 -13.808 454 HD13 LEU 82 HD13 LEU 82 74.865 35.576 -15.319 455 HD21 LEU 82 HD21 LEU 82 71.389 37.922 -14.537 456 HD22 LEU 82 HD22 LEU 82 72.212 37.038 -13.252 457 HD23 LEU 82 HD23 LEU 82 72.978 38.472 -13.947 458 H ILE 83 H ILE 83 74.105 38.331 -19.254 459 HA ILE 83 HA ILE 83 75.229 40.933 -19.123 460 HB ILE 83 HB ILE 83 74.761 39.045 -21.446 461 HG12 ILE 83 HG12 ILE 83 77.351 39.966 -20.119 462 HG13 ILE 83 HG13 ILE 83 76.441 38.573 -19.549 463 HG21 ILE 83 HG21 ILE 83 76.210 41.735 -21.553 464 HG22 ILE 83 HG22 ILE 83 76.271 40.492 -22.816 465 HG23 ILE 83 HG23 ILE 83 74.755 41.293 -22.467 466 HD11 ILE 83 HD11 ILE 83 77.723 38.845 -22.293 467 HD12 ILE 83 HD12 ILE 83 78.212 37.784 -20.962 468 HD13 ILE 83 HD13 ILE 83 76.669 37.500 -21.787 469 H PHE 84 H PHE 84 72.322 39.893 -21.021 470 HA PHE 84 HA PHE 84 71.804 42.498 -21.989 471 HB2 PHE 84 HB2 PHE 84 70.891 40.272 -22.852 472 HB3 PHE 84 HB3 PHE 84 69.738 40.312 -21.535 473 HD1 PHE 84 HD1 PHE 84 71.033 42.899 -23.995 474 HD2 PHE 84 HD2 PHE 84 67.585 40.892 -22.341 475 HE1 PHE 84 HE1 PHE 84 69.601 44.139 -25.532 476 HE2 PHE 84 HE2 PHE 84 66.117 42.226 -23.837 477 HZ PHE 84 HZ PHE 84 67.110 43.842 -25.448 478 H ASN 85 H ASN 85 70.321 40.869 -19.134 479 HA ASN 85 HA ASN 85 68.542 43.050 -18.565 480 HB2 ASN 85 HB2 ASN 85 68.142 40.712 -17.879 481 HB3 ASN 85 HB3 ASN 85 69.542 40.761 -16.808 482 HD21 ASN 85 HD22 ASN 85 69.266 41.672 -14.711 483 HD22 ASN 85 HD21 ASN 85 67.742 42.378 -14.208 484 H GLU 86 H GLU 86 71.780 42.185 -17.167 485 HA GLU 86 HA GLU 86 71.737 44.440 -15.345 486 HB2 GLU 86 HB2 GLU 86 73.169 42.522 -14.894 487 HB3 GLU 86 HB3 GLU 86 74.117 42.845 -16.369 488 HG2 GLU 86 HG2 GLU 86 74.909 44.942 -15.516 489 HG3 GLU 86 HG3 GLU 86 73.720 44.946 -14.212 490 H TRP 87 H TRP 87 73.155 44.028 -18.719 491 HA TRP 87 HA TRP 87 74.127 46.706 -18.821 492 HB2 TRP 87 HB2 TRP 87 74.783 45.133 -20.501 493 HB3 TRP 87 HB3 TRP 87 73.108 44.828 -20.949 494 HD1 TRP 87 HD1 TRP 87 75.732 47.652 -21.270 495 HE1 TRP 87 HE1 TRP 87 75.198 48.952 -23.414 496 HE3 TRP 87 HE3 TRP 87 71.340 45.362 -22.537 497 HZ2 TRP 87 HZ2 TRP 87 73.190 48.945 -25.457 498 HZ3 TRP 87 HZ3 TRP 87 70.234 45.932 -24.642 499 HH2 TRP 87 HH2 TRP 87 71.103 47.740 -26.120 500 H GLU 88 H GLU 88 70.816 45.441 -19.721 501 HA GLU 88 HA GLU 88 69.757 47.909 -20.544 502 HB2 GLU 88 HB2 GLU 88 68.569 45.425 -19.302 503 HB3 GLU 88 HB3 GLU 88 67.562 46.839 -19.525 504 HG2 GLU 88 HG2 GLU 88 69.149 45.740 -21.856 505 HG3 GLU 88 HG3 GLU 88 67.610 45.038 -21.379 506 H GLU 89 H GLU 89 69.814 46.646 -17.129 507 HA GLU 89 HA GLU 89 68.549 49.033 -16.071 508 HB2 GLU 89 HB2 GLU 89 70.278 46.891 -14.771 509 HB3 GLU 89 HB3 GLU 89 69.499 48.193 -13.875 510 HG2 GLU 89 HG2 GLU 89 68.004 46.148 -15.571 511 HG3 GLU 89 HG3 GLU 89 68.249 46.032 -13.834 512 H ARG 90 H ARG 90 72.003 48.045 -16.127 513 HA ARG 90 HA ARG 90 73.080 50.395 -14.870 514 HB2 ARG 90 HB2 ARG 90 74.296 48.590 -17.004 515 HB3 ARG 90 HB3 ARG 90 75.205 49.761 -16.044 516 HG2 ARG 90 HG2 ARG 90 73.662 47.482 -14.790 517 HG3 ARG 90 HG3 ARG 90 75.307 47.302 -15.408 518 HD2 ARG 90 HD2 ARG 90 76.036 49.117 -13.835 519 HD3 ARG 90 HD3 ARG 90 74.388 49.140 -13.165 520 HE ARG 90 HE ARG 90 75.422 46.447 -13.150 521 HH11 ARG 90 HH11 ARG 90 75.888 49.412 -11.323 522 HH12 ARG 90 HH12 ARG 90 76.439 48.534 -9.922 523 HH21 ARG 90 HH21 ARG 90 76.108 45.442 -11.467 524 HH22 ARG 90 HH22 ARG 90 76.564 46.283 -9.985 525 H LYS 91 H LYS 91 72.559 49.644 -18.282 526 HA LYS 91 HA LYS 91 73.420 52.211 -19.261 527 HB2 LYS 91 HB2 LYS 91 73.406 50.062 -20.565 528 HB3 LYS 91 HB3 LYS 91 71.657 50.153 -20.678 529 HG2 LYS 91 HG2 LYS 91 73.260 52.486 -21.717 530 HG3 LYS 91 HG3 LYS 91 73.333 50.965 -22.598 531 HD2 LYS 91 HD2 LYS 91 70.853 50.912 -22.767 532 HD3 LYS 91 HD3 LYS 91 70.777 52.508 -21.991 533 HE2 LYS 91 HE2 LYS 91 72.170 53.457 -23.824 534 HE3 LYS 91 HE3 LYS 91 72.284 51.862 -24.572 535 HZ1 LYS 91 HZ1 LYS 91 69.742 53.382 -24.198 536 HZ2 LYS 91 HZ2 LYS 91 70.536 53.199 -25.612 537 HZ3 LYS 91 HZ3 LYS 91 69.857 51.903 -24.892 538 H LYS 92 H LYS 92 70.137 51.098 -18.279 539 HA LYS 92 HA LYS 92 68.802 53.513 -19.075 540 HB2 LYS 92 HB2 LYS 92 67.676 51.433 -18.304 541 HB3 LYS 92 HB3 LYS 92 68.243 51.742 -16.654 542 HG2 LYS 92 HG2 LYS 92 66.974 53.849 -16.603 543 HG3 LYS 92 HG3 LYS 92 66.467 53.595 -18.288 544 HD2 LYS 92 HD2 LYS 92 65.347 51.471 -17.601 545 HD3 LYS 92 HD3 LYS 92 65.774 51.784 -15.918 546 HE2 LYS 92 HE2 LYS 92 64.055 53.610 -17.672 547 HE3 LYS 92 HE3 LYS 92 63.411 52.388 -16.577 548 HZ1 LYS 92 HZ1 LYS 92 65.008 54.755 -15.726 549 HZ2 LYS 92 HZ2 LYS 92 63.408 54.545 -15.506 550 HZ3 LYS 92 HZ3 LYS 92 64.460 53.586 -14.714 551 H SER 93 H SER 93 70.796 52.761 -16.170 552 HA SER 93 HA SER 93 70.696 55.567 -15.287 553 HB2 SER 93 HB2 SER 93 72.554 53.318 -14.458 554 HB3 SER 93 HB3 SER 93 72.465 54.922 -13.713 555 HG SER 93 HG SER 93 71.161 53.375 -12.598 556 H GLU 94 H GLU 94 72.759 53.841 -17.520 557 HA GLU 94 HA GLU 94 74.623 56.159 -17.856 558 HB2 GLU 94 HB2 GLU 94 75.321 53.191 -17.758 559 HB3 GLU 94 HB3 GLU 94 76.428 54.527 -18.028 560 HG2 GLU 94 HG2 GLU 94 75.824 55.402 -15.740 561 HG3 GLU 94 HG3 GLU 94 74.870 53.931 -15.500 562 HA PRO 95 HA PRO 95 72.549 54.737 -21.767 563 HB2 PRO 95 HB2 PRO 95 72.466 57.188 -23.114 564 HB3 PRO 95 HB3 PRO 95 71.245 56.565 -21.968 565 HG2 PRO 95 HG2 PRO 95 73.568 58.425 -21.391 566 HG3 PRO 95 HG3 PRO 95 71.852 58.603 -20.894 567 HD2 PRO 95 HD2 PRO 95 73.649 57.614 -19.167 568 HD3 PRO 95 HD3 PRO 95 72.047 56.834 -19.303 569 H TRP 96 H TRP 96 75.711 55.791 -21.356 570 HA TRP 96 HA TRP 96 76.608 55.503 -24.153 571 HB2 TRP 96 HB2 TRP 96 78.819 56.039 -23.112 572 HB3 TRP 96 HB3 TRP 96 77.585 57.260 -22.877 573 HD1 TRP 96 HD1 TRP 96 79.568 54.625 -20.931 574 HE1 TRP 96 HE1 TRP 96 79.425 55.116 -18.412 575 HE3 TRP 96 HE3 TRP 96 76.136 58.431 -21.036 576 HZ2 TRP 96 HZ2 TRP 96 77.988 56.908 -16.667 577 HZ3 TRP 96 HZ3 TRP 96 75.386 59.500 -18.922 578 HH2 TRP 96 HH2 TRP 96 76.296 58.747 -16.737 579 H LEU 97 H LEU 97 75.970 53.257 -21.603 580 HA LEU 97 HA LEU 97 78.306 51.776 -21.574 581 HB2 LEU 97 HB2 LEU 97 76.272 51.798 -19.977 582 HB3 LEU 97 HB3 LEU 97 75.508 50.702 -21.104 583 HG LEU 97 HG LEU 97 77.356 49.103 -20.747 584 HD11 LEU 97 HD11 LEU 97 78.271 51.075 -18.609 585 HD12 LEU 97 HD12 LEU 97 78.836 49.398 -18.744 586 HD13 LEU 97 HD13 LEU 97 79.210 50.548 -20.024 587 HD21 LEU 97 HD21 LEU 97 75.256 49.015 -19.396 588 HD22 LEU 97 HD22 LEU 97 76.649 48.432 -18.469 589 HD23 LEU 97 HD23 LEU 97 76.018 50.073 -18.194 590 H ARG 98 H ARG 98 79.150 50.052 -22.621 591 HA ARG 98 HA ARG 98 78.065 49.286 -25.245 592 HB2 ARG 98 HB2 ARG 98 80.603 48.456 -23.788 593 HB3 ARG 98 HB3 ARG 98 80.190 48.033 -25.455 594 HG2 ARG 98 HG2 ARG 98 80.150 50.452 -26.062 595 HG3 ARG 98 HG3 ARG 98 80.638 50.868 -24.410 596 HD2 ARG 98 HD2 ARG 98 82.721 49.491 -24.719 597 HD3 ARG 98 HD3 ARG 98 82.223 49.165 -26.376 598 HE ARG 98 HE ARG 98 82.713 51.358 -27.017 599 HH11 ARG 98 HH11 ARG 98 83.253 51.114 -23.553 600 HH12 ARG 98 HH12 ARG 98 84.109 52.628 -23.495 601 HH21 ARG 98 HH21 ARG 98 83.815 53.269 -26.863 602 HH22 ARG 98 HH22 ARG 98 84.418 53.812 -25.326 603 H LEU 99 H LEU 99 77.855 47.140 -25.980 604 HA LEU 99 HA LEU 99 77.038 45.070 -23.999 605 HB2 LEU 99 HB2 LEU 99 75.180 46.509 -24.644 606 HB3 LEU 99 HB3 LEU 99 75.436 46.219 -26.332 607 HG LEU 99 HG LEU 99 73.462 45.091 -25.304 608 HD11 LEU 99 HD11 LEU 99 75.309 42.931 -26.316 609 HD12 LEU 99 HD12 LEU 99 73.591 43.234 -26.676 610 HD13 LEU 99 HD13 LEU 99 74.813 44.270 -27.369 611 HD21 LEU 99 HD21 LEU 99 74.686 44.566 -23.128 612 HD22 LEU 99 HD22 LEU 99 73.462 43.482 -23.750 613 HD23 LEU 99 HD23 LEU 99 75.210 43.086 -23.952 614 H ASP 100 H ASP 100 77.890 43.095 -24.575 615 HA ASP 100 HA ASP 100 78.123 42.343 -27.415 616 HB2 ASP 100 HB2 ASP 100 80.337 43.384 -26.672 617 HB3 ASP 100 HB3 ASP 100 80.523 42.018 -25.576 618 H MET 101 H MET 101 77.722 40.199 -27.753 619 HA MET 101 HA MET 101 77.312 38.424 -25.373 620 HB2 MET 101 HB2 MET 101 75.479 38.808 -27.771 621 HB3 MET 101 HB3 MET 101 75.257 37.590 -26.508 622 HG2 MET 101 HG2 MET 101 75.028 39.329 -24.801 623 HG3 MET 101 HG3 MET 101 75.296 40.589 -26.013 624 HE1 MET 101 HE1 MET 101 73.026 41.878 -25.246 625 HE2 MET 101 HE2 MET 101 71.513 40.971 -25.075 626 HE3 MET 101 HE3 MET 101 72.892 40.596 -24.018 627 H SER 102 H SER 102 79.458 38.639 -27.692 628 HA SER 102 HA SER 102 79.340 36.088 -29.070 629 HB2 SER 102 HB2 SER 102 80.768 37.970 -29.802 630 HB3 SER 102 HB3 SER 102 81.739 37.806 -28.322 631 HG SER 102 HG SER 102 82.585 36.674 -30.224 632 H ASP 103 H ASP 103 80.325 34.089 -28.480 633 HA ASP 103 HA ASP 103 80.000 33.430 -25.743 634 HB2 ASP 103 HB2 ASP 103 81.347 31.919 -28.004 635 HB3 ASP 103 HB3 ASP 103 81.046 31.239 -26.400 636 H LYS 104 H LYS 104 82.912 34.533 -27.368 637 HA LYS 104 HA LYS 104 84.867 33.875 -25.387 638 HB2 LYS 104 HB2 LYS 104 84.623 36.295 -27.231 639 HB3 LYS 104 HB3 LYS 104 86.048 35.913 -26.255 640 HG2 LYS 104 HG2 LYS 104 86.267 33.722 -27.412 641 HG3 LYS 104 HG3 LYS 104 84.880 34.131 -28.440 642 HD2 LYS 104 HD2 LYS 104 86.100 36.112 -29.308 643 HD3 LYS 104 HD3 LYS 104 87.492 35.701 -28.281 644 HE2 LYS 104 HE2 LYS 104 87.690 33.505 -29.441 645 HE3 LYS 104 HE3 LYS 104 86.313 33.921 -30.468 646 HZ1 LYS 104 HZ1 LYS 104 88.898 35.406 -30.400 647 HZ2 LYS 104 HZ2 LYS 104 88.425 34.390 -31.584 648 HZ3 LYS 104 HZ3 LYS 104 87.624 35.792 -31.351 649 H ALA 105 H ALA 105 82.458 36.514 -25.417 650 HA ALA 105 HA ALA 105 83.423 37.826 -23.021 651 HB1 ALA 105 HB1 ALA 105 80.645 37.849 -24.254 652 HB2 ALA 105 HB2 ALA 105 81.299 38.993 -23.072 653 HB3 ALA 105 HB3 ALA 105 81.981 38.929 -24.708 654 H ILE 106 H ILE 106 81.155 35.175 -23.619 655 HA ILE 106 HA ILE 106 80.234 35.011 -20.872 656 HB ILE 106 HB ILE 106 79.968 33.199 -23.295 657 HG12 ILE 106 HG12 ILE 106 77.570 33.719 -23.016 658 HG13 ILE 106 HG13 ILE 106 77.935 34.744 -21.628 659 HG21 ILE 106 HG21 ILE 106 78.929 32.648 -20.481 660 HG22 ILE 106 HG22 ILE 106 78.389 31.808 -21.952 661 HG23 ILE 106 HG23 ILE 106 80.058 31.647 -21.423 662 HD11 ILE 106 HD11 ILE 106 78.886 35.272 -24.469 663 HD12 ILE 106 HD12 ILE 106 77.457 36.007 -23.720 664 HD13 ILE 106 HD13 ILE 106 79.065 36.375 -23.083 665 H PHE 107 H PHE 107 82.640 33.110 -22.764 666 HA PHE 107 HA PHE 107 83.590 31.498 -20.624 667 HB2 PHE 107 HB2 PHE 107 85.314 32.739 -22.795 668 HB3 PHE 107 HB3 PHE 107 85.637 31.268 -21.902 669 HD1 PHE 107 HD2 PHE 107 82.624 30.172 -22.304 670 HD2 PHE 107 HD1 PHE 107 85.691 31.760 -24.885 671 HE1 PHE 107 HE2 PHE 107 81.704 28.862 -24.198 672 HE2 PHE 107 HE1 PHE 107 84.773 30.431 -26.787 673 HZ PHE 107 HZ PHE 107 82.781 28.980 -26.436 674 H ARG 108 H ARG 108 84.772 34.754 -21.655 675 HA ARG 108 HA ARG 108 86.812 34.858 -19.673 676 HB2 ARG 108 HB2 ARG 108 86.753 35.867 -21.944 677 HB3 ARG 108 HB3 ARG 108 85.605 37.089 -21.383 678 HG2 ARG 108 HG2 ARG 108 88.250 36.650 -19.971 679 HG3 ARG 108 HG3 ARG 108 88.206 37.536 -21.494 680 HD2 ARG 108 HD2 ARG 108 86.860 39.283 -20.620 681 HD3 ARG 108 HD3 ARG 108 86.454 38.408 -19.157 682 HE ARG 108 HE ARG 108 88.920 39.880 -19.727 683 HH11 ARG 108 HH11 ARG 108 87.527 37.479 -17.531 684 HH12 ARG 108 HH12 ARG 108 88.730 37.809 -16.312 685 HH21 ARG 108 HH21 ARG 108 90.394 40.210 -18.119 686 HH22 ARG 108 HH22 ARG 108 90.304 39.306 -16.637 687 H ARG 109 H ARG 109 83.469 36.041 -19.576 688 HA ARG 109 HA ARG 109 83.805 37.314 -16.924 689 HB2 ARG 109 HB2 ARG 109 81.372 36.517 -18.580 690 HB3 ARG 109 HB3 ARG 109 81.267 37.271 -16.986 691 HG2 ARG 109 HG2 ARG 109 82.429 39.266 -17.760 692 HG3 ARG 109 HG3 ARG 109 82.707 38.550 -19.352 693 HD2 ARG 109 HD2 ARG 109 80.284 38.412 -19.753 694 HD3 ARG 109 HD3 ARG 109 79.947 39.090 -18.162 695 HE ARG 109 HE ARG 109 80.905 40.496 -20.570 696 HH11 ARG 109 HH11 ARG 109 80.476 40.852 -17.102 697 HH12 ARG 109 HH12 ARG 109 80.573 42.587 -17.181 698 HH21 ARG 109 HH21 ARG 109 81.020 42.709 -20.592 699 HH22 ARG 109 HH22 ARG 109 80.869 43.607 -19.113 700 H TYR 110 H TYR 110 82.683 34.179 -18.143 701 HA TYR 110 HA TYR 110 82.390 33.140 -15.359 702 HB2 TYR 110 HB2 TYR 110 80.640 32.466 -17.733 703 HB3 TYR 110 HB3 TYR 110 80.405 32.060 -16.046 704 HD1 TYR 110 HD2 TYR 110 80.329 34.203 -14.394 705 HD2 TYR 110 HD1 TYR 110 79.426 34.236 -18.610 706 HE1 TYR 110 HE2 TYR 110 79.026 36.323 -14.120 707 HE2 TYR 110 HE1 TYR 110 78.092 36.323 -18.322 708 HH TYR 110 HH TYR 110 77.354 37.937 -16.837 709 HA PRO 111 HA PRO 111 85.472 30.667 -17.736 710 HB2 PRO 111 HB2 PRO 111 87.120 29.911 -15.664 711 HB3 PRO 111 HB3 PRO 111 87.172 31.515 -16.456 712 HG2 PRO 111 HG2 PRO 111 85.713 30.751 -13.904 713 HG3 PRO 111 HG3 PRO 111 86.821 32.138 -14.173 714 HD2 PRO 111 HD2 PRO 111 84.145 32.449 -14.315 715 HD3 PRO 111 HD3 PRO 111 85.211 33.284 -15.490 716 H HIS 112 H HIS 112 83.321 29.641 -15.197 717 HA HIS 112 HA HIS 112 83.855 26.783 -15.399 718 HB2 HIS 112 HB2 HIS 112 82.032 26.553 -13.937 719 HB3 HIS 112 HB3 HIS 112 82.807 28.051 -13.433 720 HD2 HIS 112 HD2 HIS 112 79.507 26.644 -14.208 721 HE1 HIS 112 HE1 HIS 112 78.929 30.734 -15.216 722 HE2 HIS 112 HE2 HIS 112 77.773 28.578 -14.774 723 H LEU 113 H LEU 113 81.979 29.086 -17.281 724 HA LEU 113 HA LEU 113 80.052 27.226 -18.266 725 HB2 LEU 113 HB2 LEU 113 80.228 29.928 -17.863 726 HB3 LEU 113 HB3 LEU 113 80.603 29.879 -19.569 727 HG LEU 113 HG LEU 113 78.292 30.373 -19.208 728 HD11 LEU 113 HD11 LEU 113 78.350 27.470 -20.100 729 HD12 LEU 113 HD12 LEU 113 77.237 28.744 -20.611 730 HD13 LEU 113 HD13 LEU 113 78.925 28.821 -21.110 731 HD21 LEU 113 HD21 LEU 113 77.861 29.540 -17.052 732 HD22 LEU 113 HD22 LEU 113 76.723 28.794 -18.147 733 HD23 LEU 113 HD23 LEU 113 78.090 27.842 -17.554 734 H ARG 114 H ARG 114 83.235 28.146 -19.390 735 HA ARG 114 HA ARG 114 82.939 27.438 -22.175 736 HB2 ARG 114 HB2 ARG 114 84.741 28.925 -21.235 737 HB3 ARG 114 HB3 ARG 114 85.491 27.488 -20.524 738 HG2 ARG 114 HG2 ARG 114 85.730 26.493 -22.799 739 HG3 ARG 114 HG3 ARG 114 84.928 27.901 -23.501 740 HD2 ARG 114 HD2 ARG 114 87.292 28.164 -23.834 741 HD3 ARG 114 HD3 ARG 114 86.772 29.351 -22.649 742 HE ARG 114 HE ARG 114 88.032 28.305 -21.001 743 HH11 ARG 114 HH11 ARG 114 88.043 26.182 -23.799 744 HH12 ARG 114 HH12 ARG 114 89.270 25.152 -23.118 745 HH21 ARG 114 HH21 ARG 114 89.582 26.943 -20.201 746 HH22 ARG 114 HH22 ARG 114 90.118 25.579 -21.138 Start of MODEL 16 1 H1 MET 1 H1 MET 1 -6.892 39.953 10.207 2 H2 MET 1 H2 MET 1 -6.471 38.582 9.431 3 H3 MET 1 H3 MET 1 -7.713 39.483 8.869 4 HA MET 1 HA MET 1 -4.872 40.316 8.932 5 HB2 MET 1 HB2 MET 1 -5.345 38.549 7.255 6 HB3 MET 1 HB3 MET 1 -6.580 39.565 6.513 7 HG2 MET 1 HG2 MET 1 -4.844 41.251 5.954 8 HG3 MET 1 HG3 MET 1 -3.618 40.252 6.749 9 HE1 MET 1 HE1 MET 1 -2.116 40.431 4.564 10 HE2 MET 1 HE2 MET 1 -2.690 40.006 2.936 11 HE3 MET 1 HE3 MET 1 -3.374 41.415 3.777 12 H ARG 2 H ARG 2 -5.121 42.357 9.803 13 HA ARG 2 HA ARG 2 -6.424 44.425 8.107 14 HB2 ARG 2 HB2 ARG 2 -6.933 44.028 11.096 15 HB3 ARG 2 HB3 ARG 2 -7.204 45.561 10.266 16 HG2 ARG 2 HG2 ARG 2 -8.783 44.414 8.693 17 HG3 ARG 2 HG3 ARG 2 -8.633 42.941 9.672 18 HD2 ARG 2 HD2 ARG 2 -9.487 44.162 11.654 19 HD3 ARG 2 HD3 ARG 2 -9.561 45.649 10.714 20 HE ARG 2 HE ARG 2 -11.428 44.896 9.528 21 HH11 ARG 2 HH11 ARG 2 -10.453 42.348 11.744 22 HH12 ARG 2 HH12 ARG 2 -11.949 41.481 11.533 23 HH21 ARG 2 HH21 ARG 2 -13.298 43.743 9.319 24 HH22 ARG 2 HH22 ARG 2 -13.518 42.258 10.195 25 H GLY 3 H GLY 3 -5.720 46.600 8.670 26 HA2 GLY 3 HA2 GLY 3 -4.207 48.218 9.377 27 HA3 GLY 3 HA3 GLY 3 -3.287 47.004 10.252 28 H SER 4 H SER 4 -1.784 48.757 9.164 29 HA SER 4 HA SER 4 -0.412 47.519 6.856 30 HB2 SER 4 HB2 SER 4 -0.339 49.638 5.620 31 HB3 SER 4 HB3 SER 4 -2.002 49.082 5.834 32 HG SER 4 HG SER 4 -1.789 51.330 6.287 33 H HIS 5 H HIS 5 1.676 48.723 6.369 34 HA HIS 5 HA HIS 5 2.915 50.076 8.695 35 HB2 HIS 5 HB2 HIS 5 4.776 48.575 8.808 36 HB3 HIS 5 HB3 HIS 5 3.313 47.617 8.970 37 HD2 HIS 5 HD2 HIS 5 2.679 45.953 6.908 38 HE1 HIS 5 HE1 HIS 5 6.376 46.315 4.807 39 HE2 HIS 5 HE2 HIS 5 4.201 45.001 4.974 40 H HIS 6 H HIS 6 5.076 50.947 8.195 41 HA HIS 6 HA HIS 6 5.823 51.269 5.370 42 HB2 HIS 6 HB2 HIS 6 4.245 53.135 5.728 43 HB3 HIS 6 HB3 HIS 6 5.157 53.655 7.145 44 HD2 HIS 6 HD2 HIS 6 5.538 53.364 3.283 45 HE1 HIS 6 HE1 HIS 6 8.447 56.189 4.612 46 HE2 HIS 6 HE2 HIS 6 7.394 55.094 2.567 47 H HIS 7 H HIS 7 7.987 51.688 5.073 48 HA HIS 7 HA HIS 7 9.707 52.607 7.226 49 HB2 HIS 7 HB2 HIS 7 11.244 50.754 7.237 50 HB3 HIS 7 HB3 HIS 7 9.651 50.151 7.660 51 HD2 HIS 7 HD2 HIS 7 8.381 48.587 5.804 52 HE1 HIS 7 HE1 HIS 7 11.810 47.882 3.363 53 HE2 HIS 7 HE2 HIS 7 9.417 47.158 3.842 54 H HIS 8 H HIS 8 11.870 53.140 6.476 55 HA HIS 8 HA HIS 8 12.447 53.087 3.595 56 HB2 HIS 8 HB2 HIS 8 11.076 55.102 3.731 57 HB3 HIS 8 HB3 HIS 8 12.011 55.695 5.106 58 HD2 HIS 8 HD2 HIS 8 14.192 57.041 4.614 59 HE1 HIS 8 HE1 HIS 8 14.596 56.269 0.440 60 HE2 HIS 8 HE2 HIS 8 15.579 57.523 2.435 61 H HIS 9 H HIS 9 14.593 53.253 3.123 62 HA HIS 9 HA HIS 9 16.505 54.476 4.905 63 HB2 HIS 9 HB2 HIS 9 18.024 52.597 5.146 64 HB3 HIS 9 HB3 HIS 9 16.488 52.226 5.906 65 HD2 HIS 9 HD2 HIS 9 14.886 50.379 4.645 66 HE1 HIS 9 HE1 HIS 9 17.966 48.763 2.172 67 HE2 HIS 9 HE2 HIS 9 15.603 48.403 3.052 68 H HIS 10 H HIS 10 18.493 54.964 3.867 69 HA HIS 10 HA HIS 10 18.982 54.218 1.079 70 HB2 HIS 10 HB2 HIS 10 18.796 56.424 0.142 71 HB3 HIS 10 HB3 HIS 10 17.271 56.056 0.916 72 HD2 HIS 10 HD2 HIS 10 20.225 58.468 1.059 73 HE1 HIS 10 HE1 HIS 10 17.520 59.776 4.087 74 HE2 HIS 10 HE2 HIS 10 19.636 60.362 2.795 75 H GLY 11 H GLY 11 20.921 55.465 0.200 76 HA2 GLY 11 HA2 GLY 11 22.867 56.728 0.402 77 HA3 GLY 11 HA3 GLY 11 22.681 56.780 2.146 78 H SER 28 H SER 28 23.764 54.792 -0.573 79 HA SER 28 HA SER 28 26.112 53.985 0.977 80 HB2 SER 28 HB2 SER 28 25.994 51.615 0.315 81 HB3 SER 28 HB3 SER 28 24.703 52.080 1.430 82 HG SER 28 HG SER 28 23.915 50.788 -0.305 83 H VAL 29 H VAL 29 27.940 53.790 -0.245 84 HA VAL 29 HA VAL 29 27.922 53.603 -3.151 85 HB VAL 29 HB VAL 29 27.314 56.008 -2.691 86 HG11 VAL 29 HG11 VAL 29 30.173 56.317 -1.698 87 HG12 VAL 29 HG12 VAL 29 28.973 57.596 -1.954 88 HG13 VAL 29 HG13 VAL 29 28.717 56.396 -0.680 89 HG21 VAL 29 HG21 VAL 29 28.360 55.294 -4.814 90 HG22 VAL 29 HG22 VAL 29 28.729 56.962 -4.360 91 HG23 VAL 29 HG23 VAL 29 29.957 55.708 -4.144 92 H SER 30 H SER 30 30.072 53.366 -4.050 93 HA SER 30 HA SER 30 32.373 53.342 -2.209 94 HB2 SER 30 HB2 SER 30 33.119 51.121 -2.949 95 HB3 SER 30 HB3 SER 30 31.597 51.057 -2.048 96 HG SER 30 HG SER 30 31.528 49.740 -3.935 97 H PHE 31 H PHE 31 34.381 53.519 -3.184 98 HA PHE 31 HA PHE 31 34.599 54.031 -6.096 99 HB2 PHE 31 HB2 PHE 31 35.287 56.047 -3.913 100 HB3 PHE 31 HB3 PHE 31 35.755 56.208 -5.594 101 HD1 PHE 31 HD1 PHE 31 33.817 56.143 -7.386 102 HD2 PHE 31 HD2 PHE 31 33.286 57.117 -3.216 103 HE1 PHE 31 HE1 PHE 31 31.731 57.375 -7.937 104 HE2 PHE 31 HE2 PHE 31 31.211 58.362 -3.775 105 HZ PHE 31 HZ PHE 31 30.428 58.489 -6.134 106 H GLY 32 H GLY 32 36.914 54.487 -6.701 107 HA2 GLY 32 HA2 GLY 32 39.231 54.319 -6.450 108 HA3 GLY 32 HA3 GLY 32 39.033 53.618 -4.852 109 H ALA 33 H ALA 33 38.904 52.959 -8.316 110 HA ALA 33 HA ALA 33 39.955 50.218 -7.874 111 HB1 ALA 33 HB1 ALA 33 37.559 50.872 -9.639 112 HB2 ALA 33 HB2 ALA 33 38.371 49.293 -9.516 113 HB3 ALA 33 HB3 ALA 33 37.525 49.965 -8.112 114 HA PRO 34 HA PRO 34 42.100 52.891 -11.095 115 HB2 PRO 34 HB2 PRO 34 44.655 52.850 -10.119 116 HB3 PRO 34 HB3 PRO 34 43.395 53.970 -9.516 117 HG2 PRO 34 HG2 PRO 34 44.225 51.295 -8.333 118 HG3 PRO 34 HG3 PRO 34 44.062 52.872 -7.492 119 HD2 PRO 34 HD2 PRO 34 42.061 51.040 -7.457 120 HD3 PRO 34 HD3 PRO 34 41.705 52.788 -7.591 121 H SER 35 H SER 35 43.329 52.244 -12.847 122 HA SER 35 HA SER 35 44.618 49.581 -12.916 123 HB2 SER 35 HB2 SER 35 43.320 48.939 -14.943 124 HB3 SER 35 HB3 SER 35 42.364 49.034 -13.463 125 HG SER 35 HG SER 35 41.299 50.035 -15.248 126 HA PRO 36 HA PRO 36 46.657 52.992 -15.524 127 HB2 PRO 36 HB2 PRO 36 49.050 53.238 -14.214 128 HB3 PRO 36 HB3 PRO 36 47.581 54.155 -13.759 129 HG2 PRO 36 HG2 PRO 36 48.601 51.563 -12.540 130 HG3 PRO 36 HG3 PRO 36 48.105 53.064 -11.692 131 HD2 PRO 36 HD2 PRO 36 46.386 50.989 -11.979 132 HD3 PRO 36 HD3 PRO 36 45.821 52.681 -12.147 133 H LEU 37 H LEU 37 47.911 52.472 -17.224 134 HA LEU 37 HA LEU 37 49.536 49.977 -17.213 135 HB2 LEU 37 HB2 LEU 37 48.423 49.014 -18.992 136 HB3 LEU 37 HB3 LEU 37 47.150 49.567 -17.925 137 HG LEU 37 HG LEU 37 48.015 50.856 -20.559 138 HD11 LEU 37 HD11 LEU 37 45.463 49.408 -19.755 139 HD12 LEU 37 HD12 LEU 37 45.821 50.116 -21.347 140 HD13 LEU 37 HD13 LEU 37 46.766 48.738 -20.763 141 HD21 LEU 37 HD21 LEU 37 47.214 52.670 -19.157 142 HD22 LEU 37 HD22 LEU 37 45.957 52.260 -20.317 143 HD23 LEU 37 HD23 LEU 37 45.807 51.700 -18.637 144 H SER 38 H SER 38 49.958 53.123 -17.690 145 HA SER 38 HA SER 38 51.156 53.149 -20.358 146 HB2 SER 38 HB2 SER 38 50.066 55.138 -19.363 147 HB3 SER 38 HB3 SER 38 51.358 55.218 -18.146 148 HG SER 38 HG SER 38 51.757 56.569 -20.003 149 H SER 39 H SER 39 53.204 52.744 -20.915 150 HA SER 39 HA SER 39 55.470 52.980 -19.100 151 HB2 SER 39 HB2 SER 39 54.518 50.706 -18.554 152 HB3 SER 39 HB3 SER 39 54.809 50.232 -20.238 153 HG SER 39 HG SER 39 56.544 49.650 -18.794 154 H GLU 40 H GLU 40 57.475 52.931 -20.205 155 HA GLU 40 HA GLU 40 57.621 52.338 -23.054 156 HB2 GLU 40 HB2 GLU 40 58.490 54.505 -23.757 157 HB3 GLU 40 HB3 GLU 40 56.826 54.629 -23.197 158 HG2 GLU 40 HG2 GLU 40 57.646 55.539 -21.011 159 HG3 GLU 40 HG3 GLU 40 59.302 55.445 -21.614 160 H SER 41 H SER 41 59.735 52.087 -23.847 161 HA SER 41 HA SER 41 62.066 52.558 -22.124 162 HB2 SER 41 HB2 SER 41 61.137 50.335 -21.385 163 HB3 SER 41 HB3 SER 41 61.423 49.721 -23.020 164 HG SER 41 HG SER 41 63.199 49.269 -21.662 165 H GLU 42 H GLU 42 62.998 53.825 -23.647 166 HA GLU 42 HA GLU 42 63.747 52.702 -26.285 167 HB2 GLU 42 HB2 GLU 42 62.704 54.563 -27.507 168 HB3 GLU 42 HB3 GLU 42 61.530 53.548 -26.690 169 HG2 GLU 42 HG2 GLU 42 61.238 55.213 -24.907 170 HG3 GLU 42 HG3 GLU 42 62.502 56.227 -25.606 171 H ASP 43 H ASP 43 65.298 53.485 -23.960 172 HA ASP 43 HA ASP 43 66.708 55.952 -24.537 173 HB2 ASP 43 HB2 ASP 43 67.300 53.651 -22.644 174 HB3 ASP 43 HB3 ASP 43 68.200 55.167 -22.701 175 H GLU 44 H GLU 44 66.911 55.134 -26.864 176 HA GLU 44 HA GLU 44 68.036 54.327 -28.656 177 HB2 GLU 44 HB2 GLU 44 70.511 54.817 -26.965 178 HB3 GLU 44 HB3 GLU 44 70.479 54.539 -28.712 179 HG2 GLU 44 HG2 GLU 44 69.018 56.551 -28.983 180 HG3 GLU 44 HG3 GLU 44 69.172 56.874 -27.254 181 H ILE 45 H ILE 45 66.806 52.393 -27.306 182 HA ILE 45 HA ILE 45 68.621 50.071 -26.932 183 HB ILE 45 HB ILE 45 65.638 50.380 -26.435 184 HG12 ILE 45 HG12 ILE 45 67.940 50.286 -24.426 185 HG13 ILE 45 HG13 ILE 45 67.152 51.767 -24.946 186 HG21 ILE 45 HG21 ILE 45 67.559 48.122 -25.678 187 HG22 ILE 45 HG22 ILE 45 65.851 48.224 -25.223 188 HG23 ILE 45 HG23 ILE 45 66.283 48.018 -26.910 189 HD11 ILE 45 HD11 ILE 45 65.828 49.536 -23.390 190 HD12 ILE 45 HD12 ILE 45 66.219 51.173 -22.846 191 HD13 ILE 45 HD13 ILE 45 64.975 50.931 -24.088 192 H ASN 46 H ASN 46 69.302 49.487 -28.948 193 HA ASN 46 HA ASN 46 67.287 48.391 -30.828 194 HB2 ASN 46 HB2 ASN 46 67.753 50.864 -31.298 195 HB3 ASN 46 HB3 ASN 46 69.405 50.401 -31.700 196 HD21 ASN 46 HD22 ASN 46 68.829 51.383 -33.830 197 HD22 ASN 46 HD21 ASN 46 67.938 50.400 -34.984 198 H TYR 47 H TYR 47 69.066 46.907 -29.176 199 HA TYR 47 HA TYR 47 70.427 45.389 -31.311 200 HB2 TYR 47 HB2 TYR 47 72.195 46.853 -30.390 201 HB3 TYR 47 HB3 TYR 47 71.893 46.211 -28.778 202 HD1 TYR 47 HD1 TYR 47 73.234 45.464 -32.154 203 HD2 TYR 47 HD2 TYR 47 72.606 43.925 -28.170 204 HE1 TYR 47 HE1 TYR 47 74.734 43.544 -32.659 205 HE2 TYR 47 HE2 TYR 47 74.094 41.986 -28.692 206 HH TYR 47 HH TYR 47 75.711 41.613 -31.869 207 H MET 48 H MET 48 70.249 43.297 -31.145 208 HA MET 48 HA MET 48 70.404 41.841 -28.675 209 HB2 MET 48 HB2 MET 48 67.952 42.322 -28.709 210 HB3 MET 48 HB3 MET 48 67.825 41.584 -30.306 211 HG2 MET 48 HG2 MET 48 68.498 39.412 -29.388 212 HG3 MET 48 HG3 MET 48 68.760 40.129 -27.795 213 HE1 MET 48 HE1 MET 48 66.300 41.925 -27.133 214 HE2 MET 48 HE2 MET 48 65.201 40.725 -26.426 215 HE3 MET 48 HE3 MET 48 66.940 40.646 -26.074 216 H THR 49 H THR 49 71.094 39.645 -29.118 217 HA THR 49 HA THR 49 70.997 38.758 -31.952 218 HB THR 49 HB THR 49 73.187 39.585 -31.762 219 HG1 THR 49 HG1 THR 49 74.209 37.701 -32.418 220 HG21 THR 49 HG21 THR 49 73.735 37.617 -29.499 221 HG22 THR 49 HG22 THR 49 74.910 38.656 -30.326 222 HG23 THR 49 HG23 THR 49 73.642 39.387 -29.341 223 HA PRO 50 HA PRO 50 69.633 35.121 -29.639 224 HB2 PRO 50 HB2 PRO 50 67.791 34.154 -31.332 225 HB3 PRO 50 HB3 PRO 50 67.531 35.705 -30.474 226 HG2 PRO 50 HG2 PRO 50 68.512 35.288 -33.316 227 HG3 PRO 50 HG3 PRO 50 67.248 36.413 -32.733 228 HD2 PRO 50 HD2 PRO 50 69.913 37.113 -33.154 229 HD3 PRO 50 HD3 PRO 50 68.824 37.952 -32.009 230 HA PRO 51 HA PRO 51 71.903 31.794 -31.828 231 HB2 PRO 51 HB2 PRO 51 71.095 29.621 -30.437 232 HB3 PRO 51 HB3 PRO 51 72.138 30.866 -29.684 233 HG2 PRO 51 HG2 PRO 51 69.116 30.622 -29.505 234 HG3 PRO 51 HG3 PRO 51 70.283 30.789 -28.153 235 HD2 PRO 51 HD2 PRO 51 68.956 32.931 -29.224 236 HD3 PRO 51 HD3 PRO 51 70.638 33.070 -28.623 237 H GLU 52 H GLU 52 71.280 29.760 -33.071 238 HA GLU 52 HA GLU 52 68.910 30.193 -34.653 239 HB2 GLU 52 HB2 GLU 52 69.550 28.225 -35.871 240 HB3 GLU 52 HB3 GLU 52 70.966 29.225 -35.559 241 HG2 GLU 52 HG2 GLU 52 71.605 27.701 -33.677 242 HG3 GLU 52 HG3 GLU 52 70.201 26.694 -34.032 243 H GLN 53 H GLN 53 69.400 28.388 -31.762 244 HA GLN 53 HA GLN 53 66.524 27.899 -31.524 245 HB2 GLN 53 HB2 GLN 53 67.388 25.823 -32.620 246 HB3 GLN 53 HB3 GLN 53 68.521 25.598 -31.287 247 HG2 GLN 53 HG2 GLN 53 66.596 25.384 -29.708 248 HG3 GLN 53 HG3 GLN 53 65.475 25.616 -31.056 249 HE21 GLN 53 HE22 GLN 53 65.504 23.903 -32.820 250 HE22 GLN 53 HE21 GLN 53 66.003 22.282 -32.360 251 H GLU 54 H GLU 54 65.946 28.473 -29.460 252 HA GLU 54 HA GLU 54 68.082 28.971 -27.467 253 HB2 GLU 54 HB2 GLU 54 65.114 29.618 -27.478 254 HB3 GLU 54 HB3 GLU 54 66.223 30.003 -26.157 255 HG2 GLU 54 HG2 GLU 54 67.641 31.298 -27.748 256 HG3 GLU 54 HG3 GLU 54 66.437 31.039 -29.013 257 H ALA 55 H ALA 55 65.145 26.949 -27.673 258 HA ALA 55 HA ALA 55 64.311 25.268 -26.458 259 HB1 ALA 55 HB1 ALA 55 67.229 24.488 -26.170 260 HB2 ALA 55 HB2 ALA 55 65.825 23.405 -26.068 261 HB3 ALA 55 HB3 ALA 55 66.208 24.207 -27.598 262 H GLN 56 H GLN 56 65.256 27.698 -24.752 263 HA GLN 56 HA GLN 56 64.402 26.596 -22.164 264 HB2 GLN 56 HB2 GLN 56 66.857 26.205 -22.280 265 HB3 GLN 56 HB3 GLN 56 67.133 27.932 -22.461 266 HG2 GLN 56 HG2 GLN 56 66.344 28.365 -20.215 267 HG3 GLN 56 HG3 GLN 56 65.616 26.761 -20.090 268 HE21 GLN 56 HE22 GLN 56 66.980 24.912 -19.634 269 HE22 GLN 56 HE21 GLN 56 68.648 25.147 -19.134 270 HA PRO 57 HA PRO 57 63.061 30.779 -23.655 271 HB2 PRO 57 HB2 PRO 57 60.384 30.444 -23.871 272 HB3 PRO 57 HB3 PRO 57 61.530 29.643 -24.990 273 HG2 PRO 57 HG2 PRO 57 60.271 28.460 -22.484 274 HG3 PRO 57 HG3 PRO 57 60.251 27.785 -24.147 275 HD2 PRO 57 HD2 PRO 57 62.120 27.034 -22.309 276 HD3 PRO 57 HD3 PRO 57 62.520 27.203 -24.044 277 H GLY 58 H GLY 58 61.347 32.397 -22.897 278 HA2 GLY 58 HA2 GLY 58 59.935 33.337 -21.285 279 HA3 GLY 58 HA3 GLY 58 60.507 32.203 -20.070 280 H ALA 59 H ALA 59 63.297 33.366 -21.372 281 HA ALA 59 HA ALA 59 64.917 34.767 -20.725 282 HB1 ALA 59 HB1 ALA 59 62.682 36.788 -20.504 283 HB2 ALA 59 HB2 ALA 59 64.397 37.122 -20.829 284 HB3 ALA 59 HB3 ALA 59 63.426 36.243 -22.029 285 H LEU 60 H LEU 60 63.451 33.425 -18.452 286 HA LEU 60 HA LEU 60 64.481 34.949 -16.124 287 HB2 LEU 60 HB2 LEU 60 63.044 32.301 -16.499 288 HB3 LEU 60 HB3 LEU 60 63.983 32.559 -15.053 289 HG LEU 60 HG LEU 60 61.652 32.983 -14.649 290 HD11 LEU 60 HD11 LEU 60 63.175 35.614 -14.489 291 HD12 LEU 60 HD12 LEU 60 61.811 35.089 -13.492 292 HD13 LEU 60 HD13 LEU 60 63.361 34.249 -13.361 293 HD21 LEU 60 HD21 LEU 60 60.954 33.803 -16.866 294 HD22 LEU 60 HD22 LEU 60 60.436 34.875 -15.556 295 HD23 LEU 60 HD23 LEU 60 61.817 35.330 -16.573 296 H ALA 61 H ALA 61 66.113 33.934 -14.716 297 HA ALA 61 HA ALA 61 68.007 32.148 -16.093 298 HB1 ALA 61 HB1 ALA 61 68.780 34.715 -14.654 299 HB2 ALA 61 HB2 ALA 61 69.917 33.479 -15.225 300 HB3 ALA 61 HB3 ALA 61 68.936 34.377 -16.393 301 H ALA 62 H ALA 62 68.986 30.645 -14.888 302 HA ALA 62 HA ALA 62 68.404 30.435 -11.980 303 HB1 ALA 62 HB1 ALA 62 69.758 28.494 -13.894 304 HB2 ALA 62 HB2 ALA 62 69.402 28.197 -12.182 305 HB3 ALA 62 HB3 ALA 62 68.073 28.412 -13.337 306 H LEU 63 H LEU 63 70.167 30.122 -10.494 307 HA LEU 63 HA LEU 63 72.744 31.423 -11.261 308 HB2 LEU 63 HB2 LEU 63 71.045 32.037 -8.811 309 HB3 LEU 63 HB3 LEU 63 72.639 32.703 -9.142 310 HG LEU 63 HG LEU 63 70.133 33.243 -10.803 311 HD11 LEU 63 HD11 LEU 63 71.676 34.990 -8.839 312 HD12 LEU 63 HD12 LEU 63 70.265 35.484 -9.805 313 HD13 LEU 63 HD13 LEU 63 70.086 34.252 -8.547 314 HD21 LEU 63 HD21 LEU 63 72.155 33.450 -12.200 315 HD22 LEU 63 HD22 LEU 63 71.513 35.047 -11.807 316 HD23 LEU 63 HD23 LEU 63 72.940 34.429 -10.950 317 H HIS 64 H HIS 64 74.507 31.023 -9.867 318 HA HIS 64 HA HIS 64 74.412 28.555 -8.202 319 HB2 HIS 64 HB2 HIS 64 76.596 30.479 -9.014 320 HB3 HIS 64 HB3 HIS 64 76.852 29.202 -7.829 321 HD2 HIS 64 HD2 HIS 64 77.066 29.872 -11.480 322 HE1 HIS 64 HE1 HIS 64 76.998 25.615 -11.168 323 HE2 HIS 64 HE2 HIS 64 77.502 27.577 -12.700 324 H ALA 65 H ALA 65 74.318 28.606 -5.974 325 HA ALA 65 HA ALA 65 73.569 31.201 -4.779 326 HB1 ALA 65 HB1 ALA 65 73.336 28.350 -3.742 327 HB2 ALA 65 HB2 ALA 65 72.600 29.799 -3.026 328 HB3 ALA 65 HB3 ALA 65 72.080 29.248 -4.630 329 H GLU 66 H GLU 66 76.329 29.074 -4.647 330 HA GLU 66 HA GLU 66 77.493 30.534 -2.316 331 HB2 GLU 66 HB2 GLU 66 77.275 27.508 -2.619 332 HB3 GLU 66 HB3 GLU 66 78.252 28.340 -1.407 333 HG2 GLU 66 HG2 GLU 66 76.181 29.423 -0.509 334 HG3 GLU 66 HG3 GLU 66 75.219 28.456 -1.634 335 H GLY 67 H GLY 67 79.823 30.061 -2.006 336 HA2 GLY 67 HA2 GLY 67 82.006 29.774 -2.722 337 HA3 GLY 67 HA3 GLY 67 81.395 28.865 -4.099 338 HA PRO 68 HA PRO 68 83.334 32.863 -5.499 339 HB2 PRO 68 HB2 PRO 68 84.742 31.904 -7.655 340 HB3 PRO 68 HB3 PRO 68 85.315 31.794 -5.963 341 HG2 PRO 68 HG2 PRO 68 83.853 29.672 -7.570 342 HG3 PRO 68 HG3 PRO 68 85.368 29.494 -6.625 343 HD2 PRO 68 HD2 PRO 68 82.978 28.794 -5.579 344 HD3 PRO 68 HD3 PRO 68 84.201 29.618 -4.563 345 H LEU 69 H LEU 69 81.223 30.607 -7.120 346 HA LEU 69 HA LEU 69 80.524 32.568 -9.233 347 HB2 LEU 69 HB2 LEU 69 79.628 29.704 -8.806 348 HB3 LEU 69 HB3 LEU 69 79.115 30.732 -10.136 349 HG LEU 69 HG LEU 69 81.972 29.808 -9.654 350 HD11 LEU 69 HD11 LEU 69 79.936 29.014 -11.769 351 HD12 LEU 69 HD12 LEU 69 81.597 28.398 -11.608 352 HD13 LEU 69 HD13 LEU 69 80.395 28.028 -10.363 353 HD21 LEU 69 HD21 LEU 69 82.038 31.945 -10.814 354 HD22 LEU 69 HD22 LEU 69 82.369 30.657 -11.972 355 HD23 LEU 69 HD23 LEU 69 80.763 31.414 -11.949 356 H ALA 70 H ALA 70 79.612 32.472 -6.070 357 HA ALA 70 HA ALA 70 76.831 32.257 -6.128 358 HB1 ALA 70 HB1 ALA 70 78.554 34.092 -4.405 359 HB2 ALA 70 HB2 ALA 70 76.875 33.618 -4.062 360 HB3 ALA 70 HB3 ALA 70 78.157 32.394 -4.062 361 H GLY 71 H GLY 71 75.294 33.288 -7.074 362 HA2 GLY 71 HA2 GLY 71 73.958 35.035 -7.877 363 HA3 GLY 71 HA3 GLY 71 75.259 36.192 -7.605 364 H LEU 72 H LEU 72 76.473 33.535 -9.367 365 HA LEU 72 HA LEU 72 76.278 35.010 -11.948 366 HB2 LEU 72 HB2 LEU 72 78.315 32.928 -11.076 367 HB3 LEU 72 HB3 LEU 72 78.392 33.890 -12.501 368 HG LEU 72 HG LEU 72 78.808 34.847 -9.669 369 HD11 LEU 72 HD11 LEU 72 80.503 35.104 -12.191 370 HD12 LEU 72 HD12 LEU 72 80.975 35.514 -10.527 371 HD13 LEU 72 HD13 LEU 72 80.697 33.829 -10.983 372 HD21 LEU 72 HD21 LEU 72 77.486 36.634 -10.724 373 HD22 LEU 72 HD22 LEU 72 79.171 37.123 -10.588 374 HD23 LEU 72 HD23 LEU 72 78.531 36.592 -12.156 375 HA PRO 73 HA PRO 73 73.710 32.178 -13.875 376 HB2 PRO 73 HB2 PRO 73 74.673 31.827 -16.435 377 HB3 PRO 73 HB3 PRO 73 74.039 33.390 -15.829 378 HG2 PRO 73 HG2 PRO 73 76.898 32.434 -16.054 379 HG3 PRO 73 HG3 PRO 73 76.220 34.019 -16.534 380 HD2 PRO 73 HD2 PRO 73 77.509 33.586 -14.223 381 HD3 PRO 73 HD3 PRO 73 76.182 34.783 -14.324 382 H VAL 74 H VAL 74 73.252 30.003 -14.840 383 HA VAL 74 HA VAL 74 75.443 28.040 -14.291 384 HB VAL 74 HB VAL 74 72.481 27.449 -14.349 385 HG11 VAL 74 HG11 VAL 74 74.873 25.924 -13.241 386 HG12 VAL 74 HG12 VAL 74 73.171 25.455 -13.057 387 HG13 VAL 74 HG13 VAL 74 73.899 25.475 -14.659 388 HG21 VAL 74 HG21 VAL 74 72.865 29.022 -12.500 389 HG22 VAL 74 HG22 VAL 74 72.608 27.400 -11.866 390 HG23 VAL 74 HG23 VAL 74 74.253 28.065 -11.942 391 H THR 75 H THR 75 73.109 29.071 -16.771 392 HA THR 75 HA THR 75 74.460 27.265 -18.749 393 HB THR 75 HB THR 75 72.437 27.036 -19.934 394 HG1 THR 75 HG1 THR 75 70.530 28.111 -19.122 395 HG21 THR 75 HG21 THR 75 71.647 26.827 -17.014 396 HG22 THR 75 HG22 THR 75 71.033 25.884 -18.392 397 HG23 THR 75 HG23 THR 75 72.715 25.676 -17.850 398 H ARG 76 H ARG 76 74.154 27.947 -21.098 399 HA ARG 76 HA ARG 76 75.245 30.573 -21.613 400 HB2 ARG 76 HB2 ARG 76 73.796 28.486 -23.338 401 HB3 ARG 76 HB3 ARG 76 74.280 30.029 -24.014 402 HG2 ARG 76 HG2 ARG 76 76.218 28.020 -22.796 403 HG3 ARG 76 HG3 ARG 76 75.869 28.223 -24.516 404 HD2 ARG 76 HD2 ARG 76 76.558 30.664 -24.273 405 HD3 ARG 76 HD3 ARG 76 77.166 30.260 -22.670 406 HE ARG 76 HE ARG 76 78.680 28.587 -23.758 407 HH11 ARG 76 HH11 ARG 76 77.511 31.197 -25.878 408 HH12 ARG 76 HH12 ARG 76 78.898 30.941 -26.942 409 HH21 ARG 76 HH21 ARG 76 80.323 28.421 -25.321 410 HH22 ARG 76 HH22 ARG 76 80.302 29.587 -26.651 411 H SER 77 H SER 77 71.882 29.372 -21.635 412 HA SER 77 HA SER 77 70.689 31.852 -22.477 413 HB2 SER 77 HB2 SER 77 69.556 29.586 -22.410 414 HB3 SER 77 HB3 SER 77 69.400 29.803 -20.651 415 HG SER 77 HG SER 77 67.545 30.578 -21.859 416 H ASP 78 H ASP 78 71.402 30.532 -19.161 417 HA ASP 78 HA ASP 78 70.418 32.789 -17.730 418 HB2 ASP 78 HB2 ASP 78 72.791 31.028 -17.072 419 HB3 ASP 78 HB3 ASP 78 71.979 32.118 -15.950 420 H ALA 79 H ALA 79 73.731 32.193 -19.054 421 HA ALA 79 HA ALA 79 74.844 34.641 -18.113 422 HB1 ALA 79 HB1 ALA 79 75.664 32.822 -20.429 423 HB2 ALA 79 HB2 ALA 79 76.665 34.113 -19.744 424 HB3 ALA 79 HB3 ALA 79 76.230 32.714 -18.741 425 H ARG 80 H ARG 80 73.297 33.929 -21.289 426 HA ARG 80 HA ARG 80 73.641 36.583 -22.389 427 HB2 ARG 80 HB2 ARG 80 71.557 34.407 -22.876 428 HB3 ARG 80 HB3 ARG 80 71.566 35.948 -23.743 429 HG2 ARG 80 HG2 ARG 80 73.810 35.499 -24.635 430 HG3 ARG 80 HG3 ARG 80 73.896 33.983 -23.735 431 HD2 ARG 80 HD2 ARG 80 73.329 33.515 -26.041 432 HD3 ARG 80 HD3 ARG 80 71.960 33.099 -25.020 433 HE ARG 80 HE ARG 80 72.226 35.488 -26.827 434 HH11 ARG 80 HH11 ARG 80 69.989 33.442 -25.028 435 HH12 ARG 80 HH12 ARG 80 68.602 34.192 -25.760 436 HH21 ARG 80 HH21 ARG 80 70.422 36.390 -27.683 437 HH22 ARG 80 HH22 ARG 80 68.841 35.909 -27.104 438 H VAL 81 H VAL 81 70.962 35.210 -20.438 439 HA VAL 81 HA VAL 81 69.344 37.574 -20.380 440 HB VAL 81 HB VAL 81 69.594 35.232 -18.460 441 HG11 VAL 81 HG11 VAL 81 67.544 37.494 -18.399 442 HG12 VAL 81 HG12 VAL 81 67.403 35.962 -17.514 443 HG13 VAL 81 HG13 VAL 81 68.699 37.083 -17.109 444 HG21 VAL 81 HG21 VAL 81 68.669 34.854 -20.764 445 HG22 VAL 81 HG22 VAL 81 67.512 34.529 -19.469 446 HG23 VAL 81 HG23 VAL 81 67.398 36.038 -20.413 447 H LEU 82 H LEU 82 71.755 36.428 -17.940 448 HA LEU 82 HA LEU 82 71.593 38.737 -16.311 449 HB2 LEU 82 HB2 LEU 82 73.585 36.522 -16.707 450 HB3 LEU 82 HB3 LEU 82 74.165 37.986 -15.928 451 HG LEU 82 HG LEU 82 72.419 37.885 -14.232 452 HD11 LEU 82 HD11 LEU 82 71.586 35.232 -15.451 453 HD12 LEU 82 HD12 LEU 82 71.013 35.913 -13.915 454 HD13 LEU 82 HD13 LEU 82 70.604 36.717 -15.427 455 HD21 LEU 82 HD21 LEU 82 74.618 36.709 -13.959 456 HD22 LEU 82 HD22 LEU 82 73.314 35.974 -13.022 457 HD23 LEU 82 HD23 LEU 82 73.833 35.221 -14.547 458 H ILE 83 H ILE 83 73.958 38.185 -19.008 459 HA ILE 83 HA ILE 83 75.221 40.722 -18.851 460 HB ILE 83 HB ILE 83 74.700 38.838 -21.171 461 HG12 ILE 83 HG12 ILE 83 77.287 39.658 -19.762 462 HG13 ILE 83 HG13 ILE 83 76.311 38.284 -19.259 463 HG21 ILE 83 HG21 ILE 83 76.286 41.450 -21.285 464 HG22 ILE 83 HG22 ILE 83 76.298 40.191 -22.536 465 HG23 ILE 83 HG23 ILE 83 74.822 41.072 -22.217 466 HD11 ILE 83 HD11 ILE 83 77.718 38.571 -21.942 467 HD12 ILE 83 HD12 ILE 83 78.127 37.477 -20.617 468 HD13 ILE 83 HD13 ILE 83 76.610 37.244 -21.509 469 H PHE 84 H PHE 84 72.336 39.815 -20.835 470 HA PHE 84 HA PHE 84 71.977 42.434 -21.834 471 HB2 PHE 84 HB2 PHE 84 71.041 40.250 -22.746 472 HB3 PHE 84 HB3 PHE 84 69.814 40.325 -21.495 473 HD1 PHE 84 HD1 PHE 84 71.356 42.782 -23.941 474 HD2 PHE 84 HD2 PHE 84 67.726 41.072 -22.347 475 HE1 PHE 84 HE1 PHE 84 70.059 44.038 -25.589 476 HE2 PHE 84 HE2 PHE 84 66.402 42.446 -23.937 477 HZ PHE 84 HZ PHE 84 67.559 43.915 -25.582 478 H ASN 85 H ASN 85 70.302 40.870 -19.022 479 HA ASN 85 HA ASN 85 68.618 43.142 -18.546 480 HB2 ASN 85 HB2 ASN 85 68.066 40.883 -17.737 481 HB3 ASN 85 HB3 ASN 85 69.467 40.899 -16.658 482 HD21 ASN 85 HD22 ASN 85 69.369 42.201 -14.719 483 HD22 ASN 85 HD21 ASN 85 67.982 43.204 -14.342 484 H GLU 86 H GLU 86 71.787 42.208 -17.042 485 HA GLU 86 HA GLU 86 71.774 44.451 -15.209 486 HB2 GLU 86 HB2 GLU 86 74.062 42.732 -16.255 487 HB3 GLU 86 HB3 GLU 86 74.230 43.999 -15.040 488 HG2 GLU 86 HG2 GLU 86 72.586 42.852 -13.579 489 HG3 GLU 86 HG3 GLU 86 72.438 41.546 -14.750 490 H TRP 87 H TRP 87 73.241 44.019 -18.534 491 HA TRP 87 HA TRP 87 74.218 46.708 -18.660 492 HB2 TRP 87 HB2 TRP 87 74.949 45.069 -20.257 493 HB3 TRP 87 HB3 TRP 87 73.297 44.767 -20.779 494 HD1 TRP 87 HD1 TRP 87 75.947 47.586 -21.003 495 HE1 TRP 87 HE1 TRP 87 75.537 48.853 -23.196 496 HE3 TRP 87 HE3 TRP 87 71.633 45.274 -22.497 497 HZ2 TRP 87 HZ2 TRP 87 73.678 48.786 -25.371 498 HZ3 TRP 87 HZ3 TRP 87 70.658 45.812 -24.671 499 HH2 TRP 87 HH2 TRP 87 71.630 47.574 -26.137 500 H GLU 88 H GLU 88 70.955 45.374 -19.646 501 HA GLU 88 HA GLU 88 69.923 47.773 -20.658 502 HB2 GLU 88 HB2 GLU 88 68.674 45.366 -19.318 503 HB3 GLU 88 HB3 GLU 88 67.683 46.749 -19.717 504 HG2 GLU 88 HG2 GLU 88 69.419 45.517 -21.864 505 HG3 GLU 88 HG3 GLU 88 67.878 44.793 -21.415 506 H GLU 89 H GLU 89 69.716 46.683 -17.192 507 HA GLU 89 HA GLU 89 68.353 49.087 -16.347 508 HB2 GLU 89 HB2 GLU 89 70.025 47.067 -14.792 509 HB3 GLU 89 HB3 GLU 89 69.126 48.401 -14.059 510 HG2 GLU 89 HG2 GLU 89 67.018 47.519 -15.061 511 HG3 GLU 89 HG3 GLU 89 67.915 46.153 -15.722 512 H ARG 90 H ARG 90 71.826 48.164 -16.097 513 HA ARG 90 HA ARG 90 72.719 50.645 -14.929 514 HB2 ARG 90 HB2 ARG 90 74.174 48.651 -16.726 515 HB3 ARG 90 HB3 ARG 90 74.963 49.985 -15.890 516 HG2 ARG 90 HG2 ARG 90 73.442 47.748 -14.549 517 HG3 ARG 90 HG3 ARG 90 75.192 47.792 -14.758 518 HD2 ARG 90 HD2 ARG 90 73.497 49.690 -13.068 519 HD3 ARG 90 HD3 ARG 90 74.586 48.434 -12.483 520 HE ARG 90 HE ARG 90 75.620 50.755 -14.112 521 HH11 ARG 90 HH11 ARG 90 75.805 49.056 -11.022 522 HH12 ARG 90 HH12 ARG 90 77.195 49.992 -10.544 523 HH21 ARG 90 HH21 ARG 90 77.235 51.807 -13.497 524 HH22 ARG 90 HH22 ARG 90 78.032 51.563 -11.935 525 H LYS 91 H LYS 91 72.633 49.621 -18.303 526 HA LYS 91 HA LYS 91 73.571 52.133 -19.326 527 HB2 LYS 91 HB2 LYS 91 73.619 49.913 -20.541 528 HB3 LYS 91 HB3 LYS 91 71.896 50.074 -20.845 529 HG2 LYS 91 HG2 LYS 91 73.603 52.380 -21.725 530 HG3 LYS 91 HG3 LYS 91 73.902 50.847 -22.530 531 HD2 LYS 91 HD2 LYS 91 71.495 50.652 -23.112 532 HD3 LYS 91 HD3 LYS 91 71.206 52.262 -22.409 533 HE2 LYS 91 HE2 LYS 91 72.784 53.277 -23.997 534 HE3 LYS 91 HE3 LYS 91 73.254 51.687 -24.606 535 HZ1 LYS 91 HZ1 LYS 91 70.538 52.905 -24.905 536 HZ2 LYS 91 HZ2 LYS 91 71.649 52.720 -26.095 537 HZ3 LYS 91 HZ3 LYS 91 70.958 51.404 -25.434 538 H LYS 92 H LYS 92 70.198 51.096 -18.629 539 HA LYS 92 HA LYS 92 69.081 53.556 -19.708 540 HB2 LYS 92 HB2 LYS 92 68.030 51.513 -17.730 541 HB3 LYS 92 HB3 LYS 92 67.169 53.020 -18.087 542 HG2 LYS 92 HG2 LYS 92 67.069 52.496 -20.469 543 HG3 LYS 92 HG3 LYS 92 68.038 51.055 -20.242 544 HD2 LYS 92 HD2 LYS 92 65.841 50.311 -20.497 545 HD3 LYS 92 HD3 LYS 92 66.179 50.099 -18.788 546 HE2 LYS 92 HE2 LYS 92 64.870 52.673 -19.737 547 HE3 LYS 92 HE3 LYS 92 63.914 51.199 -19.785 548 HZ1 LYS 92 HZ1 LYS 92 65.168 52.280 -17.304 549 HZ2 LYS 92 HZ2 LYS 92 63.587 52.340 -17.687 550 HZ3 LYS 92 HZ3 LYS 92 64.287 50.900 -17.398 551 H SER 93 H SER 93 70.682 52.881 -16.564 552 HA SER 93 HA SER 93 70.364 55.795 -15.996 553 HB2 SER 93 HB2 SER 93 71.533 55.422 -13.917 554 HB3 SER 93 HB3 SER 93 70.079 54.436 -14.100 555 HG SER 93 HG SER 93 71.840 53.241 -13.234 556 H GLU 94 H GLU 94 72.604 53.958 -17.745 557 HA GLU 94 HA GLU 94 74.622 56.161 -17.844 558 HB2 GLU 94 HB2 GLU 94 75.222 53.176 -17.643 559 HB3 GLU 94 HB3 GLU 94 76.382 54.482 -17.774 560 HG2 GLU 94 HG2 GLU 94 75.589 55.363 -15.570 561 HG3 GLU 94 HG3 GLU 94 74.514 53.963 -15.446 562 HA PRO 95 HA PRO 95 72.902 54.657 -21.909 563 HB2 PRO 95 HB2 PRO 95 72.971 57.065 -23.327 564 HB3 PRO 95 HB3 PRO 95 71.639 56.484 -22.288 565 HG2 PRO 95 HG2 PRO 95 73.912 58.350 -21.544 566 HG3 PRO 95 HG3 PRO 95 72.159 58.550 -21.218 567 HD2 PRO 95 HD2 PRO 95 73.775 57.602 -19.297 568 HD3 PRO 95 HD3 PRO 95 72.186 56.828 -19.564 569 H TRP 96 H TRP 96 76.021 55.748 -21.242 570 HA TRP 96 HA TRP 96 77.185 55.367 -23.919 571 HB2 TRP 96 HB2 TRP 96 79.292 55.866 -22.664 572 HB3 TRP 96 HB3 TRP 96 78.069 57.117 -22.563 573 HD1 TRP 96 HD1 TRP 96 79.776 54.452 -20.406 574 HE1 TRP 96 HE1 TRP 96 79.406 54.980 -17.921 575 HE3 TRP 96 HE3 TRP 96 76.465 58.338 -20.885 576 HZ2 TRP 96 HZ2 TRP 96 77.840 56.817 -16.341 577 HZ3 TRP 96 HZ3 TRP 96 75.535 59.445 -18.865 578 HH2 TRP 96 HH2 TRP 96 76.208 58.693 -16.594 579 H LEU 97 H LEU 97 76.290 53.191 -21.361 580 HA LEU 97 HA LEU 97 78.572 51.636 -21.156 581 HB2 LEU 97 HB2 LEU 97 76.415 51.744 -19.708 582 HB3 LEU 97 HB3 LEU 97 75.728 50.630 -20.861 583 HG LEU 97 HG LEU 97 77.528 49.024 -20.335 584 HD11 LEU 97 HD11 LEU 97 78.286 51.021 -18.160 585 HD12 LEU 97 HD12 LEU 97 78.847 49.338 -18.229 586 HD13 LEU 97 HD13 LEU 97 79.328 50.469 -19.490 587 HD21 LEU 97 HD21 LEU 97 75.327 48.962 -19.161 588 HD22 LEU 97 HD22 LEU 97 76.635 48.401 -18.105 589 HD23 LEU 97 HD23 LEU 97 75.986 50.049 -17.923 590 H ARG 98 H ARG 98 79.405 49.841 -22.112 591 HA ARG 98 HA ARG 98 78.371 49.091 -24.785 592 HB2 ARG 98 HB2 ARG 98 80.944 48.216 -23.430 593 HB3 ARG 98 HB3 ARG 98 80.536 48.086 -25.139 594 HG2 ARG 98 HG2 ARG 98 81.102 50.641 -23.577 595 HG3 ARG 98 HG3 ARG 98 82.116 49.897 -24.804 596 HD2 ARG 98 HD2 ARG 98 80.405 50.382 -26.539 597 HD3 ARG 98 HD3 ARG 98 79.339 51.055 -25.308 598 HE ARG 98 HE ARG 98 80.592 52.977 -25.151 599 HH11 ARG 98 HH11 ARG 98 82.362 50.784 -27.253 600 HH12 ARG 98 HH12 ARG 98 83.450 52.034 -27.786 601 HH21 ARG 98 HH21 ARG 98 82.015 54.514 -25.880 602 HH22 ARG 98 HH22 ARG 98 83.253 54.092 -27.025 603 H LEU 99 H LEU 99 78.303 46.941 -25.514 604 HA LEU 99 HA LEU 99 77.395 44.894 -23.548 605 HB2 LEU 99 HB2 LEU 99 75.587 46.321 -24.317 606 HB3 LEU 99 HB3 LEU 99 75.952 46.035 -25.986 607 HG LEU 99 HG LEU 99 73.906 44.929 -25.118 608 HD11 LEU 99 HD11 LEU 99 75.857 42.777 -25.967 609 HD12 LEU 99 HD12 LEU 99 74.157 43.008 -26.421 610 HD13 LEU 99 HD13 LEU 99 75.375 44.081 -27.068 611 HD21 LEU 99 HD21 LEU 99 74.916 44.399 -22.848 612 HD22 LEU 99 HD22 LEU 99 73.781 43.285 -23.577 613 HD23 LEU 99 HD23 LEU 99 75.545 42.928 -23.613 614 H ASP 100 H ASP 100 78.181 42.863 -24.089 615 HA ASP 100 HA ASP 100 78.801 42.229 -26.916 616 HB2 ASP 100 HB2 ASP 100 80.890 43.079 -25.802 617 HB3 ASP 100 HB3 ASP 100 80.793 41.723 -24.678 618 H MET 101 H MET 101 78.144 40.279 -27.473 619 HA MET 101 HA MET 101 77.436 38.236 -25.405 620 HB2 MET 101 HB2 MET 101 75.859 39.045 -27.876 621 HB3 MET 101 HB3 MET 101 75.480 37.652 -26.852 622 HG2 MET 101 HG2 MET 101 75.131 39.108 -24.918 623 HG3 MET 101 HG3 MET 101 75.552 40.529 -25.876 624 HE1 MET 101 HE1 MET 101 73.184 41.785 -25.122 625 HE2 MET 101 HE2 MET 101 71.684 40.832 -25.151 626 HE3 MET 101 HE3 MET 101 73.031 40.322 -24.111 627 H SER 102 H SER 102 79.723 38.767 -27.598 628 HA SER 102 HA SER 102 79.747 36.359 -29.207 629 HB2 SER 102 HB2 SER 102 81.078 38.393 -29.709 630 HB3 SER 102 HB3 SER 102 82.045 38.109 -28.244 631 HG SER 102 HG SER 102 82.960 37.260 -30.261 632 H ASP 103 H ASP 103 81.104 34.489 -28.895 633 HA ASP 103 HA ASP 103 80.845 33.147 -26.443 634 HB2 ASP 103 HB2 ASP 103 82.845 32.765 -28.712 635 HB3 ASP 103 HB3 ASP 103 82.648 31.638 -27.373 636 H LYS 104 H LYS 104 83.606 35.102 -27.567 637 HA LYS 104 HA LYS 104 85.447 34.538 -25.464 638 HB2 LYS 104 HB2 LYS 104 85.056 37.057 -27.145 639 HB3 LYS 104 HB3 LYS 104 86.446 36.751 -26.095 640 HG2 LYS 104 HG2 LYS 104 87.012 34.723 -27.397 641 HG3 LYS 104 HG3 LYS 104 85.644 35.030 -28.484 642 HD2 LYS 104 HD2 LYS 104 86.621 37.244 -29.073 643 HD3 LYS 104 HD3 LYS 104 88.027 36.901 -28.062 644 HE2 LYS 104 HE2 LYS 104 87.136 35.218 -30.458 645 HE3 LYS 104 HE3 LYS 104 88.331 36.512 -30.544 646 HZ1 LYS 104 HZ1 LYS 104 88.637 34.028 -28.925 647 HZ2 LYS 104 HZ2 LYS 104 89.430 34.381 -30.304 648 HZ3 LYS 104 HZ3 LYS 104 89.720 35.259 -28.963 649 H ALA 105 H ALA 105 82.761 36.894 -25.528 650 HA ALA 105 HA ALA 105 83.422 38.200 -23.036 651 HB1 ALA 105 HB1 ALA 105 80.717 37.895 -24.400 652 HB2 ALA 105 HB2 ALA 105 81.152 39.066 -23.144 653 HB3 ALA 105 HB3 ALA 105 81.911 39.165 -24.742 654 H ILE 106 H ILE 106 81.429 35.375 -23.847 655 HA ILE 106 HA ILE 106 80.533 34.942 -21.123 656 HB ILE 106 HB ILE 106 80.375 33.369 -23.703 657 HG12 ILE 106 HG12 ILE 106 77.968 33.638 -23.346 658 HG13 ILE 106 HG13 ILE 106 78.246 34.415 -21.787 659 HG21 ILE 106 HG21 ILE 106 79.468 32.387 -20.955 660 HG22 ILE 106 HG22 ILE 106 78.992 31.675 -22.512 661 HG23 ILE 106 HG23 ILE 106 80.675 31.615 -22.017 662 HD11 ILE 106 HD11 ILE 106 79.069 35.582 -24.476 663 HD12 ILE 106 HD12 ILE 106 77.599 36.004 -23.578 664 HD13 ILE 106 HD13 ILE 106 79.187 36.401 -22.902 665 H PHE 107 H PHE 107 83.079 33.345 -23.118 666 HA PHE 107 HA PHE 107 84.103 31.611 -21.134 667 HB2 PHE 107 HB2 PHE 107 85.722 33.255 -23.119 668 HB3 PHE 107 HB3 PHE 107 86.263 31.802 -22.302 669 HD1 PHE 107 HD2 PHE 107 83.376 30.360 -22.889 670 HD2 PHE 107 HD1 PHE 107 86.416 32.366 -25.195 671 HE1 PHE 107 HE2 PHE 107 82.814 28.952 -24.848 672 HE2 PHE 107 HE1 PHE 107 85.837 30.954 -27.176 673 HZ PHE 107 HZ PHE 107 84.045 29.237 -26.990 674 H ARG 108 H ARG 108 85.054 35.039 -21.720 675 HA ARG 108 HA ARG 108 87.029 35.008 -19.649 676 HB2 ARG 108 HB2 ARG 108 86.925 36.267 -21.862 677 HB3 ARG 108 HB3 ARG 108 85.817 37.403 -21.089 678 HG2 ARG 108 HG2 ARG 108 88.163 37.008 -19.394 679 HG3 ARG 108 HG3 ARG 108 88.688 37.268 -21.049 680 HD2 ARG 108 HD2 ARG 108 88.643 39.420 -19.998 681 HD3 ARG 108 HD3 ARG 108 87.312 39.361 -21.141 682 HE ARG 108 HE ARG 108 85.797 39.574 -19.407 683 HH11 ARG 108 HH11 ARG 108 88.887 38.795 -17.928 684 HH12 ARG 108 HH12 ARG 108 88.312 39.150 -16.325 685 HH21 ARG 108 HH21 ARG 108 85.145 40.042 -17.324 686 HH22 ARG 108 HH22 ARG 108 86.249 39.827 -16.001 687 H ARG 109 H ARG 109 83.676 36.215 -19.704 688 HA ARG 109 HA ARG 109 83.832 37.315 -16.979 689 HB2 ARG 109 HB2 ARG 109 82.397 38.199 -18.849 690 HB3 ARG 109 HB3 ARG 109 81.395 36.745 -18.722 691 HG2 ARG 109 HG2 ARG 109 80.825 37.331 -16.389 692 HG3 ARG 109 HG3 ARG 109 81.875 38.750 -16.466 693 HD2 ARG 109 HD2 ARG 109 79.455 38.276 -18.263 694 HD3 ARG 109 HD3 ARG 109 79.411 39.238 -16.794 695 HE ARG 109 HE ARG 109 80.574 39.976 -19.390 696 HH11 ARG 109 HH11 ARG 109 80.503 40.873 -15.996 697 HH12 ARG 109 HH12 ARG 109 81.076 42.483 -16.317 698 HH21 ARG 109 HH21 ARG 109 81.310 42.047 -19.722 699 HH22 ARG 109 HH22 ARG 109 81.513 43.126 -18.376 700 H TYR 110 H TYR 110 82.655 34.313 -18.433 701 HA TYR 110 HA TYR 110 82.075 33.141 -15.745 702 HB2 TYR 110 HB2 TYR 110 80.535 32.706 -18.321 703 HB3 TYR 110 HB3 TYR 110 80.168 32.049 -16.747 704 HD1 TYR 110 HD1 TYR 110 80.137 34.159 -14.837 705 HD2 TYR 110 HD2 TYR 110 79.014 34.283 -19.005 706 HE1 TYR 110 HE1 TYR 110 78.707 36.153 -14.405 707 HE2 TYR 110 HE2 TYR 110 77.530 36.240 -18.543 708 HH TYR 110 HH TYR 110 77.232 37.706 -15.294 709 HA PRO 111 HA PRO 111 85.273 30.733 -18.110 710 HB2 PRO 111 HB2 PRO 111 86.869 29.966 -16.000 711 HB3 PRO 111 HB3 PRO 111 86.969 31.557 -16.813 712 HG2 PRO 111 HG2 PRO 111 85.453 30.859 -14.277 713 HG3 PRO 111 HG3 PRO 111 86.590 32.222 -14.547 714 HD2 PRO 111 HD2 PRO 111 83.925 32.587 -14.738 715 HD3 PRO 111 HD3 PRO 111 85.024 33.373 -15.913 716 H HIS 112 H HIS 112 83.112 29.740 -15.549 717 HA HIS 112 HA HIS 112 83.583 26.873 -15.805 718 HB2 HIS 112 HB2 HIS 112 81.753 26.658 -14.334 719 HB3 HIS 112 HB3 HIS 112 82.638 28.075 -13.785 720 HD2 HIS 112 HD2 HIS 112 79.266 26.995 -14.097 721 HE1 HIS 112 HE1 HIS 112 78.829 31.018 -15.387 722 HE2 HIS 112 HE2 HIS 112 77.619 29.060 -14.472 723 H LEU 113 H LEU 113 81.659 29.250 -17.556 724 HA LEU 113 HA LEU 113 79.926 27.320 -18.824 725 HB2 LEU 113 HB2 LEU 113 79.915 30.085 -18.182 726 HB3 LEU 113 HB3 LEU 113 80.038 30.055 -19.920 727 HG LEU 113 HG LEU 113 77.771 30.270 -19.269 728 HD11 LEU 113 HD11 LEU 113 78.136 27.367 -20.145 729 HD12 LEU 113 HD12 LEU 113 76.725 28.393 -20.426 730 HD13 LEU 113 HD13 LEU 113 78.264 28.777 -21.217 731 HD21 LEU 113 HD21 LEU 113 77.680 29.448 -17.069 732 HD22 LEU 113 HD22 LEU 113 76.541 28.506 -18.015 733 HD23 LEU 113 HD23 LEU 113 78.097 27.786 -17.561 734 H ARG 114 H ARG 114 83.112 28.065 -19.413 735 HA ARG 114 HA ARG 114 83.144 27.978 -22.340 736 HB2 ARG 114 HB2 ARG 114 84.888 29.173 -21.072 737 HB3 ARG 114 HB3 ARG 114 85.366 27.660 -20.289 738 HG2 ARG 114 HG2 ARG 114 86.054 26.714 -22.470 739 HG3 ARG 114 HG3 ARG 114 85.460 28.154 -23.301 740 HD2 ARG 114 HD2 ARG 114 87.846 28.301 -23.128 741 HD3 ARG 114 HD3 ARG 114 87.132 29.534 -22.073 742 HE ARG 114 HE ARG 114 87.592 27.175 -20.538 743 HH11 ARG 114 HH11 ARG 114 89.541 29.627 -22.111 744 HH12 ARG 114 HH12 ARG 114 90.865 29.416 -20.998 745 HH21 ARG 114 HH21 ARG 114 89.311 26.964 -19.154 746 HH22 ARG 114 HH22 ARG 114 90.733 27.939 -19.371 Start of MODEL 17 1 H1 MET 1 H1 MET 1 3.756 -20.647 -86.093 2 H2 MET 1 H2 MET 1 2.690 -21.188 -84.977 3 H3 MET 1 H3 MET 1 3.846 -22.186 -85.540 4 HA MET 1 HA MET 1 4.440 -21.435 -83.318 5 HB2 MET 1 HB2 MET 1 6.225 -20.253 -85.499 6 HB3 MET 1 HB3 MET 1 6.667 -20.386 -83.798 7 HG2 MET 1 HG2 MET 1 6.455 -22.846 -83.910 8 HG3 MET 1 HG3 MET 1 6.040 -22.733 -85.627 9 HE1 MET 1 HE1 MET 1 7.890 -24.447 -86.294 10 HE2 MET 1 HE2 MET 1 9.591 -24.321 -85.795 11 HE3 MET 1 HE3 MET 1 8.331 -24.633 -84.580 12 H ARG 2 H ARG 2 3.913 -19.963 -81.820 13 HA ARG 2 HA ARG 2 3.913 -17.041 -82.411 14 HB2 ARG 2 HB2 ARG 2 1.547 -18.569 -81.214 15 HB3 ARG 2 HB3 ARG 2 1.718 -16.814 -81.207 16 HG2 ARG 2 HG2 ARG 2 1.823 -16.863 -83.730 17 HG3 ARG 2 HG3 ARG 2 1.380 -18.576 -83.665 18 HD2 ARG 2 HD2 ARG 2 -0.248 -16.270 -82.524 19 HD3 ARG 2 HD3 ARG 2 -0.555 -17.077 -84.069 20 HE ARG 2 HE ARG 2 -0.564 -19.133 -82.179 21 HH11 ARG 2 HH11 ARG 2 -2.512 -16.268 -82.717 22 HH12 ARG 2 HH12 ARG 2 -3.915 -16.965 -81.954 23 HH21 ARG 2 HH21 ARG 2 -2.388 -19.958 -81.203 24 HH22 ARG 2 HH22 ARG 2 -3.840 -19.007 -81.128 25 H GLY 3 H GLY 3 3.653 -15.756 -80.402 26 HA2 GLY 3 HA2 GLY 3 3.828 -15.314 -78.149 27 HA3 GLY 3 HA3 GLY 3 3.973 -17.036 -77.815 28 H SER 4 H SER 4 6.331 -15.688 -80.035 29 HA SER 4 HA SER 4 8.544 -16.145 -78.207 30 HB2 SER 4 HB2 SER 4 9.922 -15.216 -80.053 31 HB3 SER 4 HB3 SER 4 8.893 -16.575 -80.529 32 HG SER 4 HG SER 4 8.816 -14.847 -82.060 33 H HIS 5 H HIS 5 10.017 -14.619 -77.369 34 HA HIS 5 HA HIS 5 8.695 -12.257 -76.304 35 HB2 HIS 5 HB2 HIS 5 10.661 -12.088 -74.896 36 HB3 HIS 5 HB3 HIS 5 10.058 -13.740 -74.914 37 HD2 HIS 5 HD2 HIS 5 13.196 -11.786 -75.358 38 HE1 HIS 5 HE1 HIS 5 14.071 -15.542 -77.182 39 HE2 HIS 5 HE2 HIS 5 15.073 -13.358 -76.338 40 H HIS 6 H HIS 6 11.330 -12.787 -78.592 41 HA HIS 6 HA HIS 6 12.618 -11.485 -79.897 42 HB2 HIS 6 HB2 HIS 6 10.383 -10.965 -80.849 43 HB3 HIS 6 HB3 HIS 6 10.326 -9.507 -79.861 44 HD2 HIS 6 HD2 HIS 6 10.794 -7.481 -81.393 45 HE1 HIS 6 HE1 HIS 6 14.027 -9.018 -83.712 46 HE2 HIS 6 HE2 HIS 6 12.577 -6.972 -83.266 47 H HIS 7 H HIS 7 13.620 -9.245 -80.256 48 HA HIS 7 HA HIS 7 15.010 -8.565 -77.783 49 HB2 HIS 7 HB2 HIS 7 15.453 -7.659 -80.642 50 HB3 HIS 7 HB3 HIS 7 16.539 -7.355 -79.284 51 HD2 HIS 7 HD2 HIS 7 16.069 -9.763 -82.027 52 HE1 HIS 7 HE1 HIS 7 18.212 -12.009 -79.099 53 HE2 HIS 7 HE2 HIS 7 17.449 -11.954 -81.529 54 H HIS 8 H HIS 8 12.387 -7.721 -77.573 55 HA HIS 8 HA HIS 8 12.215 -4.806 -77.885 56 HB2 HIS 8 HB2 HIS 8 10.513 -6.894 -76.479 57 HB3 HIS 8 HB3 HIS 8 10.205 -5.171 -76.317 58 HD2 HIS 8 HD2 HIS 8 9.745 -3.774 -78.704 59 HE1 HIS 8 HE1 HIS 8 8.029 -7.157 -80.653 60 HE2 HIS 8 HE2 HIS 8 8.286 -4.625 -80.727 61 H HIS 9 H HIS 9 11.967 -3.352 -76.097 62 HA HIS 9 HA HIS 9 12.760 -2.220 -74.322 63 HB2 HIS 9 HB2 HIS 9 12.694 -4.851 -72.828 64 HB3 HIS 9 HB3 HIS 9 12.564 -3.230 -72.155 65 HD2 HIS 9 HD2 HIS 9 10.288 -1.773 -73.179 66 HE1 HIS 9 HE1 HIS 9 7.914 -5.307 -73.465 67 HE2 HIS 9 HE2 HIS 9 7.856 -2.761 -73.431 68 H HIS 10 H HIS 10 14.831 -3.447 -76.097 69 HA HIS 10 HA HIS 10 17.211 -3.281 -74.294 70 HB2 HIS 10 HB2 HIS 10 16.979 -4.195 -77.182 71 HB3 HIS 10 HB3 HIS 10 18.470 -4.112 -76.254 72 HD2 HIS 10 HD2 HIS 10 16.743 -5.475 -73.565 73 HE1 HIS 10 HE1 HIS 10 17.154 -8.938 -76.022 74 HE2 HIS 10 HE2 HIS 10 16.652 -8.102 -73.666 75 H GLY 11 H GLY 11 18.931 -1.877 -74.777 76 HA2 GLY 11 HA2 GLY 11 19.973 0.042 -75.538 77 HA3 GLY 11 HA3 GLY 11 18.788 0.179 -76.828 78 H SER 28 H SER 28 19.456 2.477 -75.999 79 HA SER 28 HA SER 28 17.167 3.617 -74.568 80 HB2 SER 28 HB2 SER 28 18.868 2.984 -72.783 81 HB3 SER 28 HB3 SER 28 19.974 4.158 -73.520 82 HG SER 28 HG SER 28 18.694 5.022 -71.762 83 H VAL 29 H VAL 29 17.389 6.074 -74.515 84 HA VAL 29 HA VAL 29 19.106 7.255 -76.589 85 HB VAL 29 HB VAL 29 17.122 6.606 -77.849 86 HG11 VAL 29 HG11 VAL 29 15.515 8.514 -76.103 87 HG12 VAL 29 HG12 VAL 29 14.949 7.643 -77.539 88 HG13 VAL 29 HG13 VAL 29 15.385 6.741 -76.083 89 HG21 VAL 29 HG21 VAL 29 18.399 8.629 -78.489 90 HG22 VAL 29 HG22 VAL 29 16.691 8.716 -78.943 91 HG23 VAL 29 HG23 VAL 29 17.271 9.629 -77.540 92 H SER 30 H SER 30 19.710 9.302 -76.187 93 HA SER 30 HA SER 30 18.366 11.027 -74.240 94 HB2 SER 30 HB2 SER 30 20.356 11.282 -72.810 95 HB3 SER 30 HB3 SER 30 19.722 9.632 -72.755 96 HG SER 30 HG SER 30 22.017 9.665 -72.979 97 H PHE 31 H PHE 31 19.412 13.173 -74.098 98 HA PHE 31 HA PHE 31 21.020 13.918 -76.500 99 HB2 PHE 31 HB2 PHE 31 18.524 15.355 -75.534 100 HB3 PHE 31 HB3 PHE 31 19.557 15.838 -76.871 101 HD1 PHE 31 HD2 PHE 31 19.689 14.385 -78.953 102 HD2 PHE 31 HD1 PHE 31 16.805 13.681 -75.822 103 HE1 PHE 31 HE2 PHE 31 18.355 12.966 -80.497 104 HE2 PHE 31 HE1 PHE 31 15.477 12.258 -77.368 105 HZ PHE 31 HZ PHE 31 16.252 11.896 -79.705 106 H GLY 32 H GLY 32 22.624 15.304 -76.130 107 HA2 GLY 32 HA2 GLY 32 24.059 16.763 -75.059 108 HA3 GLY 32 HA3 GLY 32 22.812 17.150 -73.881 109 H ALA 33 H ALA 33 25.433 16.938 -73.124 110 HA ALA 33 HA ALA 33 25.315 14.760 -71.136 111 HB1 ALA 33 HB1 ALA 33 27.667 15.088 -73.051 112 HB2 ALA 33 HB2 ALA 33 27.582 13.961 -71.677 113 HB3 ALA 33 HB3 ALA 33 26.494 13.755 -73.056 114 HA PRO 34 HA PRO 34 27.081 18.910 -69.679 115 HB2 PRO 34 HB2 PRO 34 25.172 19.657 -67.873 116 HB3 PRO 34 HB3 PRO 34 25.052 20.015 -69.624 117 HG2 PRO 34 HG2 PRO 34 23.789 17.699 -68.113 118 HG3 PRO 34 HG3 PRO 34 23.002 18.835 -69.255 119 HD2 PRO 34 HD2 PRO 34 23.887 16.393 -70.059 120 HD3 PRO 34 HD3 PRO 34 24.030 17.828 -71.118 121 H SER 35 H SER 35 28.404 19.036 -67.925 122 HA SER 35 HA SER 35 27.924 17.483 -65.468 123 HB2 SER 35 HB2 SER 35 29.059 15.909 -67.050 124 HB3 SER 35 HB3 SER 35 30.465 16.984 -67.056 125 HG SER 35 HG SER 35 30.560 15.251 -65.470 126 HA PRO 36 HA PRO 36 29.964 21.597 -64.887 127 HB2 PRO 36 HB2 PRO 36 28.254 22.714 -63.096 128 HB3 PRO 36 HB3 PRO 36 27.900 22.611 -64.845 129 HG2 PRO 36 HG2 PRO 36 26.930 20.757 -62.647 130 HG3 PRO 36 HG3 PRO 36 25.977 21.525 -63.954 131 HD2 PRO 36 HD2 PRO 36 26.942 18.959 -64.116 132 HD3 PRO 36 HD3 PRO 36 26.772 20.011 -65.553 133 H LEU 37 H LEU 37 31.781 20.648 -63.982 134 HA LEU 37 HA LEU 37 31.765 20.036 -61.049 135 HB2 LEU 37 HB2 LEU 37 33.555 19.026 -63.286 136 HB3 LEU 37 HB3 LEU 37 33.730 18.607 -61.586 137 HG LEU 37 HG LEU 37 31.315 17.907 -63.312 138 HD11 LEU 37 HD11 LEU 37 33.587 16.189 -62.224 139 HD12 LEU 37 HD12 LEU 37 32.175 15.609 -63.138 140 HD13 LEU 37 HD13 LEU 37 33.357 16.668 -63.922 141 HD21 LEU 37 HD21 LEU 37 30.638 18.124 -60.962 142 HD22 LEU 37 HD22 LEU 37 30.697 16.422 -61.417 143 HD23 LEU 37 HD23 LEU 37 32.014 17.120 -60.447 144 H SER 38 H SER 38 32.728 22.558 -63.002 145 HA SER 38 HA SER 38 35.332 23.070 -61.742 146 HB2 SER 38 HB2 SER 38 34.865 23.674 -64.100 147 HB3 SER 38 HB3 SER 38 33.682 24.874 -63.538 148 HG SER 38 HG SER 38 35.805 25.767 -63.904 149 H SER 39 H SER 39 35.767 24.377 -60.056 150 HA SER 39 HA SER 39 33.942 26.407 -59.040 151 HB2 SER 39 HB2 SER 39 33.707 25.441 -56.791 152 HB3 SER 39 HB3 SER 39 32.934 24.426 -58.013 153 HG SER 39 HG SER 39 34.181 23.186 -56.524 154 H GLU 40 H GLU 40 34.846 27.570 -57.163 155 HA GLU 40 HA GLU 40 37.765 27.238 -56.687 156 HB2 GLU 40 HB2 GLU 40 36.336 29.859 -57.283 157 HB3 GLU 40 HB3 GLU 40 37.957 29.748 -56.617 158 HG2 GLU 40 HG2 GLU 40 37.073 28.712 -59.344 159 HG3 GLU 40 HG3 GLU 40 37.954 30.201 -59.036 160 H SER 41 H SER 41 38.460 27.725 -54.627 161 HA SER 41 HA SER 41 36.431 28.374 -52.537 162 HB2 SER 41 HB2 SER 41 38.212 25.903 -52.555 163 HB3 SER 41 HB3 SER 41 37.184 26.428 -51.212 164 HG SER 41 HG SER 41 36.174 24.810 -52.512 165 H GLU 42 H GLU 42 37.223 29.067 -50.576 166 HA GLU 42 HA GLU 42 38.543 30.183 -49.130 167 HB2 GLU 42 HB2 GLU 42 40.575 28.081 -49.930 168 HB3 GLU 42 HB3 GLU 42 40.616 29.062 -48.461 169 HG2 GLU 42 HG2 GLU 42 38.435 28.119 -47.753 170 HG3 GLU 42 HG3 GLU 42 38.424 27.077 -49.179 171 H ASP 43 H ASP 43 38.658 31.307 -51.878 172 HA ASP 43 HA ASP 43 41.308 32.217 -52.386 173 HB2 ASP 43 HB2 ASP 43 39.479 31.998 -54.060 174 HB3 ASP 43 HB3 ASP 43 38.654 33.367 -53.315 175 H GLU 44 H GLU 44 38.928 33.472 -50.293 176 HA GLU 44 HA GLU 44 40.630 35.846 -49.604 177 HB2 GLU 44 HB2 GLU 44 38.432 36.205 -50.941 178 HB3 GLU 44 HB3 GLU 44 37.605 35.846 -49.425 179 HG2 GLU 44 HG2 GLU 44 38.751 37.787 -48.363 180 HG3 GLU 44 HG3 GLU 44 39.690 38.044 -49.833 181 H ILE 45 H ILE 45 40.020 32.956 -48.387 182 HA ILE 45 HA ILE 45 39.008 33.752 -45.703 183 HB ILE 45 HB ILE 45 39.349 30.997 -46.918 184 HG12 ILE 45 HG12 ILE 45 37.602 32.164 -48.136 185 HG13 ILE 45 HG13 ILE 45 36.908 30.926 -47.110 186 HG21 ILE 45 HG21 ILE 45 38.071 31.889 -44.299 187 HG22 ILE 45 HG22 ILE 45 37.877 30.276 -45.018 188 HG23 ILE 45 HG23 ILE 45 39.474 30.821 -44.516 189 HD11 ILE 45 HD11 ILE 45 36.889 33.926 -46.539 190 HD12 ILE 45 HD12 ILE 45 35.530 32.939 -47.095 191 HD13 ILE 45 HD13 ILE 45 36.195 32.675 -45.477 192 H ASN 46 H ASN 46 40.268 33.973 -44.040 193 HA ASN 46 HA ASN 46 42.092 34.037 -42.681 194 HB2 ASN 46 HB2 ASN 46 41.918 31.071 -43.326 195 HB3 ASN 46 HB3 ASN 46 42.763 31.751 -41.939 196 HD21 ASN 46 HD22 ASN 46 40.882 29.895 -41.403 197 HD22 ASN 46 HD21 ASN 46 39.475 30.675 -40.695 198 H TYR 47 H TYR 47 42.984 35.005 -45.050 199 HA TYR 47 HA TYR 47 45.301 33.549 -46.005 200 HB2 TYR 47 HB2 TYR 47 43.632 34.798 -47.407 201 HB3 TYR 47 HB3 TYR 47 44.350 36.298 -46.842 202 HD1 TYR 47 HD1 TYR 47 45.161 33.030 -48.518 203 HD2 TYR 47 HD2 TYR 47 46.241 37.181 -48.032 204 HE1 TYR 47 HE1 TYR 47 46.855 32.799 -50.325 205 HE2 TYR 47 HE2 TYR 47 47.933 36.949 -49.850 206 HH TYR 47 HH TYR 47 48.479 33.849 -51.576 207 H MET 48 H MET 48 46.065 33.697 -43.659 208 HA MET 48 HA MET 48 47.657 34.197 -42.163 209 HB2 MET 48 HB2 MET 48 49.074 35.580 -44.467 210 HB3 MET 48 HB3 MET 48 49.805 35.082 -42.942 211 HG2 MET 48 HG2 MET 48 49.193 32.721 -43.420 212 HG3 MET 48 HG3 MET 48 48.559 33.221 -44.993 213 HE1 MET 48 HE1 MET 48 50.049 31.381 -46.155 214 HE2 MET 48 HE2 MET 48 51.804 31.232 -45.916 215 HE3 MET 48 HE3 MET 48 50.695 30.901 -44.568 216 H THR 49 H THR 49 49.038 35.890 -41.061 217 HA THR 49 HA THR 49 47.750 38.562 -40.883 218 HB THR 49 HB THR 49 47.912 38.356 -38.364 219 HG1 THR 49 HG1 THR 49 47.958 36.264 -37.514 220 HG21 THR 49 HG21 THR 49 45.984 36.379 -39.653 221 HG22 THR 49 HG22 THR 49 45.808 37.180 -38.077 222 HG23 THR 49 HG23 THR 49 45.740 38.138 -39.565 223 HA PRO 50 HA PRO 50 51.943 39.945 -40.537 224 HB2 PRO 50 HB2 PRO 50 51.767 42.245 -39.049 225 HB3 PRO 50 HB3 PRO 50 51.167 42.106 -40.731 226 HG2 PRO 50 HG2 PRO 50 49.577 41.810 -38.159 227 HG3 PRO 50 HG3 PRO 50 49.184 42.815 -39.591 228 HD2 PRO 50 HD2 PRO 50 48.093 40.361 -39.254 229 HD3 PRO 50 HD3 PRO 50 48.597 40.917 -40.877 230 HA PRO 51 HA PRO 51 53.548 38.213 -36.789 231 HB2 PRO 51 HB2 PRO 51 56.101 39.183 -36.673 232 HB3 PRO 51 HB3 PRO 51 55.551 38.011 -37.911 233 HG2 PRO 51 HG2 PRO 51 55.766 41.030 -38.174 234 HG3 PRO 51 HG3 PRO 51 56.382 39.776 -39.297 235 HD2 PRO 51 HD2 PRO 51 54.001 41.025 -39.713 236 HD3 PRO 51 HD3 PRO 51 54.211 39.288 -40.092 237 H GLU 52 H GLU 52 53.554 38.581 -34.636 238 HA GLU 52 HA GLU 52 52.722 41.112 -33.614 239 HB2 GLU 52 HB2 GLU 52 53.659 38.685 -32.039 240 HB3 GLU 52 HB3 GLU 52 52.670 40.027 -31.474 241 HG2 GLU 52 HG2 GLU 52 50.975 38.605 -31.839 242 HG3 GLU 52 HG3 GLU 52 51.066 39.197 -33.490 243 H GLN 53 H GLN 53 53.797 42.744 -32.806 244 HA GLN 53 HA GLN 53 56.657 42.838 -32.829 245 HB2 GLN 53 HB2 GLN 53 56.424 45.151 -32.330 246 HB3 GLN 53 HB3 GLN 53 55.218 44.707 -33.518 247 HG2 GLN 53 HG2 GLN 53 54.659 45.071 -30.529 248 HG3 GLN 53 HG3 GLN 53 54.474 46.329 -31.729 249 HE21 GLN 53 HE22 GLN 53 52.340 45.469 -30.029 250 HE22 GLN 53 HE21 GLN 53 51.112 44.800 -31.112 251 H GLU 54 H GLU 54 54.503 42.129 -30.196 252 HA GLU 54 HA GLU 54 56.737 42.396 -28.212 253 HB2 GLU 54 HB2 GLU 54 55.289 43.596 -26.707 254 HB3 GLU 54 HB3 GLU 54 55.389 44.428 -28.255 255 HG2 GLU 54 HG2 GLU 54 53.160 43.347 -28.877 256 HG3 GLU 54 HG3 GLU 54 53.057 42.760 -27.219 257 H ALA 55 H ALA 55 54.754 40.143 -29.434 258 HA ALA 55 HA ALA 55 53.807 38.905 -26.941 259 HB1 ALA 55 HB1 ALA 55 53.558 37.960 -29.818 260 HB2 ALA 55 HB2 ALA 55 52.694 37.323 -28.407 261 HB3 ALA 55 HB3 ALA 55 52.379 38.980 -28.954 262 H GLN 56 H GLN 56 56.182 38.901 -26.251 263 HA GLN 56 HA GLN 56 57.216 36.180 -26.500 264 HB2 GLN 56 HB2 GLN 56 58.334 37.225 -28.402 265 HB3 GLN 56 HB3 GLN 56 58.948 38.521 -27.381 266 HG2 GLN 56 HG2 GLN 56 60.654 36.783 -27.876 267 HG3 GLN 56 HG3 GLN 56 60.377 36.949 -26.153 268 HE21 GLN 56 HE22 GLN 56 59.552 35.077 -24.951 269 HE22 GLN 56 HE21 GLN 56 59.285 33.561 -25.787 270 HA PRO 57 HA PRO 57 57.735 38.036 -22.333 271 HB2 PRO 57 HB2 PRO 57 56.056 36.537 -20.914 272 HB3 PRO 57 HB3 PRO 57 55.430 37.650 -22.186 273 HG2 PRO 57 HG2 PRO 57 55.967 34.669 -22.488 274 HG3 PRO 57 HG3 PRO 57 54.431 35.547 -22.798 275 HD2 PRO 57 HD2 PRO 57 56.329 35.069 -24.751 276 HD3 PRO 57 HD3 PRO 57 55.258 36.504 -24.758 277 H GLY 58 H GLY 58 58.158 36.494 -20.154 278 HA2 GLY 58 HA2 GLY 58 59.404 34.807 -19.132 279 HA3 GLY 58 HA3 GLY 58 59.709 34.073 -20.699 280 H ALA 59 H ALA 59 61.836 33.923 -21.004 281 HA ALA 59 HA ALA 59 64.059 34.227 -20.953 282 HB1 ALA 59 HB1 ALA 59 63.425 37.155 -21.215 283 HB2 ALA 59 HB2 ALA 59 64.934 36.326 -21.660 284 HB3 ALA 59 HB3 ALA 59 63.430 35.965 -22.548 285 H LEU 60 H LEU 60 63.353 33.623 -18.670 286 HA LEU 60 HA LEU 60 64.638 35.276 -16.553 287 HB2 LEU 60 HB2 LEU 60 63.120 32.630 -16.510 288 HB3 LEU 60 HB3 LEU 60 63.965 33.254 -15.116 289 HG LEU 60 HG LEU 60 61.658 33.691 -14.874 290 HD11 LEU 60 HD11 LEU 60 62.995 36.351 -15.496 291 HD12 LEU 60 HD12 LEU 60 61.643 36.052 -14.392 292 HD13 LEU 60 HD13 LEU 60 63.244 35.397 -14.013 293 HD21 LEU 60 HD21 LEU 60 61.005 33.794 -17.286 294 HD22 LEU 60 HD22 LEU 60 60.288 35.053 -16.264 295 HD23 LEU 60 HD23 LEU 60 61.643 35.463 -17.324 296 H ALA 61 H ALA 61 66.170 34.091 -15.059 297 HA ALA 61 HA ALA 61 67.929 32.154 -16.414 298 HB1 ALA 61 HB1 ALA 61 68.856 34.758 -15.130 299 HB2 ALA 61 HB2 ALA 61 69.931 33.448 -15.652 300 HB3 ALA 61 HB3 ALA 61 68.961 34.319 -16.850 301 H ALA 62 H ALA 62 69.109 30.809 -15.104 302 HA ALA 62 HA ALA 62 68.405 30.683 -12.212 303 HB1 ALA 62 HB1 ALA 62 69.776 28.652 -14.014 304 HB2 ALA 62 HB2 ALA 62 69.353 28.420 -12.306 305 HB3 ALA 62 HB3 ALA 62 68.070 28.627 -13.515 306 H LEU 63 H LEU 63 70.083 30.394 -10.652 307 HA LEU 63 HA LEU 63 72.727 31.607 -11.345 308 HB2 LEU 63 HB2 LEU 63 71.020 32.213 -8.902 309 HB3 LEU 63 HB3 LEU 63 72.612 32.876 -9.244 310 HG LEU 63 HG LEU 63 70.076 33.443 -10.845 311 HD11 LEU 63 HD11 LEU 63 71.705 35.179 -8.941 312 HD12 LEU 63 HD12 LEU 63 70.266 35.683 -9.854 313 HD13 LEU 63 HD13 LEU 63 70.120 34.457 -8.586 314 HD21 LEU 63 HD21 LEU 63 72.054 33.622 -12.307 315 HD22 LEU 63 HD22 LEU 63 71.438 35.228 -11.902 316 HD23 LEU 63 HD23 LEU 63 72.888 34.600 -11.086 317 H HIS 64 H HIS 64 74.445 31.144 -9.902 318 HA HIS 64 HA HIS 64 74.237 28.663 -8.265 319 HB2 HIS 64 HB2 HIS 64 76.477 30.472 -9.158 320 HB3 HIS 64 HB3 HIS 64 76.719 29.296 -7.871 321 HD2 HIS 64 HD2 HIS 64 77.000 29.694 -11.521 322 HE1 HIS 64 HE1 HIS 64 76.822 25.476 -10.958 323 HE2 HIS 64 HE2 HIS 64 77.395 27.314 -12.598 324 H ALA 65 H ALA 65 74.344 28.709 -6.018 325 HA ALA 65 HA ALA 65 73.571 31.320 -4.820 326 HB1 ALA 65 HB1 ALA 65 73.055 28.462 -3.916 327 HB2 ALA 65 HB2 ALA 65 72.361 29.939 -3.213 328 HB3 ALA 65 HB3 ALA 65 71.942 29.472 -4.871 329 H GLU 66 H GLU 66 76.339 29.335 -4.769 330 HA GLU 66 HA GLU 66 77.350 30.585 -2.289 331 HB2 GLU 66 HB2 GLU 66 77.965 28.474 -1.270 332 HB3 GLU 66 HB3 GLU 66 76.224 28.564 -1.499 333 HG2 GLU 66 HG2 GLU 66 76.413 27.107 -3.516 334 HG3 GLU 66 HG3 GLU 66 78.160 27.013 -3.276 335 H GLY 67 H GLY 67 79.667 30.069 -1.877 336 HA2 GLY 67 HA2 GLY 67 81.882 29.944 -2.531 337 HA3 GLY 67 HA3 GLY 67 81.357 29.002 -3.922 338 HA PRO 68 HA PRO 68 83.100 33.058 -5.396 339 HB2 PRO 68 HB2 PRO 68 84.499 32.125 -7.564 340 HB3 PRO 68 HB3 PRO 68 85.109 32.046 -5.884 341 HG2 PRO 68 HG2 PRO 68 83.685 29.864 -7.444 342 HG3 PRO 68 HG3 PRO 68 85.226 29.744 -6.534 343 HD2 PRO 68 HD2 PRO 68 82.882 28.976 -5.433 344 HD3 PRO 68 HD3 PRO 68 84.104 29.836 -4.447 345 H LEU 69 H LEU 69 81.003 30.716 -6.874 346 HA LEU 69 HA LEU 69 80.224 32.548 -9.073 347 HB2 LEU 69 HB2 LEU 69 79.435 29.686 -8.466 348 HB3 LEU 69 HB3 LEU 69 78.826 30.624 -9.825 349 HG LEU 69 HG LEU 69 81.753 29.915 -9.424 350 HD11 LEU 69 HD11 LEU 69 79.692 28.770 -11.337 351 HD12 LEU 69 HD12 LEU 69 81.406 28.311 -11.218 352 HD13 LEU 69 HD13 LEU 69 80.303 27.958 -9.880 353 HD21 LEU 69 HD21 LEU 69 81.566 31.949 -10.747 354 HD22 LEU 69 HD22 LEU 69 81.959 30.606 -11.815 355 HD23 LEU 69 HD23 LEU 69 80.296 31.219 -11.765 356 H ALA 70 H ALA 70 79.348 32.572 -5.872 357 HA ALA 70 HA ALA 70 76.536 32.377 -5.992 358 HB1 ALA 70 HB1 ALA 70 78.258 34.159 -4.208 359 HB2 ALA 70 HB2 ALA 70 76.567 33.702 -3.905 360 HB3 ALA 70 HB3 ALA 70 77.837 32.464 -3.893 361 H GLY 71 H GLY 71 75.163 33.392 -7.214 362 HA2 GLY 71 HA2 GLY 71 73.903 35.229 -8.011 363 HA3 GLY 71 HA3 GLY 71 75.244 36.325 -7.702 364 H LEU 72 H LEU 72 76.564 33.691 -9.323 365 HA LEU 72 HA LEU 72 76.480 35.033 -11.949 366 HB2 LEU 72 HB2 LEU 72 78.410 33.028 -10.683 367 HB3 LEU 72 HB3 LEU 72 78.487 33.477 -12.331 368 HG LEU 72 HG LEU 72 78.560 35.929 -11.569 369 HD11 LEU 72 HD11 LEU 72 79.455 34.674 -8.954 370 HD12 LEU 72 HD12 LEU 72 79.750 36.349 -9.436 371 HD13 LEU 72 HD13 LEU 72 78.105 35.803 -9.188 372 HD21 LEU 72 HD21 LEU 72 80.477 34.658 -12.551 373 HD22 LEU 72 HD22 LEU 72 80.997 35.858 -11.369 374 HD23 LEU 72 HD23 LEU 72 80.939 34.144 -10.915 375 HA PRO 73 HA PRO 73 73.843 32.262 -13.946 376 HB2 PRO 73 HB2 PRO 73 74.974 31.829 -16.437 377 HB3 PRO 73 HB3 PRO 73 74.280 33.397 -15.920 378 HG2 PRO 73 HG2 PRO 73 77.170 32.491 -15.887 379 HG3 PRO 73 HG3 PRO 73 76.507 34.037 -16.498 380 HD2 PRO 73 HD2 PRO 73 77.599 33.842 -14.073 381 HD3 PRO 73 HD3 PRO 73 76.167 34.873 -14.325 382 H VAL 74 H VAL 74 73.371 30.079 -14.748 383 HA VAL 74 HA VAL 74 75.495 28.083 -14.072 384 HB VAL 74 HB VAL 74 72.533 27.576 -14.370 385 HG11 VAL 74 HG11 VAL 74 74.780 25.957 -13.107 386 HG12 VAL 74 HG12 VAL 74 73.054 25.546 -13.059 387 HG13 VAL 74 HG13 VAL 74 73.903 25.558 -14.602 388 HG21 VAL 74 HG21 VAL 74 72.839 29.122 -12.484 389 HG22 VAL 74 HG22 VAL 74 72.465 27.507 -11.893 390 HG23 VAL 74 HG23 VAL 74 74.136 28.103 -11.831 391 H THR 75 H THR 75 73.306 29.071 -16.721 392 HA THR 75 HA THR 75 74.821 27.268 -18.580 393 HB THR 75 HB THR 75 72.867 27.011 -19.899 394 HG1 THR 75 HG1 THR 75 70.879 28.035 -19.051 395 HG21 THR 75 HG21 THR 75 71.948 26.745 -17.018 396 HG22 THR 75 HG22 THR 75 71.423 25.801 -18.434 397 HG23 THR 75 HG23 THR 75 73.081 25.630 -17.817 398 H ARG 76 H ARG 76 74.703 27.898 -20.923 399 HA ARG 76 HA ARG 76 75.848 30.485 -21.424 400 HB2 ARG 76 HB2 ARG 76 76.143 28.434 -22.815 401 HB3 ARG 76 HB3 ARG 76 74.446 28.497 -23.290 402 HG2 ARG 76 HG2 ARG 76 74.863 30.677 -24.443 403 HG3 ARG 76 HG3 ARG 76 76.572 30.584 -23.962 404 HD2 ARG 76 HD2 ARG 76 76.804 28.454 -25.201 405 HD3 ARG 76 HD3 ARG 76 75.099 28.502 -25.647 406 HE ARG 76 HE ARG 76 77.218 30.452 -26.546 407 HH11 ARG 76 HH11 ARG 76 74.143 28.913 -27.339 408 HH12 ARG 76 HH12 ARG 76 74.162 29.588 -28.943 409 HH21 ARG 76 HH21 ARG 76 77.229 31.146 -28.526 410 HH22 ARG 76 HH22 ARG 76 75.873 30.868 -29.604 411 H SER 77 H SER 77 72.501 29.294 -21.759 412 HA SER 77 HA SER 77 71.306 31.720 -22.679 413 HB2 SER 77 HB2 SER 77 70.086 29.544 -20.937 414 HB3 SER 77 HB3 SER 77 69.208 30.762 -21.883 415 HG SER 77 HG SER 77 69.386 28.748 -23.010 416 H ASP 78 H ASP 78 71.848 30.499 -19.287 417 HA ASP 78 HA ASP 78 70.694 32.778 -18.004 418 HB2 ASP 78 HB2 ASP 78 73.022 31.070 -17.079 419 HB3 ASP 78 HB3 ASP 78 72.123 32.204 -16.079 420 H ALA 79 H ALA 79 74.138 32.205 -19.011 421 HA ALA 79 HA ALA 79 75.116 34.696 -18.083 422 HB1 ALA 79 HB1 ALA 79 76.088 32.901 -20.360 423 HB2 ALA 79 HB2 ALA 79 77.021 34.210 -19.619 424 HB3 ALA 79 HB3 ALA 79 76.574 32.794 -18.647 425 H ARG 80 H ARG 80 73.750 33.919 -21.320 426 HA ARG 80 HA ARG 80 74.115 36.575 -22.419 427 HB2 ARG 80 HB2 ARG 80 72.188 34.305 -23.078 428 HB3 ARG 80 HB3 ARG 80 72.261 35.810 -24.003 429 HG2 ARG 80 HG2 ARG 80 74.581 35.413 -24.635 430 HG3 ARG 80 HG3 ARG 80 74.690 34.012 -23.569 431 HD2 ARG 80 HD2 ARG 80 74.412 33.239 -25.842 432 HD3 ARG 80 HD3 ARG 80 72.970 32.840 -24.893 433 HE ARG 80 HE ARG 80 72.903 35.370 -26.446 434 HH11 ARG 80 HH11 ARG 80 71.971 31.984 -26.518 435 HH12 ARG 80 HH12 ARG 80 70.768 32.256 -27.747 436 HH21 ARG 80 HH21 ARG 80 71.332 35.638 -27.990 437 HH22 ARG 80 HH22 ARG 80 70.433 34.268 -28.563 438 H VAL 81 H VAL 81 71.330 35.150 -20.663 439 HA VAL 81 HA VAL 81 69.649 37.487 -20.792 440 HB VAL 81 HB VAL 81 69.781 35.182 -18.818 441 HG11 VAL 81 HG11 VAL 81 67.692 37.405 -18.991 442 HG12 VAL 81 HG12 VAL 81 67.480 35.882 -18.106 443 HG13 VAL 81 HG13 VAL 81 68.720 37.022 -17.590 444 HG21 VAL 81 HG21 VAL 81 69.078 34.719 -21.179 445 HG22 VAL 81 HG22 VAL 81 67.809 34.405 -19.989 446 HG23 VAL 81 HG23 VAL 81 67.758 35.883 -20.985 447 H LEU 82 H LEU 82 71.903 36.409 -18.189 448 HA LEU 82 HA LEU 82 71.613 38.720 -16.572 449 HB2 LEU 82 HB2 LEU 82 73.665 36.540 -16.871 450 HB3 LEU 82 HB3 LEU 82 74.179 38.013 -16.064 451 HG LEU 82 HG LEU 82 72.383 37.875 -14.444 452 HD11 LEU 82 HD11 LEU 82 71.611 35.230 -15.724 453 HD12 LEU 82 HD12 LEU 82 70.988 35.873 -14.192 454 HD13 LEU 82 HD13 LEU 82 70.614 36.706 -15.702 455 HD21 LEU 82 HD21 LEU 82 74.586 36.698 -14.117 456 HD22 LEU 82 HD22 LEU 82 73.252 35.986 -13.205 457 HD23 LEU 82 HD23 LEU 82 73.800 35.208 -14.705 458 H ILE 83 H ILE 83 74.016 38.213 -19.234 459 HA ILE 83 HA ILE 83 75.248 40.774 -19.064 460 HB ILE 83 HB ILE 83 74.749 38.880 -21.377 461 HG12 ILE 83 HG12 ILE 83 77.346 39.803 -20.060 462 HG13 ILE 83 HG13 ILE 83 76.425 38.424 -19.476 463 HG21 ILE 83 HG21 ILE 83 76.233 41.548 -21.537 464 HG22 ILE 83 HG22 ILE 83 76.275 40.280 -22.776 465 HG23 ILE 83 HG23 ILE 83 74.771 41.108 -22.442 466 HD11 ILE 83 HD11 ILE 83 77.726 38.653 -22.217 467 HD12 ILE 83 HD12 ILE 83 78.204 37.609 -20.872 468 HD13 ILE 83 HD13 ILE 83 76.665 37.318 -21.704 469 H PHE 84 H PHE 84 72.329 39.842 -20.998 470 HA PHE 84 HA PHE 84 71.916 42.469 -21.965 471 HB2 PHE 84 HB2 PHE 84 70.965 40.275 -22.851 472 HB3 PHE 84 HB3 PHE 84 69.780 40.340 -21.564 473 HD1 PHE 84 HD1 PHE 84 71.207 42.869 -24.007 474 HD2 PHE 84 HD2 PHE 84 67.662 40.993 -22.408 475 HE1 PHE 84 HE1 PHE 84 69.852 44.083 -25.637 476 HE2 PHE 84 HE2 PHE 84 66.272 42.326 -23.976 477 HZ PHE 84 HZ PHE 84 67.354 43.860 -25.612 478 H ASN 85 H ASN 85 70.308 40.869 -19.154 479 HA ASN 85 HA ASN 85 68.614 43.119 -18.600 480 HB2 ASN 85 HB2 ASN 85 68.114 40.793 -17.937 481 HB3 ASN 85 HB3 ASN 85 69.488 40.789 -16.831 482 HD21 ASN 85 HD22 ASN 85 69.164 41.652 -14.730 483 HD22 ASN 85 HD21 ASN 85 67.666 42.438 -14.268 484 H GLU 86 H GLU 86 71.798 42.142 -17.202 485 HA GLU 86 HA GLU 86 71.886 44.300 -15.285 486 HB2 GLU 86 HB2 GLU 86 73.270 42.232 -15.144 487 HB3 GLU 86 HB3 GLU 86 74.200 42.781 -16.553 488 HG2 GLU 86 HG2 GLU 86 74.926 44.784 -15.316 489 HG3 GLU 86 HG3 GLU 86 73.920 44.327 -13.940 490 H TRP 87 H TRP 87 73.231 43.985 -18.685 491 HA TRP 87 HA TRP 87 74.255 46.642 -18.767 492 HB2 TRP 87 HB2 TRP 87 74.871 45.048 -20.449 493 HB3 TRP 87 HB3 TRP 87 73.189 44.782 -20.893 494 HD1 TRP 87 HD1 TRP 87 75.848 47.576 -21.167 495 HE1 TRP 87 HE1 TRP 87 75.397 48.868 -23.339 496 HE3 TRP 87 HE3 TRP 87 71.504 45.292 -22.590 497 HZ2 TRP 87 HZ2 TRP 87 73.496 48.830 -25.471 498 HZ3 TRP 87 HZ3 TRP 87 70.490 45.848 -24.745 499 HH2 TRP 87 HH2 TRP 87 71.441 47.615 -26.215 500 H GLU 88 H GLU 88 70.925 45.447 -19.703 501 HA GLU 88 HA GLU 88 69.969 47.958 -20.529 502 HB2 GLU 88 HB2 GLU 88 68.643 45.485 -19.394 503 HB3 GLU 88 HB3 GLU 88 67.696 46.927 -19.699 504 HG2 GLU 88 HG2 GLU 88 69.400 45.673 -21.871 505 HG3 GLU 88 HG3 GLU 88 67.744 45.184 -21.549 506 H GLU 89 H GLU 89 69.826 46.633 -17.117 507 HA GLU 89 HA GLU 89 68.518 48.930 -16.063 508 HB2 GLU 89 HB2 GLU 89 68.663 46.621 -15.082 509 HB3 GLU 89 HB3 GLU 89 70.376 46.907 -14.720 510 HG2 GLU 89 HG2 GLU 89 69.727 48.862 -13.348 511 HG3 GLU 89 HG3 GLU 89 68.028 48.551 -13.741 512 H ARG 90 H ARG 90 72.003 48.006 -16.053 513 HA ARG 90 HA ARG 90 73.012 50.363 -14.766 514 HB2 ARG 90 HB2 ARG 90 74.259 48.544 -16.866 515 HB3 ARG 90 HB3 ARG 90 75.152 49.790 -15.988 516 HG2 ARG 90 HG2 ARG 90 73.723 47.516 -14.599 517 HG3 ARG 90 HG3 ARG 90 75.369 47.402 -15.219 518 HD2 ARG 90 HD2 ARG 90 75.710 47.936 -12.980 519 HD3 ARG 90 HD3 ARG 90 75.911 49.482 -13.786 520 HE ARG 90 HE ARG 90 73.469 48.559 -12.284 521 HH11 ARG 90 HH11 ARG 90 75.375 51.365 -13.347 522 HH12 ARG 90 HH12 ARG 90 74.631 52.373 -12.136 523 HH21 ARG 90 HH21 ARG 90 72.523 49.963 -10.893 524 HH22 ARG 90 HH22 ARG 90 73.014 51.627 -10.845 525 H LYS 91 H LYS 91 72.654 49.627 -18.199 526 HA LYS 91 HA LYS 91 73.431 52.189 -19.174 527 HB2 LYS 91 HB2 LYS 91 73.218 50.055 -20.542 528 HB3 LYS 91 HB3 LYS 91 71.465 50.266 -20.484 529 HG2 LYS 91 HG2 LYS 91 72.053 52.625 -21.626 530 HG3 LYS 91 HG3 LYS 91 73.578 51.818 -21.985 531 HD2 LYS 91 HD2 LYS 91 72.298 51.313 -23.880 532 HD3 LYS 91 HD3 LYS 91 72.027 49.875 -22.879 533 HE2 LYS 91 HE2 LYS 91 69.926 51.078 -21.977 534 HE3 LYS 91 HE3 LYS 91 70.195 52.285 -23.240 535 HZ1 LYS 91 HZ1 LYS 91 69.516 49.409 -23.578 536 HZ2 LYS 91 HZ2 LYS 91 68.682 50.693 -24.112 537 HZ3 LYS 91 HZ3 LYS 91 70.094 50.311 -24.845 538 H LYS 92 H LYS 92 70.134 51.113 -18.152 539 HA LYS 92 HA LYS 92 68.812 53.544 -18.891 540 HB2 LYS 92 HB2 LYS 92 67.711 51.414 -18.139 541 HB3 LYS 92 HB3 LYS 92 68.209 51.780 -16.477 542 HG2 LYS 92 HG2 LYS 92 66.905 53.865 -16.530 543 HG3 LYS 92 HG3 LYS 92 66.482 53.572 -18.230 544 HD2 LYS 92 HD2 LYS 92 65.294 51.489 -17.570 545 HD3 LYS 92 HD3 LYS 92 65.712 51.795 -15.868 546 HE2 LYS 92 HE2 LYS 92 64.477 53.953 -15.956 547 HE3 LYS 92 HE3 LYS 92 64.075 53.663 -17.653 548 HZ1 LYS 92 HZ1 LYS 92 63.186 51.953 -15.378 549 HZ2 LYS 92 HZ2 LYS 92 62.246 53.009 -16.189 550 HZ3 LYS 92 HZ3 LYS 92 62.816 51.685 -16.951 551 H SER 93 H SER 93 70.822 52.748 -16.027 552 HA SER 93 HA SER 93 70.742 55.574 -15.143 553 HB2 SER 93 HB2 SER 93 72.464 53.264 -14.208 554 HB3 SER 93 HB3 SER 93 72.426 54.887 -13.493 555 HG SER 93 HG SER 93 70.994 53.474 -12.383 556 H GLU 94 H GLU 94 72.697 53.856 -17.414 557 HA GLU 94 HA GLU 94 74.793 55.983 -17.583 558 HB2 GLU 94 HB2 GLU 94 75.209 52.960 -17.576 559 HB3 GLU 94 HB3 GLU 94 76.446 54.187 -17.771 560 HG2 GLU 94 HG2 GLU 94 75.973 55.011 -15.469 561 HG3 GLU 94 HG3 GLU 94 74.749 53.751 -15.293 562 HA PRO 95 HA PRO 95 72.722 54.816 -21.602 563 HB2 PRO 95 HB2 PRO 95 72.771 57.312 -22.858 564 HB3 PRO 95 HB3 PRO 95 71.504 56.712 -21.749 565 HG2 PRO 95 HG2 PRO 95 73.912 58.433 -21.077 566 HG3 PRO 95 HG3 PRO 95 72.197 58.690 -20.608 567 HD2 PRO 95 HD2 PRO 95 73.901 57.551 -18.878 568 HD3 PRO 95 HD3 PRO 95 72.262 56.865 -19.068 569 H TRP 96 H TRP 96 75.911 55.675 -21.065 570 HA TRP 96 HA TRP 96 76.883 55.512 -23.850 571 HB2 TRP 96 HB2 TRP 96 79.078 55.893 -22.710 572 HB3 TRP 96 HB3 TRP 96 77.886 57.148 -22.429 573 HD1 TRP 96 HD1 TRP 96 79.653 54.271 -20.605 574 HE1 TRP 96 HE1 TRP 96 79.464 54.610 -18.066 575 HE3 TRP 96 HE3 TRP 96 76.483 58.301 -20.555 576 HZ2 TRP 96 HZ2 TRP 96 78.113 56.392 -16.247 577 HZ3 TRP 96 HZ3 TRP 96 75.750 59.289 -18.395 578 HH2 TRP 96 HH2 TRP 96 76.551 58.344 -16.241 579 H LEU 97 H LEU 97 76.079 53.176 -21.438 580 HA LEU 97 HA LEU 97 78.379 51.674 -21.321 581 HB2 LEU 97 HB2 LEU 97 76.262 51.708 -19.845 582 HB3 LEU 97 HB3 LEU 97 75.553 50.607 -21.006 583 HG LEU 97 HG LEU 97 77.401 49.016 -20.540 584 HD11 LEU 97 HD11 LEU 97 78.158 51.002 -18.353 585 HD12 LEU 97 HD12 LEU 97 78.743 49.328 -18.445 586 HD13 LEU 97 HD13 LEU 97 79.192 50.477 -19.700 587 HD21 LEU 97 HD21 LEU 97 75.211 48.927 -19.337 588 HD22 LEU 97 HD22 LEU 97 76.541 48.355 -18.309 589 HD23 LEU 97 HD23 LEU 97 75.885 49.999 -18.100 590 H ARG 98 H ARG 98 79.265 49.925 -22.295 591 HA ARG 98 HA ARG 98 78.352 49.160 -24.989 592 HB2 ARG 98 HB2 ARG 98 80.765 48.231 -23.382 593 HB3 ARG 98 HB3 ARG 98 80.493 47.953 -25.098 594 HG2 ARG 98 HG2 ARG 98 81.003 50.655 -23.773 595 HG3 ARG 98 HG3 ARG 98 82.139 49.714 -24.738 596 HD2 ARG 98 HD2 ARG 98 80.628 49.935 -26.709 597 HD3 ARG 98 HD3 ARG 98 79.555 50.976 -25.741 598 HE ARG 98 HE ARG 98 82.114 52.099 -25.528 599 HH11 ARG 98 HH11 ARG 98 79.865 51.562 -28.166 600 HH12 ARG 98 HH12 ARG 98 80.487 52.901 -29.088 601 HH21 ARG 98 HH21 ARG 98 82.859 53.791 -26.756 602 HH22 ARG 98 HH22 ARG 98 82.138 54.132 -28.301 603 H LEU 99 H LEU 99 78.157 47.025 -25.726 604 HA LEU 99 HA LEU 99 77.243 44.947 -23.800 605 HB2 LEU 99 HB2 LEU 99 75.422 46.393 -24.526 606 HB3 LEU 99 HB3 LEU 99 75.756 46.114 -26.200 607 HG LEU 99 HG LEU 99 73.722 44.994 -25.278 608 HD11 LEU 99 HD11 LEU 99 75.651 42.868 -26.227 609 HD12 LEU 99 HD12 LEU 99 73.934 43.093 -26.619 610 HD13 LEU 99 HD13 LEU 99 75.122 44.184 -27.290 611 HD21 LEU 99 HD21 LEU 99 74.819 44.448 -23.047 612 HD22 LEU 99 HD22 LEU 99 73.653 43.347 -23.745 613 HD23 LEU 99 HD23 LEU 99 75.413 42.982 -23.851 614 H ASP 100 H ASP 100 78.014 42.928 -24.389 615 HA ASP 100 HA ASP 100 78.525 42.309 -27.235 616 HB2 ASP 100 HB2 ASP 100 80.675 43.152 -26.292 617 HB3 ASP 100 HB3 ASP 100 80.619 41.879 -25.073 618 H MET 101 H MET 101 77.910 40.306 -27.759 619 HA MET 101 HA MET 101 77.243 38.324 -25.614 620 HB2 MET 101 HB2 MET 101 75.574 39.102 -28.038 621 HB3 MET 101 HB3 MET 101 75.228 37.736 -26.969 622 HG2 MET 101 HG2 MET 101 75.003 39.246 -25.046 623 HG3 MET 101 HG3 MET 101 75.342 40.637 -26.083 624 HE1 MET 101 HE1 MET 101 72.995 41.871 -25.268 625 HE2 MET 101 HE2 MET 101 71.517 40.891 -25.172 626 HE3 MET 101 HE3 MET 101 72.928 40.457 -24.182 627 H SER 102 H SER 102 79.310 38.759 -28.166 628 HA SER 102 HA SER 102 79.180 36.158 -29.452 629 HB2 SER 102 HB2 SER 102 81.480 38.112 -29.051 630 HB3 SER 102 HB3 SER 102 81.573 36.627 -30.019 631 HG SER 102 HG SER 102 81.049 38.512 -31.287 632 H ASP 103 H ASP 103 80.306 34.247 -28.919 633 HA ASP 103 HA ASP 103 80.052 33.632 -26.222 634 HB2 ASP 103 HB2 ASP 103 81.425 32.142 -28.477 635 HB3 ASP 103 HB3 ASP 103 81.222 31.464 -26.859 636 H LYS 104 H LYS 104 83.023 34.753 -27.737 637 HA LYS 104 HA LYS 104 84.892 34.057 -25.696 638 HB2 LYS 104 HB2 LYS 104 84.751 36.497 -27.520 639 HB3 LYS 104 HB3 LYS 104 86.133 36.089 -26.493 640 HG2 LYS 104 HG2 LYS 104 86.376 33.907 -27.650 641 HG3 LYS 104 HG3 LYS 104 85.026 34.322 -28.721 642 HD2 LYS 104 HD2 LYS 104 86.286 36.295 -29.552 643 HD3 LYS 104 HD3 LYS 104 87.646 35.870 -28.487 644 HE2 LYS 104 HE2 LYS 104 87.856 33.673 -29.639 645 HE3 LYS 104 HE3 LYS 104 86.505 34.094 -30.699 646 HZ1 LYS 104 HZ1 LYS 104 89.097 35.562 -30.580 647 HZ2 LYS 104 HZ2 LYS 104 88.642 34.545 -31.771 648 HZ3 LYS 104 HZ3 LYS 104 87.846 35.952 -31.561 649 H ALA 105 H ALA 105 82.456 36.652 -25.700 650 HA ALA 105 HA ALA 105 83.369 37.976 -23.306 651 HB1 ALA 105 HB1 ALA 105 80.565 37.784 -24.476 652 HB2 ALA 105 HB2 ALA 105 81.135 38.958 -23.278 653 HB3 ALA 105 HB3 ALA 105 81.795 38.985 -24.923 654 H ILE 106 H ILE 106 81.257 35.178 -23.864 655 HA ILE 106 HA ILE 106 80.479 34.913 -21.065 656 HB ILE 106 HB ILE 106 80.116 33.147 -23.514 657 HG12 ILE 106 HG12 ILE 106 77.738 33.629 -23.188 658 HG13 ILE 106 HG13 ILE 106 78.092 34.617 -21.771 659 HG21 ILE 106 HG21 ILE 106 79.164 32.601 -20.664 660 HG22 ILE 106 HG22 ILE 106 78.612 31.736 -22.115 661 HG23 ILE 106 HG23 ILE 106 80.294 31.610 -21.615 662 HD11 ILE 106 HD11 ILE 106 79.027 35.309 -24.586 663 HD12 ILE 106 HD12 ILE 106 77.525 35.902 -23.844 664 HD13 ILE 106 HD13 ILE 106 79.084 36.354 -23.146 665 H PHE 107 H PHE 107 82.801 33.193 -23.218 666 HA PHE 107 HA PHE 107 83.910 31.423 -21.319 667 HB2 PHE 107 HB2 PHE 107 85.490 32.981 -23.395 668 HB3 PHE 107 HB3 PHE 107 85.938 31.455 -22.660 669 HD1 PHE 107 HD1 PHE 107 82.824 30.418 -23.136 670 HD2 PHE 107 HD2 PHE 107 86.033 32.019 -25.522 671 HE1 PHE 107 HE1 PHE 107 81.956 29.197 -25.116 672 HE2 PHE 107 HE2 PHE 107 85.156 30.800 -27.516 673 HZ PHE 107 HZ PHE 107 83.122 29.380 -27.305 674 H ARG 108 H ARG 108 84.934 34.802 -22.003 675 HA ARG 108 HA ARG 108 87.038 34.777 -20.063 676 HB2 ARG 108 HB2 ARG 108 86.820 35.957 -22.285 677 HB3 ARG 108 HB3 ARG 108 85.766 37.143 -21.518 678 HG2 ARG 108 HG2 ARG 108 88.592 36.509 -20.570 679 HG3 ARG 108 HG3 ARG 108 88.248 37.666 -21.857 680 HD2 ARG 108 HD2 ARG 108 86.872 39.019 -20.296 681 HD3 ARG 108 HD3 ARG 108 87.311 37.915 -18.974 682 HE ARG 108 HE ARG 108 89.708 38.790 -20.210 683 HH11 ARG 108 HH11 ARG 108 87.184 40.200 -18.222 684 HH12 ARG 108 HH12 ARG 108 88.256 41.401 -17.557 685 HH21 ARG 108 HH21 ARG 108 91.016 40.345 -19.323 686 HH22 ARG 108 HH22 ARG 108 90.374 41.475 -18.170 687 H ARG 109 H ARG 109 83.728 36.159 -19.950 688 HA ARG 109 HA ARG 109 84.092 37.284 -17.274 689 HB2 ARG 109 HB2 ARG 109 82.553 38.171 -19.033 690 HB3 ARG 109 HB3 ARG 109 81.528 36.740 -18.831 691 HG2 ARG 109 HG2 ARG 109 81.087 37.353 -16.491 692 HG3 ARG 109 HG3 ARG 109 82.198 38.725 -16.607 693 HD2 ARG 109 HD2 ARG 109 79.682 38.383 -18.297 694 HD3 ARG 109 HD3 ARG 109 79.741 39.315 -16.808 695 HE ARG 109 HE ARG 109 80.831 40.057 -19.436 696 HH11 ARG 109 HH11 ARG 109 80.906 40.890 -16.027 697 HH12 ARG 109 HH12 ARG 109 81.537 42.482 -16.338 698 HH21 ARG 109 HH21 ARG 109 81.645 42.100 -19.755 699 HH22 ARG 109 HH22 ARG 109 81.938 43.144 -18.398 700 H TYR 110 H TYR 110 82.773 34.251 -18.524 701 HA TYR 110 HA TYR 110 82.340 33.228 -15.749 702 HB2 TYR 110 HB2 TYR 110 80.674 32.661 -18.219 703 HB3 TYR 110 HB3 TYR 110 80.400 32.059 -16.602 704 HD1 TYR 110 HD2 TYR 110 80.332 34.045 -14.725 705 HD2 TYR 110 HD1 TYR 110 79.311 34.417 -18.893 706 HE1 TYR 110 HE2 TYR 110 78.970 36.087 -14.219 707 HE2 TYR 110 HE1 TYR 110 77.892 36.404 -18.380 708 HH TYR 110 HH TYR 110 77.119 37.839 -16.732 709 HA PRO 111 HA PRO 111 85.409 30.604 -18.085 710 HB2 PRO 111 HB2 PRO 111 87.248 30.227 -16.081 711 HB3 PRO 111 HB3 PRO 111 87.197 31.684 -17.119 712 HG2 PRO 111 HG2 PRO 111 85.971 31.323 -14.361 713 HG3 PRO 111 HG3 PRO 111 87.033 32.653 -14.932 714 HD2 PRO 111 HD2 PRO 111 84.347 32.935 -14.905 715 HD3 PRO 111 HD3 PRO 111 85.308 33.576 -16.272 716 H HIS 112 H HIS 112 83.406 30.056 -15.324 717 HA HIS 112 HA HIS 112 83.954 27.203 -15.023 718 HB2 HIS 112 HB2 HIS 112 82.186 27.232 -13.494 719 HB3 HIS 112 HB3 HIS 112 82.947 28.801 -13.280 720 HD2 HIS 112 HD2 HIS 112 79.662 27.207 -13.767 721 HE1 HIS 112 HE1 HIS 112 78.916 31.182 -15.061 722 HE2 HIS 112 HE2 HIS 112 77.851 29.085 -14.284 723 H LEU 113 H LEU 113 82.053 29.154 -17.225 724 HA LEU 113 HA LEU 113 79.951 27.283 -17.598 725 HB2 LEU 113 HB2 LEU 113 80.129 29.897 -17.662 726 HB3 LEU 113 HB3 LEU 113 80.621 29.699 -19.331 727 HG LEU 113 HG LEU 113 78.258 30.309 -18.973 728 HD11 LEU 113 HD11 LEU 113 78.483 27.523 -20.187 729 HD12 LEU 113 HD12 LEU 113 77.312 28.782 -20.585 730 HD13 LEU 113 HD13 LEU 113 79.015 29.018 -20.993 731 HD21 LEU 113 HD21 LEU 113 78.000 28.949 -16.852 732 HD22 LEU 113 HD22 LEU 113 76.661 28.926 -17.979 733 HD23 LEU 113 HD23 LEU 113 77.750 27.525 -17.884 734 H ARG 114 H ARG 114 82.697 28.258 -19.636 735 HA ARG 114 HA ARG 114 82.771 25.650 -20.989 736 HB2 ARG 114 HB2 ARG 114 82.484 28.299 -22.452 737 HB3 ARG 114 HB3 ARG 114 83.230 26.898 -23.203 738 HG2 ARG 114 HG2 ARG 114 80.342 27.040 -22.233 739 HG3 ARG 114 HG3 ARG 114 80.904 27.175 -23.897 740 HD2 ARG 114 HD2 ARG 114 81.928 24.848 -23.652 741 HD3 ARG 114 HD3 ARG 114 81.102 24.726 -22.103 742 HE ARG 114 HE ARG 114 79.034 24.548 -23.156 743 HH11 ARG 114 HH11 ARG 114 81.458 25.099 -25.637 744 HH12 ARG 114 HH12 ARG 114 80.378 24.621 -26.916 745 HH21 ARG 114 HH21 ARG 114 77.728 23.943 -24.838 746 HH22 ARG 114 HH22 ARG 114 78.325 23.985 -26.470 Start of MODEL 18 1 H1 MET 1 H1 MET 1 141.223 50.642-103.514 2 H2 MET 1 H2 MET 1 142.267 49.445-103.135 3 H3 MET 1 H3 MET 1 142.666 50.993-102.816 4 HA MET 1 HA MET 1 142.033 49.881-100.770 5 HB2 MET 1 HB2 MET 1 139.960 51.939-101.680 6 HB3 MET 1 HB3 MET 1 140.158 51.374-100.024 7 HG2 MET 1 HG2 MET 1 142.217 52.922-101.636 8 HG3 MET 1 HG3 MET 1 141.228 53.520-100.314 9 HE1 MET 1 HE1 MET 1 143.371 54.547 -99.172 10 HE2 MET 1 HE2 MET 1 144.839 53.615 -98.802 11 HE3 MET 1 HE3 MET 1 144.384 53.919-100.493 12 H ARG 2 H ARG 2 140.389 48.829 -99.483 13 HA ARG 2 HA ARG 2 138.235 47.377-100.975 14 HB2 ARG 2 HB2 ARG 2 140.391 46.123 -99.206 15 HB3 ARG 2 HB3 ARG 2 138.934 45.292 -99.743 16 HG2 ARG 2 HG2 ARG 2 139.646 45.645-102.135 17 HG3 ARG 2 HG3 ARG 2 141.153 46.352-101.535 18 HD2 ARG 2 HD2 ARG 2 141.599 44.064-102.077 19 HD3 ARG 2 HD3 ARG 2 141.642 44.236-100.314 20 HE ARG 2 HE ARG 2 139.036 43.409-101.397 21 HH11 ARG 2 HH11 ARG 2 142.113 42.120-100.320 22 HH12 ARG 2 HH12 ARG 2 141.435 40.556 -99.955 23 HH21 ARG 2 HH21 ARG 2 138.231 41.402-100.892 24 HH22 ARG 2 HH22 ARG 2 139.291 40.165-100.284 25 H GLY 3 H GLY 3 136.745 46.261 -99.568 26 HA2 GLY 3 HA2 GLY 3 135.851 45.711 -97.433 27 HA3 GLY 3 HA3 GLY 3 136.555 47.154 -96.730 28 H SER 4 H SER 4 133.739 45.757 -97.683 29 HA SER 4 HA SER 4 132.167 48.125 -97.093 30 HB2 SER 4 HB2 SER 4 130.747 48.016 -99.104 31 HB3 SER 4 HB3 SER 4 132.410 48.465 -99.502 32 HG SER 4 HG SER 4 131.595 46.882-100.953 33 H HIS 5 H HIS 5 129.906 47.587 -96.651 34 HA HIS 5 HA HIS 5 129.097 44.754 -96.645 35 HB2 HIS 5 HB2 HIS 5 130.385 44.951 -94.549 36 HB3 HIS 5 HB3 HIS 5 129.408 46.334 -94.059 37 HD2 HIS 5 HD2 HIS 5 129.157 42.502 -94.597 38 HE1 HIS 5 HE1 HIS 5 125.787 43.644 -92.239 39 HE2 HIS 5 HE2 HIS 5 127.075 41.669 -93.209 40 H HIS 6 H HIS 6 126.978 44.532 -96.951 41 HA HIS 6 HA HIS 6 125.011 46.555 -96.051 42 HB2 HIS 6 HB2 HIS 6 125.319 45.685 -98.957 43 HB3 HIS 6 HB3 HIS 6 123.890 46.473 -98.300 44 HD2 HIS 6 HD2 HIS 6 127.348 47.224 -99.639 45 HE1 HIS 6 HE1 HIS 6 125.743 50.977 -98.392 46 HE2 HIS 6 HE2 HIS 6 127.636 49.848 -99.666 47 H HIS 7 H HIS 7 124.178 45.048 -94.582 48 HA HIS 7 HA HIS 7 122.313 43.128 -95.773 49 HB2 HIS 7 HB2 HIS 7 124.357 41.744 -95.462 50 HB3 HIS 7 HB3 HIS 7 124.376 42.169 -93.751 51 HD2 HIS 7 HD2 HIS 7 122.265 40.186 -96.334 52 HE1 HIS 7 HE1 HIS 7 121.065 38.842 -92.465 53 HE2 HIS 7 HE2 HIS 7 120.802 38.466 -94.971 54 H HIS 8 H HIS 8 120.460 43.001 -94.670 55 HA HIS 8 HA HIS 8 120.239 43.671 -91.804 56 HB2 HIS 8 HB2 HIS 8 118.644 45.119 -93.968 57 HB3 HIS 8 HB3 HIS 8 118.380 45.256 -92.235 58 HD2 HIS 8 HD2 HIS 8 120.372 46.509 -90.773 59 HE1 HIS 8 HE1 HIS 8 122.041 48.584 -94.108 60 HE2 HIS 8 HE2 HIS 8 121.979 48.445 -91.567 61 H HIS 9 H HIS 9 118.328 42.836 -90.834 62 HA HIS 9 HA HIS 9 116.253 41.594 -92.491 63 HB2 HIS 9 HB2 HIS 9 117.930 39.768 -92.212 64 HB3 HIS 9 HB3 HIS 9 117.786 39.922 -90.460 65 HD2 HIS 9 HD2 HIS 9 115.683 38.925 -93.577 66 HE1 HIS 9 HE1 HIS 9 113.731 37.233 -90.181 67 HE2 HIS 9 HE2 HIS 9 113.729 37.374 -92.723 68 H HIS 10 H HIS 10 114.277 41.658 -91.563 69 HA HIS 10 HA HIS 10 113.761 42.046 -88.723 70 HB2 HIS 10 HB2 HIS 10 112.848 44.327 -88.943 71 HB3 HIS 10 HB3 HIS 10 114.555 44.302 -89.320 72 HD2 HIS 10 HD2 HIS 10 111.133 44.966 -90.905 73 HE1 HIS 10 HE1 HIS 10 114.028 45.940 -93.884 74 HE2 HIS 10 HE2 HIS 10 111.559 46.044 -93.274 75 H GLY 11 H GLY 11 111.330 42.712 -88.449 76 HA2 GLY 11 HA2 GLY 11 109.121 42.777 -89.118 77 HA3 GLY 11 HA3 GLY 11 109.572 42.234 -90.729 78 H SER 28 H SER 28 110.597 40.194 -88.077 79 HA SER 28 HA SER 28 108.921 37.999 -88.991 80 HB2 SER 28 HB2 SER 28 110.167 36.717 -87.274 81 HB3 SER 28 HB3 SER 28 111.218 37.610 -88.385 82 HG SER 28 HG SER 28 111.854 37.853 -86.164 83 H VAL 29 H VAL 29 108.324 40.437 -86.700 84 HA VAL 29 HA VAL 29 107.009 38.799 -84.692 85 HB VAL 29 HB VAL 29 106.616 40.903 -83.505 86 HG11 VAL 29 HG11 VAL 29 109.450 40.726 -84.600 87 HG12 VAL 29 HG12 VAL 29 108.929 41.486 -83.084 88 HG13 VAL 29 HG13 VAL 29 108.778 39.734 -83.289 89 HG21 VAL 29 HG21 VAL 29 106.207 42.416 -85.443 90 HG22 VAL 29 HG22 VAL 29 107.440 43.037 -84.339 91 HG23 VAL 29 HG23 VAL 29 107.928 42.308 -85.878 92 H SER 30 H SER 30 105.760 39.750 -87.608 93 HA SER 30 HA SER 30 103.306 40.963 -86.878 94 HB2 SER 30 HB2 SER 30 104.018 39.501 -89.443 95 HB3 SER 30 HB3 SER 30 102.702 40.671 -89.230 96 HG SER 30 HG SER 30 104.605 41.642 -90.116 97 H PHE 31 H PHE 31 104.016 37.602 -86.645 98 HA PHE 31 HA PHE 31 101.366 36.632 -87.361 99 HB2 PHE 31 HB2 PHE 31 103.426 35.336 -87.745 100 HB3 PHE 31 HB3 PHE 31 103.689 35.226 -86.008 101 HD1 PHE 31 HD1 PHE 31 101.294 34.314 -88.749 102 HD2 PHE 31 HD2 PHE 31 102.625 33.496 -84.726 103 HE1 PHE 31 HE1 PHE 31 99.837 32.303 -88.672 104 HE2 PHE 31 HE2 PHE 31 101.168 31.485 -84.656 105 HZ PHE 31 HZ PHE 31 99.771 30.889 -86.627 106 H GLY 32 H GLY 32 99.815 35.680 -86.059 107 HA2 GLY 32 HA2 GLY 32 98.697 35.007 -84.150 108 HA3 GLY 32 HA3 GLY 32 99.966 35.662 -83.131 109 H ALA 33 H ALA 33 96.874 35.862 -83.364 110 HA ALA 33 HA ALA 33 96.656 38.657 -82.457 111 HB1 ALA 33 HB1 ALA 33 95.118 37.614 -84.877 112 HB2 ALA 33 HB2 ALA 33 94.853 39.178 -84.070 113 HB3 ALA 33 HB3 ALA 33 96.388 38.855 -84.892 114 HA PRO 34 HA PRO 34 93.904 35.549 -80.261 115 HB2 PRO 34 HB2 PRO 34 94.803 35.868 -77.704 116 HB3 PRO 34 HB3 PRO 34 95.610 34.801 -78.894 117 HG2 PRO 34 HG2 PRO 34 96.336 37.662 -78.168 118 HG3 PRO 34 HG3 PRO 34 97.419 36.236 -78.260 119 HD2 PRO 34 HD2 PRO 34 97.176 37.995 -80.327 120 HD3 PRO 34 HD3 PRO 34 97.387 36.242 -80.615 121 H SER 35 H SER 35 92.016 36.018 -79.183 122 HA SER 35 HA SER 35 91.488 38.784 -78.181 123 HB2 SER 35 HB2 SER 35 89.822 37.326 -80.265 124 HB3 SER 35 HB3 SER 35 89.372 38.839 -79.457 125 HG SER 35 HG SER 35 90.343 39.190 -81.522 126 HA PRO 36 HA PRO 36 89.609 35.399 -75.500 127 HB2 PRO 36 HB2 PRO 36 90.800 36.001 -73.112 128 HB3 PRO 36 HB3 PRO 36 91.559 34.959 -74.353 129 HG2 PRO 36 HG2 PRO 36 92.025 37.923 -73.878 130 HG3 PRO 36 HG3 PRO 36 93.248 36.628 -74.075 131 HD2 PRO 36 HD2 PRO 36 92.498 38.216 -76.154 132 HD3 PRO 36 HD3 PRO 36 92.860 36.480 -76.393 133 H LEU 37 H LEU 37 87.648 35.792 -74.647 134 HA LEU 37 HA LEU 37 87.043 38.195 -73.063 135 HB2 LEU 37 HB2 LEU 37 86.794 38.728 -75.570 136 HB3 LEU 37 HB3 LEU 37 85.426 37.634 -75.589 137 HG LEU 37 HG LEU 37 85.693 40.156 -73.881 138 HD11 LEU 37 HD11 LEU 37 84.057 39.623 -76.397 139 HD12 LEU 37 HD12 LEU 37 84.075 41.131 -75.454 140 HD13 LEU 37 HD13 LEU 37 85.534 40.608 -76.305 141 HD21 LEU 37 HD21 LEU 37 84.106 38.719 -72.754 142 HD22 LEU 37 HD22 LEU 37 83.190 39.936 -73.625 143 HD23 LEU 37 HD23 LEU 37 83.314 38.294 -74.295 144 H SER 38 H SER 38 86.102 37.305 -71.313 145 HA SER 38 HA SER 38 83.594 35.851 -71.612 146 HB2 SER 38 HB2 SER 38 84.200 33.987 -70.110 147 HB3 SER 38 HB3 SER 38 85.091 33.941 -71.637 148 HG SER 38 HG SER 38 86.459 33.538 -69.827 149 H SER 39 H SER 39 82.246 35.979 -69.811 150 HA SER 39 HA SER 39 83.187 36.863 -67.210 151 HB2 SER 39 HB2 SER 39 83.028 39.049 -68.414 152 HB3 SER 39 HB3 SER 39 81.319 38.721 -68.743 153 HG SER 39 HG SER 39 81.656 40.014 -66.837 154 H GLU 40 H GLU 40 81.946 35.874 -65.728 155 HA GLU 40 HA GLU 40 79.044 35.753 -65.935 156 HB2 GLU 40 HB2 GLU 40 79.719 33.719 -67.216 157 HB3 GLU 40 HB3 GLU 40 80.612 33.135 -65.810 158 HG2 GLU 40 HG2 GLU 40 78.514 33.030 -64.508 159 HG3 GLU 40 HG3 GLU 40 77.621 33.732 -65.862 160 H SER 41 H SER 41 78.304 36.223 -63.921 161 HA SER 41 HA SER 41 79.397 34.996 -61.522 162 HB2 SER 41 HB2 SER 41 80.974 36.933 -61.961 163 HB3 SER 41 HB3 SER 41 79.593 38.025 -61.757 164 HG SER 41 HG SER 41 80.827 37.688 -59.804 165 H GLU 42 H GLU 42 78.107 35.301 -59.700 166 HA GLU 42 HA GLU 42 76.113 35.330 -58.608 167 HB2 GLU 42 HB2 GLU 42 77.323 37.443 -58.194 168 HB3 GLU 42 HB3 GLU 42 76.335 38.245 -59.409 169 HG2 GLU 42 HG2 GLU 42 75.581 38.711 -57.113 170 HG3 GLU 42 HG3 GLU 42 74.321 37.925 -58.036 171 H ASP 43 H ASP 43 75.218 33.986 -60.482 172 HA ASP 43 HA ASP 43 72.919 35.136 -61.872 173 HB2 ASP 43 HB2 ASP 43 73.822 32.261 -61.499 174 HB3 ASP 43 HB3 ASP 43 72.472 32.777 -62.510 175 H GLU 44 H GLU 44 72.683 35.866 -59.298 176 HA GLU 44 HA GLU 44 71.619 35.851 -57.366 177 HB2 GLU 44 HB2 GLU 44 69.684 36.000 -59.123 178 HB3 GLU 44 HB3 GLU 44 69.256 34.398 -58.530 179 HG2 GLU 44 HG2 GLU 44 67.975 35.856 -57.216 180 HG3 GLU 44 HG3 GLU 44 69.329 35.472 -56.156 181 H ILE 45 H ILE 45 73.485 34.030 -57.329 182 HA ILE 45 HA ILE 45 72.459 31.487 -56.181 183 HB ILE 45 HB ILE 45 75.349 32.160 -56.784 184 HG12 ILE 45 HG12 ILE 45 74.205 32.323 -58.917 185 HG13 ILE 45 HG13 ILE 45 75.186 30.879 -58.853 186 HG21 ILE 45 HG21 ILE 45 73.879 29.522 -56.299 187 HG22 ILE 45 HG22 ILE 45 75.563 29.653 -56.850 188 HG23 ILE 45 HG23 ILE 45 75.108 30.259 -55.262 189 HD11 ILE 45 HD11 ILE 45 72.152 30.930 -58.491 190 HD12 ILE 45 HD12 ILE 45 73.024 30.471 -59.963 191 HD13 ILE 45 HD13 ILE 45 73.178 29.476 -58.512 192 H ASN 46 H ASN 46 71.668 33.407 -54.676 193 HA ASN 46 HA ASN 46 73.250 33.247 -52.195 194 HB2 ASN 46 HB2 ASN 46 73.257 35.646 -51.825 195 HB3 ASN 46 HB3 ASN 46 74.082 35.292 -53.339 196 HD21 ASN 46 HD22 ASN 46 73.083 35.985 -55.367 197 HD22 ASN 46 HD21 ASN 46 71.656 37.037 -55.334 198 H TYR 47 H TYR 47 72.016 33.143 -50.395 199 HA TYR 47 HA TYR 47 69.275 34.072 -50.206 200 HB2 TYR 47 HB2 TYR 47 68.319 31.781 -49.787 201 HB3 TYR 47 HB3 TYR 47 68.713 32.121 -51.452 202 HD1 TYR 47 HD1 TYR 47 69.690 30.140 -48.465 203 HD2 TYR 47 HD2 TYR 47 70.431 30.887 -52.652 204 HE1 TYR 47 HE1 TYR 47 71.054 28.066 -48.594 205 HE2 TYR 47 HE2 TYR 47 71.804 28.810 -52.776 206 HH TYR 47 HH TYR 47 72.334 26.692 -49.928 207 H MET 48 H MET 48 68.447 33.974 -48.094 208 HA MET 48 HA MET 48 69.731 32.413 -46.016 209 HB2 MET 48 HB2 MET 48 71.072 34.654 -46.185 210 HB3 MET 48 HB3 MET 48 69.631 35.410 -45.502 211 HG2 MET 48 HG2 MET 48 69.814 33.737 -43.579 212 HG3 MET 48 HG3 MET 48 71.334 33.195 -44.287 213 HE1 MET 48 HE1 MET 48 72.542 33.588 -41.969 214 HE2 MET 48 HE2 MET 48 72.450 35.108 -41.053 215 HE3 MET 48 HE3 MET 48 70.992 34.115 -41.276 216 H THR 49 H THR 49 68.268 31.927 -44.385 217 HA THR 49 HA THR 49 65.636 33.349 -44.275 218 HB THR 49 HB THR 49 64.584 31.054 -44.042 219 HG1 THR 49 HG1 THR 49 65.726 29.338 -44.946 220 HG21 THR 49 HG21 THR 49 65.857 31.649 -46.746 221 HG22 THR 49 HG22 THR 49 64.389 30.700 -46.432 222 HG23 THR 49 HG23 THR 49 64.400 32.438 -46.102 223 HA PRO 50 HA PRO 50 67.513 32.613 -40.080 224 HB2 PRO 50 HB2 PRO 50 67.564 35.153 -39.092 225 HB3 PRO 50 HB3 PRO 50 68.823 34.516 -40.194 226 HG2 PRO 50 HG2 PRO 50 66.394 36.193 -40.914 227 HG3 PRO 50 HG3 PRO 50 68.099 36.451 -41.401 228 HD2 PRO 50 HD2 PRO 50 66.292 35.171 -43.007 229 HD3 PRO 50 HD3 PRO 50 68.017 34.711 -42.966 230 HA PRO 51 HA PRO 51 63.442 32.683 -38.160 231 HB2 PRO 51 HB2 PRO 51 64.024 32.056 -35.576 232 HB3 PRO 51 HB3 PRO 51 64.225 30.887 -36.917 233 HG2 PRO 51 HG2 PRO 51 66.353 32.646 -35.648 234 HG3 PRO 51 HG3 PRO 51 66.427 30.886 -35.980 235 HD2 PRO 51 HD2 PRO 51 67.498 32.744 -37.680 236 HD3 PRO 51 HD3 PRO 51 66.748 31.235 -38.283 237 H GLU 52 H GLU 52 62.078 34.056 -37.004 238 HA GLU 52 HA GLU 52 63.193 36.675 -36.180 239 HB2 GLU 52 HB2 GLU 52 60.334 35.696 -36.496 240 HB3 GLU 52 HB3 GLU 52 60.805 37.338 -36.036 241 HG2 GLU 52 HG2 GLU 52 62.094 37.552 -38.169 242 HG3 GLU 52 HG3 GLU 52 61.511 35.961 -38.663 243 H GLN 53 H GLN 53 62.076 33.808 -34.636 244 HA GLN 53 HA GLN 53 61.662 33.191 -32.498 245 HB2 GLN 53 HB2 GLN 53 64.157 33.596 -32.778 246 HB3 GLN 53 HB3 GLN 53 63.951 35.060 -31.814 247 HG2 GLN 53 HG2 GLN 53 63.093 33.659 -29.922 248 HG3 GLN 53 HG3 GLN 53 63.222 32.219 -30.935 249 HE21 GLN 53 HE22 GLN 53 65.128 34.774 -29.275 250 HE22 GLN 53 HE21 GLN 53 66.624 33.836 -29.274 251 H GLU 54 H GLU 54 59.682 34.904 -33.054 252 HA GLU 54 HA GLU 54 59.443 37.198 -31.393 253 HB2 GLU 54 HB2 GLU 54 58.147 36.686 -33.454 254 HB3 GLU 54 HB3 GLU 54 57.243 35.452 -32.569 255 HG2 GLU 54 HG2 GLU 54 56.319 37.180 -31.069 256 HG3 GLU 54 HG3 GLU 54 57.319 38.415 -31.844 257 H ALA 55 H ALA 55 58.765 33.829 -30.651 258 HA ALA 55 HA ALA 55 57.320 34.374 -28.164 259 HB1 ALA 55 HB1 ALA 55 58.295 31.777 -29.419 260 HB2 ALA 55 HB2 ALA 55 57.210 31.925 -28.019 261 HB3 ALA 55 HB3 ALA 55 56.682 32.502 -29.609 262 H GLN 56 H GLN 56 59.180 35.778 -27.483 263 HA GLN 56 HA GLN 56 60.954 34.231 -25.667 264 HB2 GLN 56 HB2 GLN 56 62.917 35.509 -26.254 265 HB3 GLN 56 HB3 GLN 56 62.265 34.685 -27.664 266 HG2 GLN 56 HG2 GLN 56 61.200 36.859 -28.394 267 HG3 GLN 56 HG3 GLN 56 61.971 37.662 -27.040 268 HE21 GLN 56 HE22 GLN 56 62.688 38.884 -29.195 269 HE22 GLN 56 HE21 GLN 56 64.257 38.361 -29.788 270 HA PRO 57 HA PRO 57 59.000 38.251 -24.030 271 HB2 PRO 57 HB2 PRO 57 56.833 37.520 -22.603 272 HB3 PRO 57 HB3 PRO 57 56.814 37.589 -24.404 273 HG2 PRO 57 HG2 PRO 57 57.297 35.124 -22.683 274 HG3 PRO 57 HG3 PRO 57 56.066 35.344 -23.972 275 HD2 PRO 57 HD2 PRO 57 58.485 34.227 -24.522 276 HD3 PRO 57 HD3 PRO 57 57.681 35.350 -25.664 277 H GLY 58 H GLY 58 59.420 39.200 -22.056 278 HA2 GLY 58 HA2 GLY 58 60.288 39.494 -19.934 279 HA3 GLY 58 HA3 GLY 58 59.916 37.813 -19.570 280 H ALA 59 H ALA 59 62.013 38.334 -18.348 281 HA ALA 59 HA ALA 59 64.254 37.086 -19.837 282 HB1 ALA 59 HB1 ALA 59 64.489 39.718 -18.313 283 HB2 ALA 59 HB2 ALA 59 65.845 38.772 -18.965 284 HB3 ALA 59 HB3 ALA 59 64.657 39.490 -20.069 285 H LEU 60 H LEU 60 64.282 35.233 -18.724 286 HA LEU 60 HA LEU 60 64.652 35.280 -15.752 287 HB2 LEU 60 HB2 LEU 60 63.103 33.284 -17.458 288 HB3 LEU 60 HB3 LEU 60 63.624 32.962 -15.824 289 HG LEU 60 HG LEU 60 61.348 33.448 -15.741 290 HD11 LEU 60 HD11 LEU 60 62.740 35.954 -14.726 291 HD12 LEU 60 HD12 LEU 60 61.206 35.268 -14.161 292 HD13 LEU 60 HD13 LEU 60 62.716 34.379 -13.894 293 HD21 LEU 60 HD21 LEU 60 61.161 34.777 -17.864 294 HD22 LEU 60 HD22 LEU 60 60.213 35.382 -16.495 295 HD23 LEU 60 HD23 LEU 60 61.710 36.202 -16.945 296 H ALA 61 H ALA 61 66.176 33.954 -14.896 297 HA ALA 61 HA ALA 61 67.722 32.080 -16.522 298 HB1 ALA 61 HB1 ALA 61 68.920 34.591 -15.265 299 HB2 ALA 61 HB2 ALA 61 69.878 33.230 -15.885 300 HB3 ALA 61 HB3 ALA 61 68.870 34.172 -16.993 301 H ALA 62 H ALA 62 69.116 30.727 -15.300 302 HA ALA 62 HA ALA 62 68.508 30.509 -12.392 303 HB1 ALA 62 HB1 ALA 62 69.887 28.562 -14.274 304 HB2 ALA 62 HB2 ALA 62 69.513 28.281 -12.562 305 HB3 ALA 62 HB3 ALA 62 68.196 28.478 -13.734 306 H LEU 63 H LEU 63 70.164 30.355 -10.862 307 HA LEU 63 HA LEU 63 72.867 31.389 -11.589 308 HB2 LEU 63 HB2 LEU 63 71.101 32.311 -9.285 309 HB3 LEU 63 HB3 LEU 63 72.785 32.765 -9.506 310 HG LEU 63 HG LEU 63 70.508 33.516 -11.397 311 HD11 LEU 63 HD11 LEU 63 72.094 35.190 -9.405 312 HD12 LEU 63 HD12 LEU 63 70.815 35.769 -10.494 313 HD13 LEU 63 HD13 LEU 63 70.416 34.641 -9.189 314 HD21 LEU 63 HD21 LEU 63 72.559 33.440 -12.674 315 HD22 LEU 63 HD22 LEU 63 72.250 35.132 -12.284 316 HD23 LEU 63 HD23 LEU 63 73.469 34.235 -11.370 317 H HIS 64 H HIS 64 74.521 30.901 -10.048 318 HA HIS 64 HA HIS 64 74.161 28.416 -8.472 319 HB2 HIS 64 HB2 HIS 64 76.478 30.239 -9.123 320 HB3 HIS 64 HB3 HIS 64 76.623 28.956 -7.930 321 HD2 HIS 64 HD2 HIS 64 76.977 29.637 -11.572 322 HE1 HIS 64 HE1 HIS 64 76.862 25.386 -11.279 323 HE2 HIS 64 HE2 HIS 64 77.420 27.338 -12.794 324 H ALA 65 H ALA 65 74.149 28.348 -6.225 325 HA ALA 65 HA ALA 65 73.427 30.915 -4.907 326 HB1 ALA 65 HB1 ALA 65 72.789 28.033 -4.177 327 HB2 ALA 65 HB2 ALA 65 72.128 29.492 -3.409 328 HB3 ALA 65 HB3 ALA 65 71.737 29.134 -5.101 329 H GLU 66 H GLU 66 76.124 28.843 -4.910 330 HA GLU 66 HA GLU 66 77.123 29.917 -2.345 331 HB2 GLU 66 HB2 GLU 66 77.662 27.731 -1.443 332 HB3 GLU 66 HB3 GLU 66 75.928 27.885 -1.693 333 HG2 GLU 66 HG2 GLU 66 76.112 26.544 -3.790 334 HG3 GLU 66 HG3 GLU 66 77.850 26.386 -3.528 335 H GLY 67 H GLY 67 79.420 29.310 -1.931 336 HA2 GLY 67 HA2 GLY 67 81.640 29.150 -2.562 337 HA3 GLY 67 HA3 GLY 67 81.112 28.342 -4.033 338 HA PRO 68 HA PRO 68 82.996 32.469 -5.102 339 HB2 PRO 68 HB2 PRO 68 84.483 31.680 -7.269 340 HB3 PRO 68 HB3 PRO 68 85.013 31.467 -5.574 341 HG2 PRO 68 HG2 PRO 68 83.638 29.429 -7.358 342 HG3 PRO 68 HG3 PRO 68 85.134 29.219 -6.388 343 HD2 PRO 68 HD2 PRO 68 82.734 28.404 -5.454 344 HD3 PRO 68 HD3 PRO 68 83.917 29.175 -4.353 345 H LEU 69 H LEU 69 80.961 30.269 -6.868 346 HA LEU 69 HA LEU 69 80.300 32.266 -8.952 347 HB2 LEU 69 HB2 LEU 69 79.512 29.373 -8.553 348 HB3 LEU 69 HB3 LEU 69 78.844 30.385 -9.825 349 HG LEU 69 HG LEU 69 81.819 29.843 -9.555 350 HD11 LEU 69 HD11 LEU 69 79.765 28.534 -11.371 351 HD12 LEU 69 HD12 LEU 69 81.519 28.235 -11.361 352 HD13 LEU 69 HD13 LEU 69 80.538 27.769 -9.968 353 HD21 LEU 69 HD21 LEU 69 81.349 31.880 -10.842 354 HD22 LEU 69 HD22 LEU 69 81.871 30.592 -11.925 355 HD23 LEU 69 HD23 LEU 69 80.150 31.007 -11.830 356 H ALA 70 H ALA 70 79.284 32.065 -5.791 357 HA ALA 70 HA ALA 70 76.485 31.923 -6.025 358 HB1 ALA 70 HB1 ALA 70 78.155 33.547 -4.052 359 HB2 ALA 70 HB2 ALA 70 76.451 33.084 -3.843 360 HB3 ALA 70 HB3 ALA 70 77.710 31.837 -3.884 361 H GLY 71 H GLY 71 75.154 33.046 -7.200 362 HA2 GLY 71 HA2 GLY 71 73.950 34.963 -7.897 363 HA3 GLY 71 HA3 GLY 71 75.311 36.003 -7.495 364 H LEU 72 H LEU 72 76.532 33.390 -9.273 365 HA LEU 72 HA LEU 72 76.480 34.893 -11.827 366 HB2 LEU 72 HB2 LEU 72 78.506 32.910 -10.678 367 HB3 LEU 72 HB3 LEU 72 78.561 33.516 -12.286 368 HG LEU 72 HG LEU 72 78.452 35.900 -11.199 369 HD11 LEU 72 HD11 LEU 72 79.754 34.373 -8.916 370 HD12 LEU 72 HD12 LEU 72 79.699 36.128 -9.115 371 HD13 LEU 72 HD13 LEU 72 78.213 35.242 -8.823 372 HD21 LEU 72 HD21 LEU 72 80.352 35.042 -12.513 373 HD22 LEU 72 HD22 LEU 72 80.922 35.965 -11.127 374 HD23 LEU 72 HD23 LEU 72 80.973 34.191 -11.083 375 HA PRO 73 HA PRO 73 73.900 32.157 -13.860 376 HB2 PRO 73 HB2 PRO 73 74.817 32.042 -16.440 377 HB3 PRO 73 HB3 PRO 73 74.213 33.555 -15.689 378 HG2 PRO 73 HG2 PRO 73 77.084 32.589 -15.942 379 HG3 PRO 73 HG3 PRO 73 76.424 34.192 -16.396 380 HD2 PRO 73 HD2 PRO 73 77.627 33.802 -14.050 381 HD3 PRO 73 HD3 PRO 73 76.180 34.847 -14.150 382 H VAL 74 H VAL 74 73.451 30.077 -14.928 383 HA VAL 74 HA VAL 74 75.574 28.060 -14.345 384 HB VAL 74 HB VAL 74 72.620 27.554 -14.686 385 HG11 VAL 74 HG11 VAL 74 74.863 25.897 -13.466 386 HG12 VAL 74 HG12 VAL 74 73.137 25.480 -13.447 387 HG13 VAL 74 HG13 VAL 74 73.998 25.550 -14.981 388 HG21 VAL 74 HG21 VAL 74 72.906 29.032 -12.743 389 HG22 VAL 74 HG22 VAL 74 72.532 27.396 -12.215 390 HG23 VAL 74 HG23 VAL 74 74.202 27.993 -12.118 391 H THR 75 H THR 75 73.386 29.058 -17.016 392 HA THR 75 HA THR 75 74.995 27.334 -18.876 393 HB THR 75 HB THR 75 73.073 27.062 -20.243 394 HG1 THR 75 HG1 THR 75 71.048 28.020 -19.427 395 HG21 THR 75 HG21 THR 75 72.111 26.704 -17.388 396 HG22 THR 75 HG22 THR 75 71.635 25.781 -18.834 397 HG23 THR 75 HG23 THR 75 73.288 25.641 -18.190 398 H ARG 76 H ARG 76 74.830 28.039 -21.254 399 HA ARG 76 HA ARG 76 75.990 30.667 -21.590 400 HB2 ARG 76 HB2 ARG 76 74.677 28.756 -23.596 401 HB3 ARG 76 HB3 ARG 76 75.498 30.250 -24.051 402 HG2 ARG 76 HG2 ARG 76 77.624 29.434 -23.157 403 HG3 ARG 76 HG3 ARG 76 76.846 27.958 -22.567 404 HD2 ARG 76 HD2 ARG 76 78.030 27.486 -24.620 405 HD3 ARG 76 HD3 ARG 76 76.304 27.266 -24.859 406 HE ARG 76 HE ARG 76 77.948 29.616 -25.827 407 HH11 ARG 76 HH11 ARG 76 75.033 27.688 -26.333 408 HH12 ARG 76 HH12 ARG 76 74.703 28.501 -27.837 409 HH21 ARG 76 HH21 ARG 76 77.539 30.476 -27.680 410 HH22 ARG 76 HH22 ARG 76 76.093 30.073 -28.596 411 H SER 77 H SER 77 72.678 29.443 -22.067 412 HA SER 77 HA SER 77 71.440 31.874 -22.876 413 HB2 SER 77 HB2 SER 77 70.243 29.609 -21.233 414 HB3 SER 77 HB3 SER 77 69.354 30.837 -22.154 415 HG SER 77 HG SER 77 69.591 28.865 -23.341 416 H ASP 78 H ASP 78 71.952 30.518 -19.529 417 HA ASP 78 HA ASP 78 70.733 32.733 -18.180 418 HB2 ASP 78 HB2 ASP 78 73.043 30.985 -17.280 419 HB3 ASP 78 HB3 ASP 78 72.140 32.088 -16.250 420 H ALA 79 H ALA 79 74.201 32.221 -19.109 421 HA ALA 79 HA ALA 79 75.119 34.692 -18.053 422 HB1 ALA 79 HB1 ALA 79 76.218 32.989 -20.342 423 HB2 ALA 79 HB2 ALA 79 77.099 34.276 -19.498 424 HB3 ALA 79 HB3 ALA 79 76.619 32.817 -18.612 425 H ARG 80 H ARG 80 73.822 34.002 -21.337 426 HA ARG 80 HA ARG 80 74.183 36.689 -22.312 427 HB2 ARG 80 HB2 ARG 80 73.771 34.637 -23.699 428 HB3 ARG 80 HB3 ARG 80 72.081 34.646 -23.167 429 HG2 ARG 80 HG2 ARG 80 71.770 36.892 -24.187 430 HG3 ARG 80 HG3 ARG 80 73.489 36.931 -24.631 431 HD2 ARG 80 HD2 ARG 80 73.158 34.954 -26.084 432 HD3 ARG 80 HD3 ARG 80 71.434 34.926 -25.648 433 HE ARG 80 HE ARG 80 72.023 37.525 -26.617 434 HH11 ARG 80 HH11 ARG 80 71.845 34.287 -27.954 435 HH12 ARG 80 HH12 ARG 80 71.477 34.868 -29.553 436 HH21 ARG 80 HH21 ARG 80 71.560 38.201 -28.691 437 HH22 ARG 80 HH22 ARG 80 71.314 37.030 -29.949 438 H VAL 81 H VAL 81 71.395 35.195 -20.602 439 HA VAL 81 HA VAL 81 69.717 37.546 -20.653 440 HB VAL 81 HB VAL 81 69.850 35.218 -18.705 441 HG11 VAL 81 HG11 VAL 81 67.821 37.493 -18.867 442 HG12 VAL 81 HG12 VAL 81 67.524 35.966 -18.014 443 HG13 VAL 81 HG13 VAL 81 68.803 37.040 -17.457 444 HG21 VAL 81 HG21 VAL 81 69.110 34.751 -21.056 445 HG22 VAL 81 HG22 VAL 81 67.865 34.449 -19.836 446 HG23 VAL 81 HG23 VAL 81 67.797 35.920 -20.840 447 H LEU 82 H LEU 82 71.993 36.379 -18.104 448 HA LEU 82 HA LEU 82 71.672 38.646 -16.438 449 HB2 LEU 82 HB2 LEU 82 73.818 36.533 -16.748 450 HB3 LEU 82 HB3 LEU 82 74.171 37.952 -15.787 451 HG LEU 82 HG LEU 82 73.461 36.192 -14.347 452 HD11 LEU 82 HD11 LEU 82 71.142 38.152 -14.449 453 HD12 LEU 82 HD12 LEU 82 71.806 37.321 -13.041 454 HD13 LEU 82 HD13 LEU 82 72.764 38.577 -13.842 455 HD21 LEU 82 HD21 LEU 82 72.052 34.811 -15.706 456 HD22 LEU 82 HD22 LEU 82 71.126 35.339 -14.306 457 HD23 LEU 82 HD23 LEU 82 70.840 36.106 -15.875 458 H ILE 83 H ILE 83 74.125 38.202 -19.051 459 HA ILE 83 HA ILE 83 75.293 40.787 -18.891 460 HB ILE 83 HB ILE 83 74.780 38.912 -21.214 461 HG12 ILE 83 HG12 ILE 83 77.392 39.846 -19.940 462 HG13 ILE 83 HG13 ILE 83 76.500 38.450 -19.351 463 HG21 ILE 83 HG21 ILE 83 76.223 41.603 -21.364 464 HG22 ILE 83 HG22 ILE 83 76.265 40.353 -22.621 465 HG23 ILE 83 HG23 ILE 83 74.753 41.152 -22.250 466 HD11 ILE 83 HD11 ILE 83 77.750 38.731 -22.111 467 HD12 ILE 83 HD12 ILE 83 78.235 37.649 -20.796 468 HD13 ILE 83 HD13 ILE 83 76.687 37.390 -21.617 469 H PHE 84 H PHE 84 72.363 39.797 -20.776 470 HA PHE 84 HA PHE 84 71.873 42.391 -21.773 471 HB2 PHE 84 HB2 PHE 84 70.919 40.179 -22.602 472 HB3 PHE 84 HB3 PHE 84 69.798 40.222 -21.257 473 HD1 PHE 84 HD1 PHE 84 71.043 42.738 -23.806 474 HD2 PHE 84 HD2 PHE 84 67.625 40.872 -21.943 475 HE1 PHE 84 HE1 PHE 84 69.571 44.009 -25.282 476 HE2 PHE 84 HE2 PHE 84 66.124 42.225 -23.388 477 HZ PHE 84 HZ PHE 84 67.081 43.787 -25.071 478 H ASN 85 H ASN 85 70.439 40.834 -18.868 479 HA ASN 85 HA ASN 85 68.666 43.021 -18.298 480 HB2 ASN 85 HB2 ASN 85 68.261 40.692 -17.591 481 HB3 ASN 85 HB3 ASN 85 69.702 40.729 -16.570 482 HD21 ASN 85 HD22 ASN 85 66.482 42.303 -17.018 483 HD22 ASN 85 HD21 ASN 85 66.318 42.707 -15.319 484 H GLU 86 H GLU 86 71.902 42.144 -16.916 485 HA GLU 86 HA GLU 86 71.948 44.397 -15.103 486 HB2 GLU 86 HB2 GLU 86 74.216 42.715 -16.246 487 HB3 GLU 86 HB3 GLU 86 74.410 43.991 -15.044 488 HG2 GLU 86 HG2 GLU 86 72.806 42.800 -13.534 489 HG3 GLU 86 HG3 GLU 86 72.752 41.459 -14.675 490 H TRP 87 H TRP 87 73.257 43.983 -18.505 491 HA TRP 87 HA TRP 87 74.215 46.673 -18.672 492 HB2 TRP 87 HB2 TRP 87 74.857 45.049 -20.325 493 HB3 TRP 87 HB3 TRP 87 73.177 44.731 -20.737 494 HD1 TRP 87 HD1 TRP 87 75.780 47.572 -21.158 495 HE1 TRP 87 HE1 TRP 87 75.230 48.772 -23.360 496 HE3 TRP 87 HE3 TRP 87 71.361 45.243 -22.296 497 HZ2 TRP 87 HZ2 TRP 87 73.168 48.743 -25.340 498 HZ3 TRP 87 HZ3 TRP 87 70.196 45.794 -24.371 499 HH2 TRP 87 HH2 TRP 87 71.047 47.552 -25.915 500 H GLU 88 H GLU 88 70.912 45.325 -19.470 501 HA GLU 88 HA GLU 88 69.795 47.727 -20.387 502 HB2 GLU 88 HB2 GLU 88 68.698 45.249 -19.082 503 HB3 GLU 88 HB3 GLU 88 67.649 46.641 -19.176 504 HG2 GLU 88 HG2 GLU 88 69.071 45.651 -21.660 505 HG3 GLU 88 HG3 GLU 88 67.577 44.912 -21.092 506 H GLU 89 H GLU 89 69.857 46.631 -16.905 507 HA GLU 89 HA GLU 89 68.581 49.066 -15.988 508 HB2 GLU 89 HB2 GLU 89 70.403 47.117 -14.517 509 HB3 GLU 89 HB3 GLU 89 69.516 48.449 -13.761 510 HG2 GLU 89 HG2 GLU 89 67.377 47.465 -14.668 511 HG3 GLU 89 HG3 GLU 89 68.297 46.048 -15.177 512 H ARG 90 H ARG 90 72.059 48.149 -16.083 513 HA ARG 90 HA ARG 90 73.076 50.601 -14.983 514 HB2 ARG 90 HB2 ARG 90 74.328 48.641 -16.959 515 HB3 ARG 90 HB3 ARG 90 75.218 49.932 -16.140 516 HG2 ARG 90 HG2 ARG 90 73.708 47.793 -14.633 517 HG3 ARG 90 HG3 ARG 90 75.376 47.579 -15.182 518 HD2 ARG 90 HD2 ARG 90 76.061 49.571 -13.876 519 HD3 ARG 90 HD3 ARG 90 74.389 49.777 -13.309 520 HE ARG 90 HE ARG 90 75.150 47.137 -12.668 521 HH11 ARG 90 HH11 ARG 90 76.138 50.351 -11.678 522 HH12 ARG 90 HH12 ARG 90 76.643 49.813 -10.099 523 HH21 ARG 90 HH21 ARG 90 75.818 46.512 -10.640 524 HH22 ARG 90 HH22 ARG 90 76.462 47.688 -9.533 525 H LYS 91 H LYS 91 72.607 49.640 -18.325 526 HA LYS 91 HA LYS 91 73.417 52.146 -19.478 527 HB2 LYS 91 HB2 LYS 91 73.427 49.951 -20.662 528 HB3 LYS 91 HB3 LYS 91 71.680 49.937 -20.682 529 HG2 LYS 91 HG2 LYS 91 73.077 52.265 -22.009 530 HG3 LYS 91 HG3 LYS 91 73.186 50.676 -22.755 531 HD2 LYS 91 HD2 LYS 91 70.611 50.546 -22.521 532 HD3 LYS 91 HD3 LYS 91 70.654 52.290 -22.278 533 HE2 LYS 91 HE2 LYS 91 71.902 50.835 -24.668 534 HE3 LYS 91 HE3 LYS 91 70.226 51.367 -24.642 535 HZ1 LYS 91 HZ1 LYS 91 72.569 53.216 -24.440 536 HZ2 LYS 91 HZ2 LYS 91 71.614 53.001 -25.742 537 HZ3 LYS 91 HZ3 LYS 91 70.982 53.667 -24.401 538 H LYS 92 H LYS 92 70.158 51.066 -18.418 539 HA LYS 92 HA LYS 92 68.861 53.498 -19.360 540 HB2 LYS 92 HB2 LYS 92 68.163 51.441 -17.244 541 HB3 LYS 92 HB3 LYS 92 67.191 52.899 -17.483 542 HG2 LYS 92 HG2 LYS 92 66.720 52.358 -19.778 543 HG3 LYS 92 HG3 LYS 92 67.874 51.025 -19.784 544 HD2 LYS 92 HD2 LYS 92 66.476 49.827 -18.087 545 HD3 LYS 92 HD3 LYS 92 65.279 51.145 -18.185 546 HE2 LYS 92 HE2 LYS 92 65.038 50.727 -20.631 547 HE3 LYS 92 HE3 LYS 92 66.245 49.442 -20.534 548 HZ1 LYS 92 HZ1 LYS 92 63.586 49.405 -19.192 549 HZ2 LYS 92 HZ2 LYS 92 64.037 48.502 -20.480 550 HZ3 LYS 92 HZ3 LYS 92 64.721 48.231 -19.031 551 H SER 93 H SER 93 70.797 52.813 -16.428 552 HA SER 93 HA SER 93 70.591 55.650 -15.623 553 HB2 SER 93 HB2 SER 93 72.474 53.469 -14.686 554 HB3 SER 93 HB3 SER 93 72.370 55.105 -14.016 555 HG SER 93 HG SER 93 71.077 53.602 -12.832 556 H GLU 94 H GLU 94 72.688 53.889 -17.780 557 HA GLU 94 HA GLU 94 74.534 56.210 -18.189 558 HB2 GLU 94 HB2 GLU 94 75.261 53.253 -17.990 559 HB3 GLU 94 HB3 GLU 94 76.354 54.591 -18.298 560 HG2 GLU 94 HG2 GLU 94 75.737 55.529 -16.040 561 HG3 GLU 94 HG3 GLU 94 74.784 54.063 -15.763 562 HA PRO 95 HA PRO 95 72.387 54.654 -21.990 563 HB2 PRO 95 HB2 PRO 95 72.473 57.027 -23.500 564 HB3 PRO 95 HB3 PRO 95 71.189 56.522 -22.363 565 HG2 PRO 95 HG2 PRO 95 73.564 58.323 -21.826 566 HG3 PRO 95 HG3 PRO 95 71.849 58.569 -21.358 567 HD2 PRO 95 HD2 PRO 95 73.603 57.618 -19.567 568 HD3 PRO 95 HD3 PRO 95 71.982 56.872 -19.680 569 H TRP 96 H TRP 96 75.590 55.892 -21.797 570 HA TRP 96 HA TRP 96 76.445 55.306 -24.526 571 HB2 TRP 96 HB2 TRP 96 78.675 55.887 -23.538 572 HB3 TRP 96 HB3 TRP 96 77.446 57.120 -23.338 573 HD1 TRP 96 HD1 TRP 96 79.414 54.533 -21.302 574 HE1 TRP 96 HE1 TRP 96 79.298 55.123 -18.803 575 HE3 TRP 96 HE3 TRP 96 76.078 58.420 -21.536 576 HZ2 TRP 96 HZ2 TRP 96 77.902 57.000 -17.120 577 HZ3 TRP 96 HZ3 TRP 96 75.356 59.575 -19.458 578 HH2 TRP 96 HH2 TRP 96 76.251 58.873 -17.250 579 H LEU 97 H LEU 97 75.893 53.190 -21.827 580 HA LEU 97 HA LEU 97 78.251 51.773 -21.756 581 HB2 LEU 97 HB2 LEU 97 76.265 51.822 -20.127 582 HB3 LEU 97 HB3 LEU 97 75.485 50.668 -21.185 583 HG LEU 97 HG LEU 97 77.352 49.102 -20.790 584 HD11 LEU 97 HD11 LEU 97 78.309 51.186 -18.782 585 HD12 LEU 97 HD12 LEU 97 78.883 49.507 -18.846 586 HD13 LEU 97 HD13 LEU 97 79.212 50.591 -20.194 587 HD21 LEU 97 HD21 LEU 97 75.287 49.066 -19.383 588 HD22 LEU 97 HD22 LEU 97 76.709 48.542 -18.464 589 HD23 LEU 97 HD23 LEU 97 76.069 50.190 -18.257 590 H ARG 98 H ARG 98 79.172 50.071 -22.740 591 HA ARG 98 HA ARG 98 78.211 49.107 -25.300 592 HB2 ARG 98 HB2 ARG 98 80.566 49.670 -24.715 593 HB3 ARG 98 HB3 ARG 98 80.587 48.341 -23.563 594 HG2 ARG 98 HG2 ARG 98 81.791 47.735 -25.540 595 HG3 ARG 98 HG3 ARG 98 80.378 46.707 -25.411 596 HD2 ARG 98 HD2 ARG 98 79.960 49.174 -27.034 597 HD3 ARG 98 HD3 ARG 98 81.233 48.122 -27.655 598 HE ARG 98 HE ARG 98 79.316 46.275 -27.331 599 HH11 ARG 98 HH11 ARG 98 79.277 49.317 -29.079 600 HH12 ARG 98 HH12 ARG 98 78.060 48.751 -30.188 601 HH21 ARG 98 HH21 ARG 98 77.708 45.681 -28.640 602 HH22 ARG 98 HH22 ARG 98 77.213 46.702 -29.976 603 H LEU 99 H LEU 99 77.636 47.095 -25.908 604 HA LEU 99 HA LEU 99 77.003 44.990 -23.875 605 HB2 LEU 99 HB2 LEU 99 75.120 46.381 -24.634 606 HB3 LEU 99 HB3 LEU 99 75.403 45.970 -26.287 607 HG LEU 99 HG LEU 99 73.438 44.897 -25.163 608 HD11 LEU 99 HD11 LEU 99 75.343 42.750 -26.120 609 HD12 LEU 99 HD12 LEU 99 73.599 42.942 -26.428 610 HD13 LEU 99 HD13 LEU 99 74.736 44.006 -27.213 611 HD21 LEU 99 HD21 LEU 99 74.724 44.467 -22.976 612 HD22 LEU 99 HD22 LEU 99 73.453 43.399 -23.517 613 HD23 LEU 99 HD23 LEU 99 75.178 42.936 -23.748 614 H ASP 100 H ASP 100 77.771 42.944 -24.409 615 HA ASP 100 HA ASP 100 78.255 42.222 -27.223 616 HB2 ASP 100 HB2 ASP 100 80.372 43.291 -26.462 617 HB3 ASP 100 HB3 ASP 100 80.473 42.127 -25.139 618 H MET 101 H MET 101 77.860 40.101 -27.594 619 HA MET 101 HA MET 101 77.308 38.283 -25.274 620 HB2 MET 101 HB2 MET 101 75.542 38.868 -27.683 621 HB3 MET 101 HB3 MET 101 75.253 37.563 -26.526 622 HG2 MET 101 HG2 MET 101 75.034 39.164 -24.692 623 HG3 MET 101 HG3 MET 101 75.363 40.508 -25.791 624 HE1 MET 101 HE1 MET 101 73.010 41.720 -24.890 625 HE2 MET 101 HE2 MET 101 71.523 40.756 -24.822 626 HE3 MET 101 HE3 MET 101 72.920 40.294 -23.822 627 H SER 102 H SER 102 79.244 38.520 -27.964 628 HA SER 102 HA SER 102 79.053 35.861 -29.074 629 HB2 SER 102 HB2 SER 102 81.387 37.808 -28.920 630 HB3 SER 102 HB3 SER 102 81.376 36.301 -29.861 631 HG SER 102 HG SER 102 80.768 38.158 -31.125 632 H ASP 103 H ASP 103 80.286 33.984 -28.597 633 HA ASP 103 HA ASP 103 80.226 33.365 -25.905 634 HB2 ASP 103 HB2 ASP 103 81.555 31.976 -28.245 635 HB3 ASP 103 HB3 ASP 103 81.586 31.297 -26.620 636 H LYS 104 H LYS 104 83.099 34.611 -27.562 637 HA LYS 104 HA LYS 104 85.050 34.020 -25.560 638 HB2 LYS 104 HB2 LYS 104 84.774 36.392 -27.459 639 HB3 LYS 104 HB3 LYS 104 86.186 36.098 -26.434 640 HG2 LYS 104 HG2 LYS 104 86.526 33.884 -27.510 641 HG3 LYS 104 HG3 LYS 104 85.156 34.206 -28.589 642 HD2 LYS 104 HD2 LYS 104 86.336 36.189 -29.516 643 HD3 LYS 104 HD3 LYS 104 87.659 35.937 -28.374 644 HE2 LYS 104 HE2 LYS 104 88.412 35.085 -30.453 645 HE3 LYS 104 HE3 LYS 104 88.112 33.698 -29.405 646 HZ1 LYS 104 HZ1 LYS 104 86.254 34.668 -31.533 647 HZ2 LYS 104 HZ2 LYS 104 87.232 33.374 -31.667 648 HZ3 LYS 104 HZ3 LYS 104 86.001 33.342 -30.602 649 H ALA 105 H ALA 105 82.596 36.605 -25.612 650 HA ALA 105 HA ALA 105 83.532 37.982 -23.248 651 HB1 ALA 105 HB1 ALA 105 80.735 37.845 -24.445 652 HB2 ALA 105 HB2 ALA 105 81.345 39.050 -23.296 653 HB3 ALA 105 HB3 ALA 105 82.013 38.978 -24.935 654 H ILE 106 H ILE 106 81.413 35.197 -23.762 655 HA ILE 106 HA ILE 106 80.541 35.046 -20.980 656 HB ILE 106 HB ILE 106 80.224 33.225 -23.389 657 HG12 ILE 106 HG12 ILE 106 77.844 33.709 -23.083 658 HG13 ILE 106 HG13 ILE 106 78.189 34.694 -21.661 659 HG21 ILE 106 HG21 ILE 106 79.264 32.686 -20.541 660 HG22 ILE 106 HG22 ILE 106 78.711 31.818 -21.991 661 HG23 ILE 106 HG23 ILE 106 80.394 31.694 -21.493 662 HD11 ILE 106 HD11 ILE 106 79.129 35.375 -24.475 663 HD12 ILE 106 HD12 ILE 106 77.643 35.996 -23.725 664 HD13 ILE 106 HD13 ILE 106 79.216 36.426 -23.041 665 H PHE 107 H PHE 107 82.916 33.194 -22.971 666 HA PHE 107 HA PHE 107 83.976 31.574 -20.906 667 HB2 PHE 107 HB2 PHE 107 85.590 32.976 -23.070 668 HB3 PHE 107 HB3 PHE 107 86.043 31.524 -22.206 669 HD1 PHE 107 HD1 PHE 107 83.055 30.267 -22.597 670 HD2 PHE 107 HD2 PHE 107 86.078 31.985 -25.145 671 HE1 PHE 107 HE1 PHE 107 82.245 28.881 -24.486 672 HE2 PHE 107 HE2 PHE 107 85.262 30.589 -27.048 673 HZ PHE 107 HZ PHE 107 83.351 29.030 -26.709 674 H ARG 108 H ARG 108 85.011 34.901 -21.832 675 HA ARG 108 HA ARG 108 87.088 35.030 -19.880 676 HB2 ARG 108 HB2 ARG 108 86.849 36.107 -22.134 677 HB3 ARG 108 HB3 ARG 108 85.745 37.288 -21.444 678 HG2 ARG 108 HG2 ARG 108 88.532 36.877 -20.287 679 HG3 ARG 108 HG3 ARG 108 88.314 37.716 -21.813 680 HD2 ARG 108 HD2 ARG 108 88.454 39.446 -20.288 681 HD3 ARG 108 HD3 ARG 108 86.725 39.320 -20.643 682 HE ARG 108 HE ARG 108 87.371 37.733 -18.328 683 HH11 ARG 108 HH11 ARG 108 87.111 41.134 -19.149 684 HH12 ARG 108 HH12 ARG 108 86.711 41.585 -17.515 685 HH21 ARG 108 HH21 ARG 108 86.860 38.359 -16.296 686 HH22 ARG 108 HH22 ARG 108 86.586 40.038 -15.928 687 H ARG 109 H ARG 109 83.732 36.300 -19.798 688 HA ARG 109 HA ARG 109 84.090 37.488 -17.135 689 HB2 ARG 109 HB2 ARG 109 82.562 38.369 -18.872 690 HB3 ARG 109 HB3 ARG 109 81.561 36.913 -18.733 691 HG2 ARG 109 HG2 ARG 109 81.019 37.451 -16.414 692 HG3 ARG 109 HG3 ARG 109 82.134 38.822 -16.417 693 HD2 ARG 109 HD2 ARG 109 79.715 38.618 -18.269 694 HD3 ARG 109 HD3 ARG 109 79.667 39.363 -16.680 695 HE ARG 109 HE ARG 109 81.147 41.089 -17.349 696 HH11 ARG 109 HH11 ARG 109 80.274 39.162 -20.154 697 HH12 ARG 109 HH12 ARG 109 80.569 40.487 -21.248 698 HH21 ARG 109 HH21 ARG 109 81.588 42.673 -18.797 699 HH22 ARG 109 HH22 ARG 109 81.365 42.403 -20.498 700 H TYR 110 H TYR 110 82.835 34.420 -18.350 701 HA TYR 110 HA TYR 110 82.403 33.408 -15.571 702 HB2 TYR 110 HB2 TYR 110 80.773 32.766 -18.047 703 HB3 TYR 110 HB3 TYR 110 80.494 32.212 -16.414 704 HD1 TYR 110 HD1 TYR 110 80.239 34.160 -14.590 705 HD2 TYR 110 HD2 TYR 110 79.508 34.562 -18.819 706 HE1 TYR 110 HE1 TYR 110 78.816 36.178 -14.162 707 HE2 TYR 110 HE2 TYR 110 78.011 36.516 -18.380 708 HH TYR 110 HH TYR 110 77.451 37.804 -15.090 709 HA PRO 111 HA PRO 111 85.592 30.912 -17.848 710 HB2 PRO 111 HB2 PRO 111 87.264 30.346 -15.738 711 HB3 PRO 111 HB3 PRO 111 87.296 31.878 -16.660 712 HG2 PRO 111 HG2 PRO 111 85.864 31.315 -14.041 713 HG3 PRO 111 HG3 PRO 111 86.957 32.684 -14.432 714 HD2 PRO 111 HD2 PRO 111 84.279 32.966 -14.576 715 HD3 PRO 111 HD3 PRO 111 85.327 33.700 -15.829 716 H HIS 112 H HIS 112 83.494 30.075 -15.195 717 HA HIS 112 HA HIS 112 84.024 27.208 -15.205 718 HB2 HIS 112 HB2 HIS 112 82.224 27.087 -13.709 719 HB3 HIS 112 HB3 HIS 112 82.996 28.620 -13.324 720 HD2 HIS 112 HD2 HIS 112 79.703 27.150 -13.883 721 HE1 HIS 112 HE1 HIS 112 79.026 31.168 -15.087 722 HE2 HIS 112 HE2 HIS 112 77.925 29.069 -14.379 723 H LEU 113 H LEU 113 82.099 29.383 -17.175 724 HA LEU 113 HA LEU 113 80.160 27.460 -18.031 725 HB2 LEU 113 HB2 LEU 113 80.301 30.166 -17.711 726 HB3 LEU 113 HB3 LEU 113 80.671 30.084 -19.416 727 HG LEU 113 HG LEU 113 78.373 30.563 -19.086 728 HD11 LEU 113 HD11 LEU 113 78.430 27.624 -19.842 729 HD12 LEU 113 HD12 LEU 113 77.312 28.880 -20.388 730 HD13 LEU 113 HD13 LEU 113 78.995 28.936 -20.914 731 HD21 LEU 113 HD21 LEU 113 77.976 29.793 -16.868 732 HD22 LEU 113 HD22 LEU 113 76.789 29.093 -17.946 733 HD23 LEU 113 HD23 LEU 113 78.128 28.085 -17.358 734 H ARG 114 H ARG 114 83.273 28.484 -19.264 735 HA ARG 114 HA ARG 114 83.062 27.674 -22.009 736 HB2 ARG 114 HB2 ARG 114 84.846 29.155 -21.103 737 HB3 ARG 114 HB3 ARG 114 85.506 27.785 -20.200 738 HG2 ARG 114 HG2 ARG 114 85.935 26.586 -22.358 739 HG3 ARG 114 HG3 ARG 114 85.238 27.948 -23.242 740 HD2 ARG 114 HD2 ARG 114 87.629 28.106 -23.348 741 HD3 ARG 114 HD3 ARG 114 87.028 29.424 -22.326 742 HE ARG 114 HE ARG 114 87.682 27.171 -20.684 743 HH11 ARG 114 HH11 ARG 114 89.393 29.565 -22.585 744 HH12 ARG 114 HH12 ARG 114 90.822 29.462 -21.595 745 HH21 ARG 114 HH21 ARG 114 89.526 27.097 -19.460 746 HH22 ARG 114 HH22 ARG 114 90.891 28.091 -19.873 Start of MODEL 19 1 H1 MET 1 H1 MET 1 150.375 88.183 -1.219 2 H2 MET 1 H2 MET 1 150.123 89.739 -0.792 3 H3 MET 1 H3 MET 1 151.014 89.396 -2.118 4 HA MET 1 HA MET 1 148.824 90.185 -2.729 5 HB2 MET 1 HB2 MET 1 148.224 88.538 -4.349 6 HB3 MET 1 HB3 MET 1 149.971 88.646 -4.282 7 HG2 MET 1 HG2 MET 1 148.299 86.431 -3.009 8 HG3 MET 1 HG3 MET 1 149.083 86.350 -4.575 9 HE1 MET 1 HE1 MET 1 150.117 84.014 -3.878 10 HE2 MET 1 HE2 MET 1 151.101 83.772 -2.418 11 HE3 MET 1 HE3 MET 1 149.372 84.155 -2.268 12 H ARG 2 H ARG 2 146.553 90.041 -2.664 13 HA ARG 2 HA ARG 2 145.227 88.000 -1.027 14 HB2 ARG 2 HB2 ARG 2 146.140 89.959 0.503 15 HB3 ARG 2 HB3 ARG 2 144.881 90.929 -0.236 16 HG2 ARG 2 HG2 ARG 2 144.086 90.135 1.870 17 HG3 ARG 2 HG3 ARG 2 143.180 89.255 0.639 18 HD2 ARG 2 HD2 ARG 2 144.680 87.287 0.956 19 HD3 ARG 2 HD3 ARG 2 145.629 88.214 2.136 20 HE ARG 2 HE ARG 2 142.886 88.191 2.947 21 HH11 ARG 2 HH11 ARG 2 145.595 85.966 2.793 22 HH12 ARG 2 HH12 ARG 2 144.989 84.992 4.105 23 HH21 ARG 2 HH21 ARG 2 142.170 86.904 4.613 24 HH22 ARG 2 HH22 ARG 2 143.096 85.517 5.106 25 H GLY 3 H GLY 3 142.960 87.938 -1.331 26 HA2 GLY 3 HA2 GLY 3 140.878 88.425 -2.195 27 HA3 GLY 3 HA3 GLY 3 141.494 89.948 -2.824 28 H SER 4 H SER 4 143.242 89.438 -4.690 29 HA SER 4 HA SER 4 143.524 88.996 -6.889 30 HB2 SER 4 HB2 SER 4 142.383 86.260 -6.245 31 HB3 SER 4 HB3 SER 4 143.336 86.693 -7.671 32 HG SER 4 HG SER 4 144.631 85.753 -6.009 33 H HIS 5 H HIS 5 142.397 87.976 -8.985 34 HA HIS 5 HA HIS 5 139.606 89.044 -9.156 35 HB2 HIS 5 HB2 HIS 5 141.898 89.540 -11.095 36 HB3 HIS 5 HB3 HIS 5 140.233 90.070 -11.309 37 HD2 HIS 5 HD2 HIS 5 139.303 91.990 -9.550 38 HE1 HIS 5 HE1 HIS 5 143.169 93.361 -8.370 39 HE2 HIS 5 HE2 HIS 5 140.678 93.887 -8.337 40 H HIS 6 H HIS 6 138.344 88.290 -10.934 41 HA HIS 6 HA HIS 6 139.192 85.828 -12.340 42 HB2 HIS 6 HB2 HIS 6 138.248 85.109 -10.144 43 HB3 HIS 6 HB3 HIS 6 136.746 85.950 -10.529 44 HD2 HIS 6 HD2 HIS 6 134.985 84.149 -11.108 45 HE1 HIS 6 HE1 HIS 6 137.326 81.565 -13.570 46 HE2 HIS 6 HE2 HIS 6 135.001 81.991 -12.624 47 H HIS 7 H HIS 7 137.696 85.181 -14.029 48 HA HIS 7 HA HIS 7 135.938 87.338 -15.110 49 HB2 HIS 7 HB2 HIS 7 138.187 85.963 -16.632 50 HB3 HIS 7 HB3 HIS 7 136.986 87.043 -17.333 51 HD2 HIS 7 HD2 HIS 7 140.252 87.064 -15.381 52 HE1 HIS 7 HE1 HIS 7 139.178 91.163 -15.891 53 HE2 HIS 7 HE2 HIS 7 141.023 89.576 -15.139 54 H HIS 8 H HIS 8 134.352 86.668 -16.575 55 HA HIS 8 HA HIS 8 133.972 83.791 -17.140 56 HB2 HIS 8 HB2 HIS 8 131.780 83.687 -16.158 57 HB3 HIS 8 HB3 HIS 8 132.911 84.197 -14.915 58 HD2 HIS 8 HD2 HIS 8 132.690 86.741 -13.993 59 HE1 HIS 8 HE1 HIS 8 128.985 87.663 -15.900 60 HE2 HIS 8 HE2 HIS 8 130.672 88.433 -14.154 61 H HIS 9 H HIS 9 132.042 83.415 -18.544 62 HA HIS 9 HA HIS 9 131.111 85.687 -20.173 63 HB2 HIS 9 HB2 HIS 9 133.220 84.961 -21.266 64 HB3 HIS 9 HB3 HIS 9 132.598 83.314 -21.377 65 HD2 HIS 9 HD2 HIS 9 131.813 86.893 -22.717 66 HE1 HIS 9 HE1 HIS 9 130.121 84.117 -25.481 67 HE2 HIS 9 HE2 HIS 9 130.556 86.582 -25.014 68 H HIS 10 H HIS 10 129.210 85.274 -21.325 69 HA HIS 10 HA HIS 10 127.948 82.639 -21.318 70 HB2 HIS 10 HB2 HIS 10 125.909 83.345 -20.191 71 HB3 HIS 10 HB3 HIS 10 127.281 83.494 -19.107 72 HD2 HIS 10 HD2 HIS 10 128.057 85.995 -18.397 73 HE1 HIS 10 HE1 HIS 10 124.655 88.042 -19.963 74 HE2 HIS 10 HE2 HIS 10 126.715 88.266 -18.484 75 H GLY 11 H GLY 11 125.960 82.593 -22.629 76 HA2 GLY 11 HA2 GLY 11 124.975 84.693 -24.230 77 HA3 GLY 11 HA3 GLY 11 126.327 83.980 -25.108 78 H SER 28 H SER 28 124.801 83.471 -26.722 79 HA SER 28 HA SER 28 123.496 82.184 -27.987 80 HB2 SER 28 HB2 SER 28 124.963 80.363 -27.037 81 HB3 SER 28 HB3 SER 28 123.610 79.947 -25.966 82 HG SER 28 HG SER 28 123.614 78.756 -27.970 83 H VAL 29 H VAL 29 121.421 81.078 -28.250 84 HA VAL 29 HA VAL 29 119.279 81.819 -26.346 85 HB VAL 29 HB VAL 29 117.983 82.941 -28.175 86 HG11 VAL 29 HG11 VAL 29 120.528 84.418 -27.417 87 HG12 VAL 29 HG12 VAL 29 118.978 85.127 -27.908 88 HG13 VAL 29 HG13 VAL 29 119.094 84.235 -26.382 89 HG21 VAL 29 HG21 VAL 29 119.327 82.181 -30.144 90 HG22 VAL 29 HG22 VAL 29 119.109 83.935 -30.083 91 HG23 VAL 29 HG23 VAL 29 120.660 83.222 -29.607 92 H SER 30 H SER 30 117.284 80.772 -26.699 93 HA SER 30 HA SER 30 117.476 78.160 -27.880 94 HB2 SER 30 HB2 SER 30 115.007 79.633 -26.888 95 HB3 SER 30 HB3 SER 30 115.165 77.886 -27.155 96 HG SER 30 HG SER 30 115.486 78.460 -24.940 97 H PHE 31 H PHE 31 115.973 81.161 -29.008 98 HA PHE 31 HA PHE 31 114.983 81.796 -30.930 99 HB2 PHE 31 HB2 PHE 31 117.479 81.333 -31.351 100 HB3 PHE 31 HB3 PHE 31 116.949 79.968 -32.312 101 HD1 PHE 31 HD2 PHE 31 116.564 83.680 -31.880 102 HD2 PHE 31 HD1 PHE 31 116.348 80.352 -34.615 103 HE1 PHE 31 HE2 PHE 31 116.284 85.257 -33.779 104 HE2 PHE 31 HE1 PHE 31 116.073 81.932 -36.513 105 HZ PHE 31 HZ PHE 31 116.039 84.386 -36.097 106 H GLY 32 H GLY 32 113.393 79.804 -29.801 107 HA2 GLY 32 HA2 GLY 32 112.569 77.785 -31.681 108 HA3 GLY 32 HA3 GLY 32 111.682 78.301 -30.252 109 H ALA 33 H ALA 33 110.840 77.663 -33.062 110 HA ALA 33 HA ALA 33 109.000 79.948 -33.464 111 HB1 ALA 33 HB1 ALA 33 110.855 78.883 -35.636 112 HB2 ALA 33 HB2 ALA 33 109.552 80.073 -35.866 113 HB3 ALA 33 HB3 ALA 33 110.952 80.477 -34.857 114 HA PRO 34 HA PRO 34 107.162 75.651 -33.915 115 HB2 PRO 34 HB2 PRO 34 105.153 75.819 -32.068 116 HB3 PRO 34 HB3 PRO 34 106.845 75.427 -31.639 117 HG2 PRO 34 HG2 PRO 34 105.479 78.140 -31.529 118 HG3 PRO 34 HG3 PRO 34 106.434 77.331 -30.243 119 HD2 PRO 34 HD2 PRO 34 107.548 79.180 -31.893 120 HD3 PRO 34 HD3 PRO 34 108.469 77.738 -31.368 121 H SER 35 H SER 35 105.333 75.035 -35.053 122 HA SER 35 HA SER 35 103.203 76.974 -35.723 123 HB2 SER 35 HB2 SER 35 103.564 76.632 -38.168 124 HB3 SER 35 HB3 SER 35 104.841 77.537 -37.352 125 HG SER 35 HG SER 35 105.689 75.945 -38.792 126 HA PRO 36 HA PRO 36 102.020 72.395 -35.416 127 HB2 PRO 36 HB2 PRO 36 100.306 72.454 -33.285 128 HB3 PRO 36 HB3 PRO 36 102.082 72.312 -33.112 129 HG2 PRO 36 HG2 PRO 36 100.400 74.840 -32.948 130 HG3 PRO 36 HG3 PRO 36 101.635 74.259 -31.784 131 HD2 PRO 36 HD2 PRO 36 102.260 76.085 -33.687 132 HD3 PRO 36 HD3 PRO 36 103.404 74.776 -33.257 133 H LEU 37 H LEU 37 100.237 71.477 -36.297 134 HA LEU 37 HA LEU 37 97.693 72.947 -36.680 135 HB2 LEU 37 HB2 LEU 37 99.386 71.727 -38.905 136 HB3 LEU 37 HB3 LEU 37 97.691 72.153 -39.098 137 HG LEU 37 HG LEU 37 99.897 74.161 -38.455 138 HD11 LEU 37 HD11 LEU 37 98.455 73.565 -41.069 139 HD12 LEU 37 HD12 LEU 37 99.632 74.869 -40.790 140 HD13 LEU 37 HD13 LEU 37 100.149 73.178 -40.696 141 HD21 LEU 37 HD21 LEU 37 97.675 74.939 -37.684 142 HD22 LEU 37 HD22 LEU 37 98.190 75.841 -39.108 143 HD23 LEU 37 HD23 LEU 37 96.977 74.553 -39.272 144 H SER 38 H SER 38 95.899 71.572 -37.126 145 HA SER 38 HA SER 38 96.224 68.649 -37.052 146 HB2 SER 38 HB2 SER 38 94.802 68.364 -35.068 147 HB3 SER 38 HB3 SER 38 96.303 69.213 -34.680 148 HG SER 38 HG SER 38 94.469 70.216 -33.707 149 H SER 39 H SER 39 94.214 67.476 -37.293 150 HA SER 39 HA SER 39 91.889 68.949 -38.431 151 HB2 SER 39 HB2 SER 39 93.283 66.589 -39.761 152 HB3 SER 39 HB3 SER 39 91.746 67.308 -40.273 153 HG SER 39 HG SER 39 93.544 68.113 -41.482 154 H GLU 40 H GLU 40 89.896 67.857 -38.245 155 HA GLU 40 HA GLU 40 89.763 65.245 -36.865 156 HB2 GLU 40 HB2 GLU 40 90.059 66.917 -35.069 157 HB3 GLU 40 HB3 GLU 40 88.664 67.822 -35.663 158 HG2 GLU 40 HG2 GLU 40 87.171 65.958 -35.103 159 HG3 GLU 40 HG3 GLU 40 88.552 64.936 -34.691 160 H SER 41 H SER 41 87.955 64.108 -37.342 161 HA SER 41 HA SER 41 85.541 65.413 -38.485 162 HB2 SER 41 HB2 SER 41 87.005 63.077 -39.784 163 HB3 SER 41 HB3 SER 41 85.404 63.678 -40.247 164 HG SER 41 HG SER 41 87.088 64.530 -41.581 165 H GLU 42 H GLU 42 83.717 64.571 -37.634 166 HA GLU 42 HA GLU 42 83.652 61.777 -36.591 167 HB2 GLU 42 HB2 GLU 42 82.845 62.480 -34.417 168 HB3 GLU 42 HB3 GLU 42 84.437 63.157 -34.732 169 HG2 GLU 42 HG2 GLU 42 83.458 65.353 -35.245 170 HG3 GLU 42 HG3 GLU 42 81.827 64.697 -35.090 171 H ASP 43 H ASP 43 82.030 63.956 -38.507 172 HA ASP 43 HA ASP 43 79.450 63.914 -37.344 173 HB2 ASP 43 HB2 ASP 43 78.736 65.133 -39.270 174 HB3 ASP 43 HB3 ASP 43 80.336 65.695 -38.814 175 H GLU 44 H GLU 44 80.874 61.490 -39.199 176 HA GLU 44 HA GLU 44 78.265 60.029 -39.306 177 HB2 GLU 44 HB2 GLU 44 79.199 60.859 -41.557 178 HB3 GLU 44 HB3 GLU 44 80.453 59.630 -41.369 179 HG2 GLU 44 HG2 GLU 44 78.729 57.861 -41.375 180 HG3 GLU 44 HG3 GLU 44 77.448 59.075 -41.324 181 H ILE 45 H ILE 45 81.008 60.117 -37.587 182 HA ILE 45 HA ILE 45 81.801 57.279 -37.805 183 HB ILE 45 HB ILE 45 83.042 59.415 -36.057 184 HG12 ILE 45 HG12 ILE 45 83.174 60.287 -38.316 185 HG13 ILE 45 HG13 ILE 45 84.748 59.729 -37.804 186 HG21 ILE 45 HG21 ILE 45 84.126 56.774 -37.146 187 HG22 ILE 45 HG22 ILE 45 85.059 57.970 -36.226 188 HG23 ILE 45 HG23 ILE 45 83.720 57.122 -35.457 189 HD11 ILE 45 HD11 ILE 45 82.882 58.227 -39.701 190 HD12 ILE 45 HD12 ILE 45 84.305 59.178 -40.152 191 HD13 ILE 45 HD13 ILE 45 84.509 57.696 -39.210 192 H ASN 46 H ASN 46 79.403 57.102 -37.117 193 HA ASN 46 HA ASN 46 79.246 56.503 -34.183 194 HB2 ASN 46 HB2 ASN 46 78.387 58.814 -34.814 195 HB3 ASN 46 HB3 ASN 46 77.182 58.029 -35.830 196 HD21 ASN 46 HD22 ASN 46 75.284 58.535 -34.716 197 HD22 ASN 46 HD21 ASN 46 75.036 58.145 -33.022 198 H TYR 47 H TYR 47 78.755 55.235 -37.286 199 HA TYR 47 HA TYR 47 76.351 53.638 -36.508 200 HB2 TYR 47 HB2 TYR 47 77.115 54.711 -39.235 201 HB3 TYR 47 HB3 TYR 47 75.634 53.858 -38.811 202 HD1 TYR 47 HD2 TYR 47 74.293 54.940 -36.731 203 HD2 TYR 47 HD1 TYR 47 77.014 57.064 -39.324 204 HE1 TYR 47 HE2 TYR 47 73.266 57.102 -36.044 205 HE2 TYR 47 HE1 TYR 47 75.977 59.222 -38.642 206 HH TYR 47 HH TYR 47 74.397 60.260 -37.309 207 H MET 48 H MET 48 78.354 52.352 -35.656 208 HA MET 48 HA MET 48 79.428 50.498 -37.742 209 HB2 MET 48 HB2 MET 48 80.469 51.170 -34.966 210 HB3 MET 48 HB3 MET 48 81.246 50.093 -36.135 211 HG2 MET 48 HG2 MET 48 81.464 51.970 -37.733 212 HG3 MET 48 HG3 MET 48 80.738 53.062 -36.547 213 HE1 MET 48 HE1 MET 48 82.719 54.735 -36.769 214 HE2 MET 48 HE2 MET 48 84.432 54.281 -36.617 215 HE3 MET 48 HE3 MET 48 83.471 53.675 -37.985 216 H THR 49 H THR 49 76.855 50.365 -35.768 217 HA THR 49 HA THR 49 77.264 47.542 -34.852 218 HB THR 49 HB THR 49 75.825 48.239 -32.887 219 HG1 THR 49 HG1 THR 49 75.810 50.439 -32.411 220 HG21 THR 49 HG21 THR 49 78.546 49.590 -33.146 221 HG22 THR 49 HG22 THR 49 77.708 49.156 -31.640 222 HG23 THR 49 HG23 THR 49 78.275 47.883 -32.732 223 HA PRO 50 HA PRO 50 73.337 47.495 -37.348 224 HB2 PRO 50 HB2 PRO 50 73.914 45.337 -38.928 225 HB3 PRO 50 HB3 PRO 50 74.433 47.004 -39.327 226 HG2 PRO 50 HG2 PRO 50 76.043 44.838 -37.930 227 HG3 PRO 50 HG3 PRO 50 76.531 45.847 -39.331 228 HD2 PRO 50 HD2 PRO 50 77.252 46.480 -36.790 229 HD3 PRO 50 HD3 PRO 50 76.828 47.755 -37.973 230 HA PRO 51 HA PRO 51 71.747 44.371 -34.626 231 HB2 PRO 51 HB2 PRO 51 69.399 43.611 -35.798 232 HB3 PRO 51 HB3 PRO 51 69.668 45.233 -35.093 233 HG2 PRO 51 HG2 PRO 51 69.890 44.412 -38.007 234 HG3 PRO 51 HG3 PRO 51 69.031 45.823 -37.316 235 HD2 PRO 51 HD2 PRO 51 71.549 46.019 -38.356 236 HD3 PRO 51 HD3 PRO 51 71.044 46.983 -36.935 237 H GLU 52 H GLU 52 72.469 42.376 -34.243 238 HA GLU 52 HA GLU 52 72.011 40.129 -36.033 239 HB2 GLU 52 HB2 GLU 52 74.332 39.459 -36.211 240 HB3 GLU 52 HB3 GLU 52 74.107 41.022 -36.973 241 HG2 GLU 52 HG2 GLU 52 75.113 42.138 -34.989 242 HG3 GLU 52 HG3 GLU 52 75.310 40.568 -34.204 243 H GLN 53 H GLN 53 72.886 38.065 -35.024 244 HA GLN 53 HA GLN 53 73.049 36.563 -33.375 245 HB2 GLN 53 HB2 GLN 53 75.148 37.831 -33.276 246 HB3 GLN 53 HB3 GLN 53 74.517 38.805 -31.951 247 HG2 GLN 53 HG2 GLN 53 74.589 36.966 -30.435 248 HG3 GLN 53 HG3 GLN 53 74.730 35.783 -31.750 249 HE21 GLN 53 HE22 GLN 53 76.570 38.797 -30.760 250 HE22 GLN 53 HE21 GLN 53 78.130 37.977 -30.852 251 H GLU 54 H GLU 54 70.631 38.436 -33.177 252 HA GLU 54 HA GLU 54 69.825 37.920 -30.365 253 HB2 GLU 54 HB2 GLU 54 67.947 39.427 -30.825 254 HB3 GLU 54 HB3 GLU 54 69.540 40.165 -30.932 255 HG2 GLU 54 HG2 GLU 54 69.423 40.095 -33.418 256 HG3 GLU 54 HG3 GLU 54 67.812 39.384 -33.318 257 H ALA 55 H ALA 55 68.944 36.046 -29.977 258 HA ALA 55 HA ALA 55 66.765 34.975 -31.692 259 HB1 ALA 55 HB1 ALA 55 69.259 33.414 -30.876 260 HB2 ALA 55 HB2 ALA 55 67.879 32.782 -31.805 261 HB3 ALA 55 HB3 ALA 55 68.916 34.034 -32.506 262 H GLN 56 H GLN 56 66.838 36.198 -28.955 263 HA GLN 56 HA GLN 56 65.467 34.103 -27.404 264 HB2 GLN 56 HB2 GLN 56 67.895 33.732 -26.974 265 HB3 GLN 56 HB3 GLN 56 68.033 35.378 -26.361 266 HG2 GLN 56 HG2 GLN 56 66.400 34.806 -24.542 267 HG3 GLN 56 HG3 GLN 56 66.235 33.180 -25.213 268 HE21 GLN 56 HE22 GLN 56 68.746 35.460 -23.916 269 HE22 GLN 56 HE21 GLN 56 69.693 34.158 -23.193 270 HA PRO 57 HA PRO 57 64.093 38.502 -27.161 271 HB2 PRO 57 HB2 PRO 57 61.591 38.356 -28.131 272 HB3 PRO 57 HB3 PRO 57 63.032 38.083 -29.164 273 HG2 PRO 57 HG2 PRO 57 61.328 35.953 -27.815 274 HG3 PRO 57 HG3 PRO 57 61.759 36.082 -29.551 275 HD2 PRO 57 HD2 PRO 57 63.206 34.566 -27.789 276 HD3 PRO 57 HD3 PRO 57 63.972 35.432 -29.154 277 H GLY 58 H GLY 58 64.539 37.849 -24.868 278 HA2 GLY 58 HA2 GLY 58 63.850 38.413 -22.681 279 HA3 GLY 58 HA3 GLY 58 62.159 38.246 -23.130 280 H ALA 59 H ALA 59 64.387 36.954 -21.197 281 HA ALA 59 HA ALA 59 63.000 34.430 -20.809 282 HB1 ALA 59 HB1 ALA 59 65.932 34.480 -21.680 283 HB2 ALA 59 HB2 ALA 59 65.088 33.057 -21.032 284 HB3 ALA 59 HB3 ALA 59 64.579 33.761 -22.575 285 H LEU 60 H LEU 60 63.806 33.322 -18.865 286 HA LEU 60 HA LEU 60 64.803 35.170 -16.753 287 HB2 LEU 60 HB2 LEU 60 63.356 32.497 -16.739 288 HB3 LEU 60 HB3 LEU 60 64.213 33.076 -15.324 289 HG LEU 60 HG LEU 60 62.828 35.116 -15.247 290 HD11 LEU 60 HD11 LEU 60 61.258 33.807 -17.512 291 HD12 LEU 60 HD12 LEU 60 60.668 35.152 -16.510 292 HD13 LEU 60 HD13 LEU 60 62.071 35.393 -17.546 293 HD21 LEU 60 HD21 LEU 60 62.249 33.099 -13.946 294 HD22 LEU 60 HD22 LEU 60 60.799 33.989 -14.433 295 HD23 LEU 60 HD23 LEU 60 61.259 32.504 -15.298 296 H ALA 61 H ALA 61 66.395 34.295 -15.187 297 HA ALA 61 HA ALA 61 68.321 32.380 -16.355 298 HB1 ALA 61 HB1 ALA 61 69.021 34.979 -14.942 299 HB2 ALA 61 HB2 ALA 61 70.181 33.730 -15.446 300 HB3 ALA 61 HB3 ALA 61 69.252 34.612 -16.665 301 H ALA 62 H ALA 62 69.198 30.902 -15.035 302 HA ALA 62 HA ALA 62 68.475 30.846 -12.149 303 HB1 ALA 62 HB1 ALA 62 69.815 28.757 -13.910 304 HB2 ALA 62 HB2 ALA 62 69.363 28.557 -12.206 305 HB3 ALA 62 HB3 ALA 62 68.104 28.783 -13.434 306 H LEU 63 H LEU 63 70.204 30.380 -10.604 307 HA LEU 63 HA LEU 63 72.863 31.556 -11.274 308 HB2 LEU 63 HB2 LEU 63 71.045 32.324 -8.951 309 HB3 LEU 63 HB3 LEU 63 72.721 32.827 -9.111 310 HG LEU 63 HG LEU 63 70.480 33.606 -11.032 311 HD11 LEU 63 HD11 LEU 63 71.952 35.199 -8.891 312 HD12 LEU 63 HD12 LEU 63 70.727 35.831 -10.014 313 HD13 LEU 63 HD13 LEU 63 70.270 34.632 -8.795 314 HD21 LEU 63 HD21 LEU 63 72.637 33.593 -12.191 315 HD22 LEU 63 HD22 LEU 63 72.177 35.266 -11.843 316 HD23 LEU 63 HD23 LEU 63 73.402 34.457 -10.850 317 H HIS 64 H HIS 64 74.544 31.065 -9.837 318 HA HIS 64 HA HIS 64 74.259 28.649 -8.123 319 HB2 HIS 64 HB2 HIS 64 76.558 30.404 -8.990 320 HB3 HIS 64 HB3 HIS 64 76.742 29.201 -7.720 321 HD2 HIS 64 HD2 HIS 64 77.027 29.646 -11.382 322 HE1 HIS 64 HE1 HIS 64 76.809 25.424 -10.857 323 HE2 HIS 64 HE2 HIS 64 77.385 27.273 -12.486 324 H ALA 65 H ALA 65 74.274 28.760 -5.882 325 HA ALA 65 HA ALA 65 73.646 31.437 -4.752 326 HB1 ALA 65 HB1 ALA 65 73.044 28.629 -3.747 327 HB2 ALA 65 HB2 ALA 65 72.426 30.152 -3.071 328 HB3 ALA 65 HB3 ALA 65 71.947 29.656 -4.704 329 H GLU 66 H GLU 66 76.230 29.144 -4.565 330 HA GLU 66 HA GLU 66 77.347 30.426 -2.112 331 HB2 GLU 66 HB2 GLU 66 77.036 27.431 -2.587 332 HB3 GLU 66 HB3 GLU 66 78.001 28.161 -1.300 333 HG2 GLU 66 HG2 GLU 66 75.940 29.276 -0.416 334 HG3 GLU 66 HG3 GLU 66 74.983 28.406 -1.622 335 H GLY 67 H GLY 67 79.639 29.946 -1.758 336 HA2 GLY 67 HA2 GLY 67 81.846 29.708 -2.406 337 HA3 GLY 67 HA3 GLY 67 81.290 28.775 -3.791 338 HA PRO 68 HA PRO 68 83.206 32.768 -5.229 339 HB2 PRO 68 HB2 PRO 68 84.639 31.785 -7.356 340 HB3 PRO 68 HB3 PRO 68 85.198 31.701 -5.658 341 HG2 PRO 68 HG2 PRO 68 83.759 29.549 -7.247 342 HG3 PRO 68 HG3 PRO 68 85.269 29.392 -6.289 343 HD2 PRO 68 HD2 PRO 68 82.875 28.696 -5.251 344 HD3 PRO 68 HD3 PRO 68 84.087 29.536 -4.237 345 H LEU 69 H LEU 69 81.108 30.478 -6.803 346 HA LEU 69 HA LEU 69 80.429 32.354 -8.994 347 HB2 LEU 69 HB2 LEU 69 79.584 29.504 -8.417 348 HB3 LEU 69 HB3 LEU 69 78.944 30.462 -9.746 349 HG LEU 69 HG LEU 69 81.893 29.794 -9.436 350 HD11 LEU 69 HD11 LEU 69 79.780 28.568 -11.242 351 HD12 LEU 69 HD12 LEU 69 81.513 28.163 -11.210 352 HD13 LEU 69 HD13 LEU 69 80.494 27.791 -9.814 353 HD21 LEU 69 HD21 LEU 69 81.577 31.814 -10.780 354 HD22 LEU 69 HD22 LEU 69 82.004 30.469 -11.831 355 HD23 LEU 69 HD23 LEU 69 80.318 31.008 -11.751 356 H ALA 70 H ALA 70 79.490 32.361 -5.806 357 HA ALA 70 HA ALA 70 76.680 32.282 -5.964 358 HB1 ALA 70 HB1 ALA 70 78.453 33.960 -4.135 359 HB2 ALA 70 HB2 ALA 70 76.738 33.586 -3.863 360 HB3 ALA 70 HB3 ALA 70 77.941 32.284 -3.850 361 H GLY 71 H GLY 71 75.361 33.374 -7.192 362 HA2 GLY 71 HA2 GLY 71 74.203 35.286 -7.981 363 HA3 GLY 71 HA3 GLY 71 75.594 36.308 -7.643 364 H LEU 72 H LEU 72 76.687 33.554 -9.306 365 HA LEU 72 HA LEU 72 76.639 34.908 -11.943 366 HB2 LEU 72 HB2 LEU 72 78.608 32.928 -10.695 367 HB3 LEU 72 HB3 LEU 72 78.663 33.424 -12.340 368 HG LEU 72 HG LEU 72 78.670 35.872 -11.433 369 HD11 LEU 72 HD11 LEU 72 79.880 34.467 -9.024 370 HD12 LEU 72 HD12 LEU 72 79.957 36.198 -9.373 371 HD13 LEU 72 HD13 LEU 72 78.410 35.456 -9.018 372 HD21 LEU 72 HD21 LEU 72 80.534 34.810 -12.664 373 HD22 LEU 72 HD22 LEU 72 81.138 35.839 -11.371 374 HD23 LEU 72 HD23 LEU 72 81.118 34.076 -11.158 375 HA PRO 73 HA PRO 73 73.948 32.133 -13.781 376 HB2 PRO 73 HB2 PRO 73 74.927 31.688 -16.330 377 HB3 PRO 73 HB3 PRO 73 74.279 33.255 -15.773 378 HG2 PRO 73 HG2 PRO 73 77.149 32.325 -15.959 379 HG3 PRO 73 HG3 PRO 73 76.462 33.901 -16.455 380 HD2 PRO 73 HD2 PRO 73 77.754 33.522 -14.122 381 HD3 PRO 73 HD3 PRO 73 76.412 34.685 -14.246 382 H VAL 74 H VAL 74 73.414 29.986 -14.712 383 HA VAL 74 HA VAL 74 75.481 27.921 -14.058 384 HB VAL 74 HB VAL 74 72.500 27.497 -14.287 385 HG11 VAL 74 HG11 VAL 74 74.728 25.857 -13.014 386 HG12 VAL 74 HG12 VAL 74 72.994 25.482 -12.942 387 HG13 VAL 74 HG13 VAL 74 73.827 25.446 -14.491 388 HG21 VAL 74 HG21 VAL 74 72.841 29.067 -12.432 389 HG22 VAL 74 HG22 VAL 74 72.470 27.467 -11.801 390 HG23 VAL 74 HG23 VAL 74 74.146 28.052 -11.780 391 H THR 75 H THR 75 73.316 29.052 -16.658 392 HA THR 75 HA THR 75 74.682 27.168 -18.551 393 HB THR 75 HB THR 75 72.678 27.036 -19.830 394 HG1 THR 75 HG1 THR 75 70.869 28.215 -19.284 395 HG21 THR 75 HG21 THR 75 71.845 26.740 -16.923 396 HG22 THR 75 HG22 THR 75 71.210 25.872 -18.339 397 HG23 THR 75 HG23 THR 75 72.877 25.581 -17.793 398 H ARG 76 H ARG 76 74.515 27.794 -20.884 399 HA ARG 76 HA ARG 76 75.836 30.309 -21.391 400 HB2 ARG 76 HB2 ARG 76 76.001 28.110 -22.646 401 HB3 ARG 76 HB3 ARG 76 74.398 28.407 -23.310 402 HG2 ARG 76 HG2 ARG 76 75.288 30.423 -24.498 403 HG3 ARG 76 HG3 ARG 76 76.897 30.103 -23.797 404 HD2 ARG 76 HD2 ARG 76 76.874 27.829 -24.829 405 HD3 ARG 76 HD3 ARG 76 75.285 28.179 -25.530 406 HE ARG 76 HE ARG 76 77.342 30.103 -26.360 407 HH11 ARG 76 HH11 ARG 76 76.154 26.860 -27.083 408 HH12 ARG 76 HH12 ARG 76 76.734 26.941 -28.722 409 HH21 ARG 76 HH21 ARG 76 78.023 30.127 -28.381 410 HH22 ARG 76 HH22 ARG 76 77.764 28.767 -29.464 411 H SER 77 H SER 77 72.448 29.264 -21.751 412 HA SER 77 HA SER 77 71.432 31.774 -22.746 413 HB2 SER 77 HB2 SER 77 69.227 30.838 -21.919 414 HB3 SER 77 HB3 SER 77 70.094 29.899 -23.146 415 HG SER 77 HG SER 77 69.308 28.571 -21.435 416 H ASP 78 H ASP 78 71.770 30.448 -19.359 417 HA ASP 78 HA ASP 78 70.679 32.730 -18.047 418 HB2 ASP 78 HB2 ASP 78 73.025 31.016 -17.171 419 HB3 ASP 78 HB3 ASP 78 72.200 32.197 -16.166 420 H ALA 79 H ALA 79 74.131 32.125 -19.019 421 HA ALA 79 HA ALA 79 75.113 34.627 -18.140 422 HB1 ALA 79 HB1 ALA 79 76.091 32.752 -20.346 423 HB2 ALA 79 HB2 ALA 79 77.025 34.092 -19.664 424 HB3 ALA 79 HB3 ALA 79 76.574 32.723 -18.627 425 H ARG 80 H ARG 80 73.750 33.816 -21.380 426 HA ARG 80 HA ARG 80 74.049 36.465 -22.503 427 HB2 ARG 80 HB2 ARG 80 72.139 34.146 -23.022 428 HB3 ARG 80 HB3 ARG 80 71.988 35.644 -23.919 429 HG2 ARG 80 HG2 ARG 80 74.557 34.002 -23.827 430 HG3 ARG 80 HG3 ARG 80 73.303 33.791 -25.047 431 HD2 ARG 80 HD2 ARG 80 74.863 36.367 -24.581 432 HD3 ARG 80 HD3 ARG 80 75.188 35.200 -25.844 433 HE ARG 80 HE ARG 80 72.852 37.047 -25.649 434 HH11 ARG 80 HH11 ARG 80 74.393 34.562 -27.595 435 HH12 ARG 80 HH12 ARG 80 73.435 34.952 -28.996 436 HH21 ARG 80 HH21 ARG 80 71.758 37.556 -27.514 437 HH22 ARG 80 HH22 ARG 80 72.132 36.727 -28.997 438 H VAL 81 H VAL 81 71.299 35.092 -20.652 439 HA VAL 81 HA VAL 81 69.645 37.458 -20.770 440 HB VAL 81 HB VAL 81 69.784 35.182 -18.758 441 HG11 VAL 81 HG11 VAL 81 67.714 37.424 -18.941 442 HG12 VAL 81 HG12 VAL 81 67.513 35.931 -18.006 443 HG13 VAL 81 HG13 VAL 81 68.770 37.076 -17.550 444 HG21 VAL 81 HG21 VAL 81 69.026 34.618 -21.034 445 HG22 VAL 81 HG22 VAL 81 67.728 34.457 -19.855 446 HG23 VAL 81 HG23 VAL 81 67.777 35.875 -20.936 447 H LEU 82 H LEU 82 72.002 36.374 -18.306 448 HA LEU 82 HA LEU 82 71.687 38.685 -16.634 449 HB2 LEU 82 HB2 LEU 82 74.062 36.821 -16.979 450 HB3 LEU 82 HB3 LEU 82 73.965 38.080 -15.750 451 HG LEU 82 HG LEU 82 72.143 35.651 -15.950 452 HD11 LEU 82 HD11 LEU 82 74.120 36.463 -13.790 453 HD12 LEU 82 HD12 LEU 82 73.298 34.897 -14.013 454 HD13 LEU 82 HD13 LEU 82 74.542 35.421 -15.159 455 HD21 LEU 82 HD21 LEU 82 70.800 37.470 -15.037 456 HD22 LEU 82 HD22 LEU 82 71.265 36.370 -13.745 457 HD23 LEU 82 HD23 LEU 82 72.117 37.920 -13.922 458 H ILE 83 H ILE 83 74.062 38.177 -19.327 459 HA ILE 83 HA ILE 83 75.300 40.742 -19.164 460 HB ILE 83 HB ILE 83 74.702 38.910 -21.505 461 HG12 ILE 83 HG12 ILE 83 77.358 39.758 -20.264 462 HG13 ILE 83 HG13 ILE 83 76.439 38.376 -19.678 463 HG21 ILE 83 HG21 ILE 83 76.220 41.563 -21.638 464 HG22 ILE 83 HG22 ILE 83 76.192 40.335 -22.916 465 HG23 ILE 83 HG23 ILE 83 74.718 41.181 -22.504 466 HD11 ILE 83 HD11 ILE 83 77.639 38.665 -22.459 467 HD12 ILE 83 HD12 ILE 83 78.133 37.560 -21.167 468 HD13 ILE 83 HD13 ILE 83 76.560 37.340 -21.953 469 H PHE 84 H PHE 84 72.356 39.817 -21.053 470 HA PHE 84 HA PHE 84 71.859 42.443 -21.945 471 HB2 PHE 84 HB2 PHE 84 70.886 40.254 -22.814 472 HB3 PHE 84 HB3 PHE 84 69.760 40.296 -21.471 473 HD1 PHE 84 HD1 PHE 84 71.057 42.869 -23.946 474 HD2 PHE 84 HD2 PHE 84 67.603 40.959 -22.192 475 HE1 PHE 84 HE1 PHE 84 69.619 44.113 -25.472 476 HE2 PHE 84 HE2 PHE 84 66.132 42.314 -23.666 477 HZ PHE 84 HZ PHE 84 67.125 43.882 -25.324 478 H ASN 85 H ASN 85 70.428 40.821 -19.054 479 HA ASN 85 HA ASN 85 68.738 43.042 -18.402 480 HB2 ASN 85 HB2 ASN 85 68.395 40.651 -17.710 481 HB3 ASN 85 HB3 ASN 85 69.775 40.796 -16.618 482 HD21 ASN 85 HD22 ASN 85 68.520 40.430 -14.706 483 HD22 ASN 85 HD21 ASN 85 67.335 41.606 -14.166 484 H GLU 86 H GLU 86 71.969 42.068 -17.146 485 HA GLU 86 HA GLU 86 72.372 44.138 -15.228 486 HB2 GLU 86 HB2 GLU 86 73.852 42.151 -15.526 487 HB3 GLU 86 HB3 GLU 86 74.348 42.772 -17.106 488 HG2 GLU 86 HG2 GLU 86 75.175 44.867 -15.785 489 HG3 GLU 86 HG3 GLU 86 75.027 43.840 -14.359 490 H TRP 87 H TRP 87 73.321 44.026 -18.747 491 HA TRP 87 HA TRP 87 74.205 46.729 -18.820 492 HB2 TRP 87 HB2 TRP 87 74.886 45.155 -20.489 493 HB3 TRP 87 HB3 TRP 87 73.221 44.810 -20.929 494 HD1 TRP 87 HD1 TRP 87 75.742 47.734 -21.203 495 HE1 TRP 87 HE1 TRP 87 75.230 48.918 -23.454 496 HE3 TRP 87 HE3 TRP 87 71.423 45.315 -22.498 497 HZ2 TRP 87 HZ2 TRP 87 73.194 48.905 -25.453 498 HZ3 TRP 87 HZ3 TRP 87 70.281 45.872 -24.586 499 HH2 TRP 87 HH2 TRP 87 71.116 47.675 -26.085 500 H GLU 88 H GLU 88 70.919 45.371 -19.616 501 HA GLU 88 HA GLU 88 69.790 47.792 -20.511 502 HB2 GLU 88 HB2 GLU 88 68.675 45.302 -19.215 503 HB3 GLU 88 HB3 GLU 88 67.629 46.683 -19.453 504 HG2 GLU 88 HG2 GLU 88 69.222 45.605 -21.788 505 HG3 GLU 88 HG3 GLU 88 67.717 44.848 -21.279 506 H GLU 89 H GLU 89 69.895 46.592 -17.074 507 HA GLU 89 HA GLU 89 68.571 48.962 -16.047 508 HB2 GLU 89 HB2 GLU 89 70.404 46.945 -14.685 509 HB3 GLU 89 HB3 GLU 89 69.530 48.238 -13.853 510 HG2 GLU 89 HG2 GLU 89 67.377 47.318 -14.744 511 HG3 GLU 89 HG3 GLU 89 68.263 45.952 -15.414 512 H ARG 90 H ARG 90 72.035 48.064 -16.241 513 HA ARG 90 HA ARG 90 73.161 50.438 -15.118 514 HB2 ARG 90 HB2 ARG 90 74.207 48.640 -17.357 515 HB3 ARG 90 HB3 ARG 90 75.169 49.876 -16.557 516 HG2 ARG 90 HG2 ARG 90 73.856 47.832 -14.806 517 HG3 ARG 90 HG3 ARG 90 75.160 47.291 -15.858 518 HD2 ARG 90 HD2 ARG 90 75.977 47.893 -13.584 519 HD3 ARG 90 HD3 ARG 90 76.739 48.807 -14.877 520 HE ARG 90 HE ARG 90 75.834 50.783 -14.093 521 HH11 ARG 90 HH11 ARG 90 74.168 48.251 -12.281 522 HH12 ARG 90 HH12 ARG 90 73.451 49.432 -11.220 523 HH21 ARG 90 HH21 ARG 90 74.985 52.091 -12.843 524 HH22 ARG 90 HH22 ARG 90 73.915 51.638 -11.507 525 H LYS 91 H LYS 91 72.553 49.699 -18.510 526 HA LYS 91 HA LYS 91 73.244 52.261 -19.524 527 HB2 LYS 91 HB2 LYS 91 73.082 50.082 -20.851 528 HB3 LYS 91 HB3 LYS 91 71.338 50.137 -20.653 529 HG2 LYS 91 HG2 LYS 91 71.661 50.741 -22.829 530 HG3 LYS 91 HG3 LYS 91 71.343 52.286 -22.050 531 HD2 LYS 91 HD2 LYS 91 73.720 52.866 -22.136 532 HD3 LYS 91 HD3 LYS 91 74.133 51.212 -22.632 533 HE2 LYS 91 HE2 LYS 91 72.793 51.493 -24.710 534 HE3 LYS 91 HE3 LYS 91 72.486 53.177 -24.279 535 HZ1 LYS 91 HZ1 LYS 91 75.239 52.057 -24.653 536 HZ2 LYS 91 HZ2 LYS 91 74.406 52.850 -25.830 537 HZ3 LYS 91 HZ3 LYS 91 74.833 53.647 -24.470 538 H LYS 92 H LYS 92 70.014 51.086 -18.446 539 HA LYS 92 HA LYS 92 68.575 53.447 -19.175 540 HB2 LYS 92 HB2 LYS 92 67.557 51.311 -18.381 541 HB3 LYS 92 HB3 LYS 92 68.141 51.662 -16.743 542 HG2 LYS 92 HG2 LYS 92 66.768 53.719 -16.692 543 HG3 LYS 92 HG3 LYS 92 66.294 53.453 -18.374 544 HD2 LYS 92 HD2 LYS 92 64.472 52.797 -16.964 545 HD3 LYS 92 HD3 LYS 92 65.147 51.339 -17.703 546 HE2 LYS 92 HE2 LYS 92 66.374 50.832 -15.602 547 HE3 LYS 92 HE3 LYS 92 65.791 52.339 -14.883 548 HZ1 LYS 92 HZ1 LYS 92 64.041 50.074 -15.724 549 HZ2 LYS 92 HZ2 LYS 92 64.430 50.443 -14.182 550 HZ3 LYS 92 HZ3 LYS 92 63.513 51.469 -15.054 551 H SER 93 H SER 93 70.612 52.763 -16.282 552 HA SER 93 HA SER 93 70.363 55.555 -15.369 553 HB2 SER 93 HB2 SER 93 72.208 53.310 -14.507 554 HB3 SER 93 HB3 SER 93 72.139 54.917 -13.759 555 HG SER 93 HG SER 93 70.779 53.401 -12.667 556 H GLU 94 H GLU 94 72.518 53.952 -17.591 557 HA GLU 94 HA GLU 94 74.471 56.219 -17.636 558 HB2 GLU 94 HB2 GLU 94 75.085 53.237 -17.618 559 HB3 GLU 94 HB3 GLU 94 76.235 54.561 -17.653 560 HG2 GLU 94 HG2 GLU 94 75.314 55.304 -15.412 561 HG3 GLU 94 HG3 GLU 94 74.291 53.859 -15.457 562 HA PRO 95 HA PRO 95 73.037 55.220 -21.928 563 HB2 PRO 95 HB2 PRO 95 73.606 57.689 -23.097 564 HB3 PRO 95 HB3 PRO 95 72.094 57.252 -22.248 565 HG2 PRO 95 HG2 PRO 95 74.518 58.684 -21.124 566 HG3 PRO 95 HG3 PRO 95 72.788 59.130 -20.959 567 HD2 PRO 95 HD2 PRO 95 74.043 57.810 -18.986 568 HD3 PRO 95 HD3 PRO 95 72.383 57.334 -19.444 569 H TRP 96 H TRP 96 76.195 56.008 -20.806 570 HA TRP 96 HA TRP 96 77.589 55.620 -23.350 571 HB2 TRP 96 HB2 TRP 96 79.602 55.852 -21.898 572 HB3 TRP 96 HB3 TRP 96 78.483 57.196 -21.837 573 HD1 TRP 96 HD1 TRP 96 79.754 54.297 -19.681 574 HE1 TRP 96 HE1 TRP 96 79.180 54.741 -17.213 575 HE3 TRP 96 HE3 TRP 96 76.884 58.507 -20.248 576 HZ2 TRP 96 HZ2 TRP 96 77.716 56.690 -15.682 577 HZ3 TRP 96 HZ3 TRP 96 75.884 59.617 -18.262 578 HH2 TRP 96 HH2 TRP 96 76.287 58.719 -15.982 579 H LEU 97 H LEU 97 76.258 53.315 -21.112 580 HA LEU 97 HA LEU 97 78.312 51.428 -21.028 581 HB2 LEU 97 HB2 LEU 97 75.639 51.629 -20.150 582 HB3 LEU 97 HB3 LEU 97 75.600 50.266 -21.223 583 HG LEU 97 HG LEU 97 75.895 49.359 -19.165 584 HD11 LEU 97 HD11 LEU 97 78.842 49.525 -19.939 585 HD12 LEU 97 HD12 LEU 97 78.022 48.260 -19.018 586 HD13 LEU 97 HD13 LEU 97 77.682 48.445 -20.735 587 HD21 LEU 97 HD21 LEU 97 76.402 51.373 -17.936 588 HD22 LEU 97 HD22 LEU 97 77.496 50.053 -17.483 589 HD23 LEU 97 HD23 LEU 97 78.071 51.363 -18.549 590 H ARG 98 H ARG 98 79.046 49.774 -22.286 591 HA ARG 98 HA ARG 98 77.980 49.404 -25.055 592 HB2 ARG 98 HB2 ARG 98 80.634 48.637 -23.768 593 HB3 ARG 98 HB3 ARG 98 80.173 48.254 -25.430 594 HG2 ARG 98 HG2 ARG 98 80.015 50.654 -25.986 595 HG3 ARG 98 HG3 ARG 98 80.376 51.087 -24.310 596 HD2 ARG 98 HD2 ARG 98 82.385 51.345 -25.605 597 HD3 ARG 98 HD3 ARG 98 82.580 49.990 -24.481 598 HE ARG 98 HE ARG 98 81.658 49.235 -27.173 599 HH11 ARG 98 HH11 ARG 98 84.561 49.814 -25.294 600 HH12 ARG 98 HH12 ARG 98 85.544 48.821 -26.334 601 HH21 ARG 98 HH21 ARG 98 82.967 47.966 -28.450 602 HH22 ARG 98 HH22 ARG 98 84.659 47.815 -28.082 603 H LEU 99 H LEU 99 77.731 47.308 -25.934 604 HA LEU 99 HA LEU 99 77.022 45.158 -23.976 605 HB2 LEU 99 HB2 LEU 99 75.155 46.537 -24.727 606 HB3 LEU 99 HB3 LEU 99 75.471 46.189 -26.390 607 HG LEU 99 HG LEU 99 73.492 45.048 -25.318 608 HD11 LEU 99 HD11 LEU 99 75.496 43.041 -26.397 609 HD12 LEU 99 HD12 LEU 99 73.735 43.087 -26.624 610 HD13 LEU 99 HD13 LEU 99 74.739 44.281 -27.410 611 HD21 LEU 99 HD21 LEU 99 74.747 44.538 -23.150 612 HD22 LEU 99 HD22 LEU 99 73.538 43.436 -23.764 613 HD23 LEU 99 HD23 LEU 99 75.284 43.065 -23.986 614 H ASP 100 H ASP 100 77.868 43.172 -24.497 615 HA ASP 100 HA ASP 100 78.489 42.495 -27.315 616 HB2 ASP 100 HB2 ASP 100 80.569 43.421 -26.333 617 HB3 ASP 100 HB3 ASP 100 80.484 42.226 -25.037 618 H MET 101 H MET 101 77.926 40.474 -27.819 619 HA MET 101 HA MET 101 77.106 38.571 -25.646 620 HB2 MET 101 HB2 MET 101 75.577 39.492 -28.111 621 HB3 MET 101 HB3 MET 101 75.154 38.042 -27.203 622 HG2 MET 101 HG2 MET 101 74.890 39.371 -25.141 623 HG3 MET 101 HG3 MET 101 75.253 40.844 -26.048 624 HE1 MET 101 HE1 MET 101 72.800 41.951 -25.195 625 HE2 MET 101 HE2 MET 101 71.364 40.907 -25.213 626 HE3 MET 101 HE3 MET 101 72.778 40.444 -24.239 627 H SER 102 H SER 102 79.230 38.810 -28.198 628 HA SER 102 HA SER 102 78.946 36.165 -29.368 629 HB2 SER 102 HB2 SER 102 81.349 38.020 -29.170 630 HB3 SER 102 HB3 SER 102 81.260 36.544 -30.157 631 HG SER 102 HG SER 102 80.731 38.482 -31.346 632 H ASP 103 H ASP 103 80.226 34.277 -28.894 633 HA ASP 103 HA ASP 103 79.963 33.622 -26.211 634 HB2 ASP 103 HB2 ASP 103 81.558 32.234 -28.385 635 HB3 ASP 103 HB3 ASP 103 81.248 31.538 -26.793 636 H LYS 104 H LYS 104 82.878 34.975 -27.632 637 HA LYS 104 HA LYS 104 84.768 34.342 -25.569 638 HB2 LYS 104 HB2 LYS 104 84.480 36.668 -27.507 639 HB3 LYS 104 HB3 LYS 104 85.698 36.697 -26.242 640 HG2 LYS 104 HG2 LYS 104 86.733 35.925 -28.222 641 HG3 LYS 104 HG3 LYS 104 86.694 34.606 -27.054 642 HD2 LYS 104 HD2 LYS 104 84.831 33.544 -28.255 643 HD3 LYS 104 HD3 LYS 104 84.755 34.888 -29.405 644 HE2 LYS 104 HE2 LYS 104 87.175 33.062 -28.991 645 HE3 LYS 104 HE3 LYS 104 85.930 32.793 -30.209 646 HZ1 LYS 104 HZ1 LYS 104 87.717 35.176 -30.112 647 HZ2 LYS 104 HZ2 LYS 104 87.803 33.953 -31.181 648 HZ3 LYS 104 HZ3 LYS 104 86.518 34.953 -31.208 649 H ALA 105 H ALA 105 82.191 36.814 -25.593 650 HA ALA 105 HA ALA 105 82.955 38.112 -23.138 651 HB1 ALA 105 HB1 ALA 105 80.211 37.803 -24.421 652 HB2 ALA 105 HB2 ALA 105 80.659 38.968 -23.161 653 HB3 ALA 105 HB3 ALA 105 81.387 39.085 -24.772 654 H ILE 106 H ILE 106 81.031 35.218 -23.816 655 HA ILE 106 HA ILE 106 80.147 34.860 -21.061 656 HB ILE 106 HB ILE 106 80.001 33.101 -23.541 657 HG12 ILE 106 HG12 ILE 106 77.579 33.450 -23.326 658 HG13 ILE 106 HG13 ILE 106 77.818 34.467 -21.908 659 HG21 ILE 106 HG21 ILE 106 78.941 32.489 -20.744 660 HG22 ILE 106 HG22 ILE 106 78.503 31.606 -22.222 661 HG23 ILE 106 HG23 ILE 106 80.164 31.564 -21.645 662 HD11 ILE 106 HD11 ILE 106 78.837 35.170 -24.693 663 HD12 ILE 106 HD12 ILE 106 77.285 35.707 -24.013 664 HD13 ILE 106 HD13 ILE 106 78.795 36.233 -23.265 665 H PHE 107 H PHE 107 82.637 33.273 -23.140 666 HA PHE 107 HA PHE 107 83.743 31.565 -21.173 667 HB2 PHE 107 HB2 PHE 107 85.328 33.120 -23.244 668 HB3 PHE 107 HB3 PHE 107 85.787 31.609 -22.483 669 HD1 PHE 107 HD2 PHE 107 82.806 30.376 -22.953 670 HD2 PHE 107 HD1 PHE 107 85.816 32.265 -25.393 671 HE1 PHE 107 HE2 PHE 107 81.972 29.140 -24.938 672 HE2 PHE 107 HE1 PHE 107 84.998 30.992 -27.380 673 HZ PHE 107 HZ PHE 107 83.081 29.424 -27.144 674 H ARG 108 H ARG 108 84.625 34.980 -21.876 675 HA ARG 108 HA ARG 108 86.716 35.057 -19.927 676 HB2 ARG 108 HB2 ARG 108 86.462 36.218 -22.152 677 HB3 ARG 108 HB3 ARG 108 85.365 37.371 -21.389 678 HG2 ARG 108 HG2 ARG 108 88.208 36.823 -20.435 679 HG3 ARG 108 HG3 ARG 108 87.834 37.969 -21.722 680 HD2 ARG 108 HD2 ARG 108 86.428 39.293 -20.171 681 HD3 ARG 108 HD3 ARG 108 86.874 38.194 -18.846 682 HE ARG 108 HE ARG 108 89.262 39.126 -20.072 683 HH11 ARG 108 HH11 ARG 108 86.712 40.447 -18.055 684 HH12 ARG 108 HH12 ARG 108 87.761 41.652 -17.362 685 HH21 ARG 108 HH21 ARG 108 90.542 40.684 -19.149 686 HH22 ARG 108 HH22 ARG 108 89.877 41.779 -17.972 687 H ARG 109 H ARG 109 83.325 36.272 -19.798 688 HA ARG 109 HA ARG 109 83.560 37.285 -17.055 689 HB2 ARG 109 HB2 ARG 109 81.198 36.404 -18.770 690 HB3 ARG 109 HB3 ARG 109 81.028 36.913 -17.092 691 HG2 ARG 109 HG2 ARG 109 81.915 39.126 -17.574 692 HG3 ARG 109 HG3 ARG 109 82.176 38.694 -19.278 693 HD2 ARG 109 HD2 ARG 109 79.819 38.397 -19.656 694 HD3 ARG 109 HD3 ARG 109 79.456 38.444 -17.935 695 HE ARG 109 HE ARG 109 80.343 40.787 -19.587 696 HH11 ARG 109 HH11 ARG 109 78.686 39.706 -16.649 697 HH12 ARG 109 HH12 ARG 109 77.988 41.290 -16.389 698 HH21 ARG 109 HH21 ARG 109 79.427 42.779 -19.082 699 HH22 ARG 109 HH22 ARG 109 78.386 42.905 -17.672 700 H TYR 110 H TYR 110 82.614 34.161 -18.447 701 HA TYR 110 HA TYR 110 82.306 32.974 -15.725 702 HB2 TYR 110 HB2 TYR 110 80.612 32.453 -18.183 703 HB3 TYR 110 HB3 TYR 110 80.344 31.873 -16.562 704 HD1 TYR 110 HD2 TYR 110 80.317 33.918 -14.713 705 HD2 TYR 110 HD1 TYR 110 79.251 34.184 -18.878 706 HE1 TYR 110 HE2 TYR 110 78.993 36.006 -14.259 707 HE2 TYR 110 HE1 TYR 110 77.851 36.193 -18.410 708 HH TYR 110 HH TYR 110 77.051 37.637 -16.790 709 HA PRO 111 HA PRO 111 85.329 30.441 -18.233 710 HB2 PRO 111 HB2 PRO 111 87.236 30.044 -16.297 711 HB3 PRO 111 HB3 PRO 111 87.153 31.510 -17.320 712 HG2 PRO 111 HG2 PRO 111 86.025 31.132 -14.524 713 HG3 PRO 111 HG3 PRO 111 87.067 32.465 -15.124 714 HD2 PRO 111 HD2 PRO 111 84.383 32.745 -14.997 715 HD3 PRO 111 HD3 PRO 111 85.294 33.399 -16.391 716 H HIS 112 H HIS 112 83.466 29.903 -15.362 717 HA HIS 112 HA HIS 112 83.996 27.062 -15.045 718 HB2 HIS 112 HB2 HIS 112 82.275 27.134 -13.463 719 HB3 HIS 112 HB3 HIS 112 83.032 28.711 -13.318 720 HD2 HIS 112 HD2 HIS 112 79.743 27.081 -13.667 721 HE1 HIS 112 HE1 HIS 112 78.925 31.016 -15.046 722 HE2 HIS 112 HE2 HIS 112 77.903 28.930 -14.183 723 H LEU 113 H LEU 113 82.019 28.955 -17.234 724 HA LEU 113 HA LEU 113 79.867 27.132 -17.382 725 HB2 LEU 113 HB2 LEU 113 80.058 29.705 -17.578 726 HB3 LEU 113 HB3 LEU 113 80.529 29.456 -19.245 727 HG LEU 113 HG LEU 113 78.192 30.114 -18.909 728 HD11 LEU 113 HD11 LEU 113 78.253 27.280 -19.998 729 HD12 LEU 113 HD12 LEU 113 77.195 28.610 -20.459 730 HD13 LEU 113 HD13 LEU 113 78.911 28.688 -20.868 731 HD21 LEU 113 HD21 LEU 113 77.879 28.912 -16.733 732 HD22 LEU 113 HD22 LEU 113 76.562 28.770 -17.874 733 HD23 LEU 113 HD23 LEU 113 77.671 27.402 -17.650 734 H ARG 114 H ARG 114 82.511 27.858 -19.667 735 HA ARG 114 HA ARG 114 82.066 25.319 -21.122 736 HB2 ARG 114 HB2 ARG 114 80.744 27.169 -22.214 737 HB3 ARG 114 HB3 ARG 114 82.252 28.004 -22.552 738 HG2 ARG 114 HG2 ARG 114 81.572 25.194 -23.544 739 HG3 ARG 114 HG3 ARG 114 81.223 26.676 -24.435 740 HD2 ARG 114 HD2 ARG 114 83.679 27.221 -24.404 741 HD3 ARG 114 HD3 ARG 114 83.974 25.610 -23.720 742 HE ARG 114 HE ARG 114 82.418 25.169 -25.992 743 HH11 ARG 114 HH11 ARG 114 85.590 26.525 -25.398 744 HH12 ARG 114 HH12 ARG 114 86.196 26.034 -26.957 745 HH21 ARG 114 HH21 ARG 114 83.244 24.580 -27.964 746 HH22 ARG 114 HH22 ARG 114 84.891 24.958 -28.371 Start of MODEL 20 1 H1 MET 1 H1 MET 1 112.223 -3.428 -93.143 2 H2 MET 1 H2 MET 1 111.944 -2.059 -93.995 3 H3 MET 1 H3 MET 1 111.460 -3.500 -94.587 4 HA MET 1 HA MET 1 109.559 -2.289 -93.736 5 HB2 MET 1 HB2 MET 1 109.680 -4.806 -93.631 6 HB3 MET 1 HB3 MET 1 110.195 -4.692 -91.954 7 HG2 MET 1 HG2 MET 1 107.567 -3.598 -93.058 8 HG3 MET 1 HG3 MET 1 107.777 -5.195 -92.357 9 HE1 MET 1 HE1 MET 1 105.918 -5.091 -90.633 10 HE2 MET 1 HE2 MET 1 105.592 -3.676 -89.608 11 HE3 MET 1 HE3 MET 1 105.447 -3.544 -91.376 12 H ARG 2 H ARG 2 109.179 -0.490 -92.559 13 HA ARG 2 HA ARG 2 109.967 -0.320 -89.714 14 HB2 ARG 2 HB2 ARG 2 111.926 0.478 -91.155 15 HB3 ARG 2 HB3 ARG 2 110.914 1.829 -91.660 16 HG2 ARG 2 HG2 ARG 2 110.712 2.517 -89.242 17 HG3 ARG 2 HG3 ARG 2 111.718 1.129 -88.789 18 HD2 ARG 2 HD2 ARG 2 113.583 2.039 -90.124 19 HD3 ARG 2 HD3 ARG 2 112.572 3.406 -90.620 20 HE ARG 2 HE ARG 2 112.574 3.309 -87.777 21 HH11 ARG 2 HH11 ARG 2 114.878 4.042 -90.322 22 HH12 ARG 2 HH12 ARG 2 115.808 5.110 -89.307 23 HH21 ARG 2 HH21 ARG 2 113.803 4.685 -86.538 24 HH22 ARG 2 HH22 ARG 2 115.208 5.460 -87.212 25 H GLY 3 H GLY 3 107.482 -0.671 -90.248 26 HA2 GLY 3 HA2 GLY 3 106.203 1.608 -89.131 27 HA3 GLY 3 HA3 GLY 3 105.822 1.584 -90.849 28 H SER 4 H SER 4 104.449 0.955 -88.083 29 HA SER 4 HA SER 4 102.533 -0.987 -89.156 30 HB2 SER 4 HB2 SER 4 102.638 -2.468 -87.199 31 HB3 SER 4 HB3 SER 4 104.162 -2.476 -88.095 32 HG SER 4 HG SER 4 104.497 -2.313 -85.818 33 H HIS 5 H HIS 5 100.587 -1.170 -87.768 34 HA HIS 5 HA HIS 5 100.168 0.942 -85.742 35 HB2 HIS 5 HB2 HIS 5 99.676 2.071 -87.876 36 HB3 HIS 5 HB3 HIS 5 98.556 0.783 -88.320 37 HD2 HIS 5 HD2 HIS 5 96.096 1.412 -87.888 38 HE1 HIS 5 HE1 HIS 5 96.544 4.035 -84.552 39 HE2 HIS 5 HE2 HIS 5 94.871 2.981 -86.160 40 H HIS 6 H HIS 6 98.536 0.549 -84.325 41 HA HIS 6 HA HIS 6 96.440 -1.403 -84.835 42 HB2 HIS 6 HB2 HIS 6 98.215 -2.877 -83.919 43 HB3 HIS 6 HB3 HIS 6 98.347 -1.843 -82.496 44 HD2 HIS 6 HD2 HIS 6 95.900 -4.313 -84.217 45 HE1 HIS 6 HE1 HIS 6 94.544 -3.846 -80.197 46 HE2 HIS 6 HE2 HIS 6 94.193 -5.120 -82.375 47 H HIS 7 H HIS 7 94.579 -0.824 -83.793 48 HA HIS 7 HA HIS 7 94.564 0.810 -81.377 49 HB2 HIS 7 HB2 HIS 7 94.898 2.487 -83.223 50 HB3 HIS 7 HB3 HIS 7 93.392 1.938 -83.959 51 HD2 HIS 7 HD2 HIS 7 94.606 3.409 -80.536 52 HE1 HIS 7 HE1 HIS 7 90.662 4.879 -81.232 53 HE2 HIS 7 HE2 HIS 7 92.658 4.952 -79.654 54 H HIS 8 H HIS 8 92.421 1.047 -80.464 55 HA HIS 8 HA HIS 8 90.166 -0.350 -81.699 56 HB2 HIS 8 HB2 HIS 8 89.700 -1.803 -79.837 57 HB3 HIS 8 HB3 HIS 8 91.306 -2.165 -80.450 58 HD2 HIS 8 HD2 HIS 8 93.436 -1.362 -78.890 59 HE1 HIS 8 HE1 HIS 8 91.166 -0.798 -75.321 60 HE2 HIS 8 HE2 HIS 8 93.517 -1.001 -76.278 61 H HIS 9 H HIS 9 88.133 0.162 -80.733 62 HA HIS 9 HA HIS 9 88.036 2.464 -78.868 63 HB2 HIS 9 HB2 HIS 9 86.771 3.813 -80.453 64 HB3 HIS 9 HB3 HIS 9 88.355 3.432 -81.106 65 HD2 HIS 9 HD2 HIS 9 84.637 2.980 -81.784 66 HE1 HIS 9 HE1 HIS 9 86.628 0.959 -84.973 67 HE2 HIS 9 HE2 HIS 9 84.376 1.790 -84.122 68 H HIS 10 H HIS 10 85.979 2.993 -78.072 69 HA HIS 10 HA HIS 10 83.616 1.351 -78.586 70 HB2 HIS 10 HB2 HIS 10 83.423 0.489 -76.314 71 HB3 HIS 10 HB3 HIS 10 84.916 -0.087 -77.030 72 HD2 HIS 10 HD2 HIS 10 83.567 1.994 -74.143 73 HE1 HIS 10 HE1 HIS 10 87.814 2.097 -73.732 74 HE2 HIS 10 HE2 HIS 10 85.602 2.673 -72.608 75 H GLY 11 H GLY 11 81.737 2.101 -77.249 76 HA2 GLY 11 HA2 GLY 11 81.773 4.223 -75.434 77 HA3 GLY 11 HA3 GLY 11 81.548 4.980 -77.008 78 H SER 28 H SER 28 79.817 4.547 -74.538 79 HA SER 28 HA SER 28 77.276 3.907 -75.930 80 HB2 SER 28 HB2 SER 28 78.143 2.599 -73.314 81 HB3 SER 28 HB3 SER 28 76.518 2.517 -74.015 82 HG SER 28 HG SER 28 77.790 0.660 -74.524 83 H VAL 29 H VAL 29 75.449 4.873 -74.986 84 HA VAL 29 HA VAL 29 75.797 6.593 -72.569 85 HB VAL 29 HB VAL 29 74.466 7.505 -75.153 86 HG11 VAL 29 HG11 VAL 29 74.780 8.918 -72.463 87 HG12 VAL 29 HG12 VAL 29 74.161 9.658 -73.953 88 HG13 VAL 29 HG13 VAL 29 73.251 8.362 -73.179 89 HG21 VAL 29 HG21 VAL 29 76.908 7.696 -75.318 90 HG22 VAL 29 HG22 VAL 29 76.189 9.295 -75.125 91 HG23 VAL 29 HG23 VAL 29 76.975 8.509 -73.737 92 H SER 30 H SER 30 74.477 5.759 -71.125 93 HA SER 30 HA SER 30 71.745 4.796 -71.889 94 HB2 SER 30 HB2 SER 30 73.706 3.361 -70.065 95 HB3 SER 30 HB3 SER 30 72.085 2.811 -70.523 96 HG SER 30 HG SER 30 73.705 1.796 -71.786 97 H PHE 31 H PHE 31 72.838 7.249 -70.316 98 HA PHE 31 HA PHE 31 71.434 6.807 -67.711 99 HB2 PHE 31 HB2 PHE 31 72.956 8.497 -66.793 100 HB3 PHE 31 HB3 PHE 31 73.783 7.079 -67.395 101 HD1 PHE 31 HD2 PHE 31 72.999 10.660 -68.180 102 HD2 PHE 31 HD1 PHE 31 75.488 7.248 -69.074 103 HE1 PHE 31 HE2 PHE 31 74.487 12.098 -69.550 104 HE2 PHE 31 HE1 PHE 31 76.974 8.695 -70.442 105 HZ PHE 31 HZ PHE 31 76.471 11.119 -70.687 106 H GLY 32 H GLY 32 70.502 8.691 -66.689 107 HA2 GLY 32 HA2 GLY 32 69.822 11.115 -67.109 108 HA3 GLY 32 HA3 GLY 32 69.093 10.529 -68.599 109 H ALA 33 H ALA 33 68.859 10.579 -65.101 110 HA ALA 33 HA ALA 33 65.972 9.896 -65.219 111 HB1 ALA 33 HB1 ALA 33 67.997 8.417 -63.487 112 HB2 ALA 33 HB2 ALA 33 66.230 8.216 -63.434 113 HB3 ALA 33 HB3 ALA 33 67.130 7.755 -64.889 114 HA PRO 34 HA PRO 34 67.059 13.396 -62.267 115 HB2 PRO 34 HB2 PRO 34 65.563 15.397 -63.362 116 HB3 PRO 34 HB3 PRO 34 67.192 14.964 -63.971 117 HG2 PRO 34 HG2 PRO 34 64.501 14.041 -65.048 118 HG3 PRO 34 HG3 PRO 34 65.869 14.758 -65.962 119 HD2 PRO 34 HD2 PRO 34 65.508 12.067 -65.811 120 HD3 PRO 34 HD3 PRO 34 67.147 12.784 -65.781 121 H SER 35 H SER 35 65.698 14.352 -60.659 122 HA SER 35 HA SER 35 62.821 13.756 -60.615 123 HB2 SER 35 HB2 SER 35 62.940 12.653 -58.398 124 HB3 SER 35 HB3 SER 35 63.723 11.718 -59.677 125 HG SER 35 HG SER 35 65.004 11.797 -57.766 126 HA PRO 36 HA PRO 36 62.804 17.604 -58.365 127 HB2 PRO 36 HB2 PRO 36 60.343 17.618 -57.207 128 HB3 PRO 36 HB3 PRO 36 60.569 17.701 -58.982 129 HG2 PRO 36 HG2 PRO 36 59.978 15.241 -57.296 130 HG3 PRO 36 HG3 PRO 36 59.136 15.789 -58.781 131 HD2 PRO 36 HD2 PRO 36 61.111 13.912 -58.849 132 HD3 PRO 36 HD3 PRO 36 60.924 15.116 -60.158 133 H LEU 37 H LEU 37 62.917 18.554 -56.272 134 HA LEU 37 HA LEU 37 62.724 16.934 -53.858 135 HB2 LEU 37 HB2 LEU 37 65.054 17.285 -53.130 136 HB3 LEU 37 HB3 LEU 37 64.892 16.259 -54.532 137 HG LEU 37 HG LEU 37 65.579 18.259 -55.982 138 HD11 LEU 37 HD11 LEU 37 66.381 19.373 -53.253 139 HD12 LEU 37 HD12 LEU 37 67.002 19.957 -54.810 140 HD13 LEU 37 HD13 LEU 37 65.297 20.141 -54.438 141 HD21 LEU 37 HD21 LEU 37 67.069 16.382 -55.419 142 HD22 LEU 37 HD22 LEU 37 67.960 17.906 -55.482 143 HD23 LEU 37 HD23 LEU 37 67.539 17.193 -53.909 144 H SER 38 H SER 38 63.186 18.160 -51.886 145 HA SER 38 HA SER 38 62.768 19.819 -50.439 146 HB2 SER 38 HB2 SER 38 64.814 20.663 -51.664 147 HB3 SER 38 HB3 SER 38 63.738 21.796 -52.508 148 HG SER 38 HG SER 38 64.706 22.648 -50.545 149 H SER 39 H SER 39 61.838 22.177 -50.207 150 HA SER 39 HA SER 39 59.996 23.392 -49.898 151 HB2 SER 39 HB2 SER 39 60.671 23.724 -52.399 152 HB3 SER 39 HB3 SER 39 59.112 22.954 -52.733 153 HG SER 39 HG SER 39 58.987 25.269 -52.570 154 H GLU 40 H GLU 40 59.551 20.254 -49.890 155 HA GLU 40 HA GLU 40 56.940 19.697 -50.717 156 HB2 GLU 40 HB2 GLU 40 58.777 18.087 -50.232 157 HB3 GLU 40 HB3 GLU 40 58.544 18.355 -48.501 158 HG2 GLU 40 HG2 GLU 40 56.263 17.425 -48.647 159 HG3 GLU 40 HG3 GLU 40 56.421 17.266 -50.400 160 H SER 41 H SER 41 57.958 21.031 -47.604 161 HA SER 41 HA SER 41 55.263 20.729 -46.423 162 HB2 SER 41 HB2 SER 41 56.403 21.356 -44.329 163 HB3 SER 41 HB3 SER 41 57.130 19.950 -45.118 164 HG SER 41 HG SER 41 58.717 21.481 -44.399 165 H GLU 42 H GLU 42 56.597 23.092 -48.335 166 HA GLU 42 HA GLU 42 55.198 25.296 -46.875 167 HB2 GLU 42 HB2 GLU 42 57.068 26.758 -47.152 168 HB3 GLU 42 HB3 GLU 42 57.584 25.306 -46.301 169 HG2 GLU 42 HG2 GLU 42 58.530 24.405 -48.423 170 HG3 GLU 42 HG3 GLU 42 58.023 25.872 -49.268 171 H ASP 43 H ASP 43 55.409 23.800 -49.903 172 HA ASP 43 HA ASP 43 55.528 25.915 -51.691 173 HB2 ASP 43 HB2 ASP 43 55.678 23.500 -52.249 174 HB3 ASP 43 HB3 ASP 43 53.950 23.327 -51.940 175 H GLU 44 H GLU 44 52.847 25.106 -49.741 176 HA GLU 44 HA GLU 44 51.080 27.107 -51.095 177 HB2 GLU 44 HB2 GLU 44 49.170 25.937 -50.257 178 HB3 GLU 44 HB3 GLU 44 50.174 24.827 -51.170 179 HG2 GLU 44 HG2 GLU 44 50.217 25.000 -48.121 180 HG3 GLU 44 HG3 GLU 44 49.131 23.956 -49.018 181 H ILE 45 H ILE 45 53.128 27.079 -48.578 182 HA ILE 45 HA ILE 45 51.317 28.313 -46.567 183 HB ILE 45 HB ILE 45 54.217 27.480 -46.302 184 HG12 ILE 45 HG12 ILE 45 52.876 25.493 -46.665 185 HG13 ILE 45 HG13 ILE 45 53.413 25.575 -45.002 186 HG21 ILE 45 HG21 ILE 45 52.173 28.402 -44.230 187 HG22 ILE 45 HG22 ILE 45 53.738 27.655 -43.846 188 HG23 ILE 45 HG23 ILE 45 53.689 29.207 -44.677 189 HD11 ILE 45 HD11 ILE 45 50.596 26.242 -45.974 190 HD12 ILE 45 HD12 ILE 45 51.109 24.760 -45.156 191 HD13 ILE 45 HD13 ILE 45 51.148 26.297 -44.282 192 H ASN 46 H ASN 46 50.860 30.313 -47.277 193 HA ASN 46 HA ASN 46 52.917 32.336 -46.741 194 HB2 ASN 46 HB2 ASN 46 53.150 31.910 -49.191 195 HB3 ASN 46 HB3 ASN 46 51.434 32.246 -49.413 196 HD21 ASN 46 HD22 ASN 46 52.575 33.792 -51.013 197 HD22 ASN 46 HD21 ASN 46 52.949 35.387 -50.372 198 H TYR 47 H TYR 47 51.976 33.744 -45.369 199 HA TYR 47 HA TYR 47 49.370 34.914 -45.992 200 HB2 TYR 47 HB2 TYR 47 48.712 32.990 -44.600 201 HB3 TYR 47 HB3 TYR 47 49.807 33.507 -43.329 202 HD1 TYR 47 HD1 TYR 47 46.760 34.481 -45.274 203 HD2 TYR 47 HD2 TYR 47 49.126 35.184 -41.732 204 HE1 TYR 47 HE1 TYR 47 44.954 35.926 -44.355 205 HE2 TYR 47 HE2 TYR 47 47.314 36.631 -40.814 206 HH TYR 47 HH TYR 47 44.262 37.245 -42.600 207 H MET 48 H MET 48 50.057 36.911 -46.166 208 HA MET 48 HA MET 48 50.893 38.934 -45.835 209 HB2 MET 48 HB2 MET 48 49.359 38.727 -43.870 210 HB3 MET 48 HB3 MET 48 50.748 38.351 -42.860 211 HG2 MET 48 HG2 MET 48 49.990 40.703 -42.699 212 HG3 MET 48 HG3 MET 48 51.670 40.548 -43.160 213 HE1 MET 48 HE1 MET 48 48.052 41.534 -44.265 214 HE2 MET 48 HE2 MET 48 48.254 41.936 -45.984 215 HE3 MET 48 HE3 MET 48 48.375 40.247 -45.451 216 H THR 49 H THR 49 52.676 40.328 -45.264 217 HA THR 49 HA THR 49 55.249 38.939 -44.614 218 HB THR 49 HB THR 49 56.303 40.457 -46.338 219 HG1 THR 49 HG1 THR 49 54.943 41.225 -47.963 220 HG21 THR 49 HG21 THR 49 54.327 38.396 -47.405 221 HG22 THR 49 HG22 THR 49 55.800 38.982 -48.209 222 HG23 THR 49 HG23 THR 49 55.926 38.034 -46.720 223 HA PRO 50 HA PRO 50 54.481 42.764 -42.063 224 HB2 PRO 50 HB2 PRO 50 54.624 41.757 -39.538 225 HB3 PRO 50 HB3 PRO 50 53.150 41.611 -40.547 226 HG2 PRO 50 HG2 PRO 50 55.353 39.549 -40.163 227 HG3 PRO 50 HG3 PRO 50 53.583 39.313 -40.011 228 HD2 PRO 50 HD2 PRO 50 54.947 38.721 -42.307 229 HD3 PRO 50 HD3 PRO 50 53.281 39.361 -42.333 230 HA PRO 51 HA PRO 51 58.893 43.301 -41.176 231 HB2 PRO 51 HB2 PRO 51 58.880 45.551 -39.640 232 HB3 PRO 51 HB3 PRO 51 58.526 45.566 -41.394 233 HG2 PRO 51 HG2 PRO 51 56.546 45.575 -39.096 234 HG3 PRO 51 HG3 PRO 51 56.549 46.597 -40.565 235 HD2 PRO 51 HD2 PRO 51 55.030 44.321 -40.332 236 HD3 PRO 51 HD3 PRO 51 55.713 44.859 -41.895 237 H GLU 52 H GLU 52 59.848 41.856 -39.888 238 HA GLU 52 HA GLU 52 59.284 41.755 -36.959 239 HB2 GLU 52 HB2 GLU 52 59.372 39.443 -38.931 240 HB3 GLU 52 HB3 GLU 52 59.532 39.216 -37.195 241 HG2 GLU 52 HG2 GLU 52 57.085 40.586 -38.381 242 HG3 GLU 52 HG3 GLU 52 57.241 38.843 -38.294 243 H GLN 53 H GLN 53 61.001 41.313 -35.655 244 HA GLN 53 HA GLN 53 63.645 40.652 -36.834 245 HB2 GLN 53 HB2 GLN 53 63.284 43.145 -36.926 246 HB3 GLN 53 HB3 GLN 53 63.168 43.158 -35.164 247 HG2 GLN 53 HG2 GLN 53 65.496 42.366 -34.982 248 HG3 GLN 53 HG3 GLN 53 65.594 42.170 -36.736 249 HE21 GLN 53 HE22 GLN 53 65.502 44.191 -38.087 250 HE22 GLN 53 HE21 GLN 53 66.023 45.698 -37.345 251 H GLU 54 H GLU 54 61.599 40.818 -33.964 252 HA GLU 54 HA GLU 54 63.579 39.218 -32.423 253 HB2 GLU 54 HB2 GLU 54 62.086 41.677 -31.420 254 HB3 GLU 54 HB3 GLU 54 63.020 40.563 -30.416 255 HG2 GLU 54 HG2 GLU 54 65.071 41.120 -31.718 256 HG3 GLU 54 HG3 GLU 54 64.145 42.298 -32.654 257 H ALA 55 H ALA 55 62.781 37.716 -31.123 258 HA ALA 55 HA ALA 55 59.868 37.494 -30.549 259 HB1 ALA 55 HB1 ALA 55 61.632 35.271 -31.671 260 HB2 ALA 55 HB2 ALA 55 59.928 35.116 -31.185 261 HB3 ALA 55 HB3 ALA 55 60.364 36.144 -32.559 262 H GLN 56 H GLN 56 61.530 38.579 -28.747 263 HA GLN 56 HA GLN 56 61.935 36.551 -26.631 264 HB2 GLN 56 HB2 GLN 56 64.274 37.295 -26.250 265 HB3 GLN 56 HB3 GLN 56 64.015 36.390 -27.730 266 HG2 GLN 56 HG2 GLN 56 64.109 38.470 -29.072 267 HG3 GLN 56 HG3 GLN 56 64.326 39.429 -27.607 268 HE21 GLN 56 HE22 GLN 56 65.869 36.882 -29.639 269 HE22 GLN 56 HE21 GLN 56 67.489 37.233 -29.068 270 HA PRO 57 HA PRO 57 60.418 40.758 -25.325 271 HB2 PRO 57 HB2 PRO 57 57.843 40.321 -24.711 272 HB3 PRO 57 HB3 PRO 57 58.420 40.290 -26.411 273 HG2 PRO 57 HG2 PRO 57 58.032 37.886 -24.580 274 HG3 PRO 57 HG3 PRO 57 57.325 38.155 -26.208 275 HD2 PRO 57 HD2 PRO 57 59.663 36.777 -25.844 276 HD3 PRO 57 HD3 PRO 57 59.371 37.818 -27.268 277 H GLY 58 H GLY 58 62.183 39.865 -23.806 278 HA2 GLY 58 HA2 GLY 58 62.911 39.955 -21.571 279 HA3 GLY 58 HA3 GLY 58 61.262 39.782 -20.983 280 H ALA 59 H ALA 59 63.537 38.353 -20.025 281 HA ALA 59 HA ALA 59 62.649 35.574 -20.315 282 HB1 ALA 59 HB1 ALA 59 65.463 36.467 -21.095 283 HB2 ALA 59 HB2 ALA 59 64.938 34.777 -20.913 284 HB3 ALA 59 HB3 ALA 59 64.237 35.791 -22.187 285 H LEU 60 H LEU 60 63.405 34.216 -18.685 286 HA LEU 60 HA LEU 60 64.552 35.508 -16.241 287 HB2 LEU 60 HB2 LEU 60 62.702 33.144 -16.680 288 HB3 LEU 60 HB3 LEU 60 63.681 33.264 -15.230 289 HG LEU 60 HG LEU 60 62.666 35.439 -14.656 290 HD11 LEU 60 HD11 LEU 60 60.845 34.906 -17.044 291 HD12 LEU 60 HD12 LEU 60 60.507 36.081 -15.753 292 HD13 LEU 60 HD13 LEU 60 61.908 36.315 -16.794 293 HD21 LEU 60 HD21 LEU 60 61.786 33.315 -13.758 294 HD22 LEU 60 HD22 LEU 60 60.498 34.511 -13.964 295 HD23 LEU 60 HD23 LEU 60 60.672 33.185 -15.139 296 H ALA 61 H ALA 61 66.045 34.217 -14.950 297 HA ALA 61 HA ALA 61 67.602 32.149 -16.335 298 HB1 ALA 61 HB1 ALA 61 68.736 34.812 -15.379 299 HB2 ALA 61 HB2 ALA 61 69.728 33.408 -15.823 300 HB3 ALA 61 HB3 ALA 61 68.703 34.179 -17.042 301 H ALA 62 H ALA 62 69.027 30.975 -15.010 302 HA ALA 62 HA ALA 62 68.423 31.000 -12.089 303 HB1 ALA 62 HB1 ALA 62 69.695 28.855 -13.830 304 HB2 ALA 62 HB2 ALA 62 69.337 28.722 -12.097 305 HB3 ALA 62 HB3 ALA 62 68.011 28.882 -13.265 306 H LEU 63 H LEU 63 70.121 30.808 -10.581 307 HA LEU 63 HA LEU 63 72.847 31.685 -11.420 308 HB2 LEU 63 HB2 LEU 63 71.216 32.753 -9.078 309 HB3 LEU 63 HB3 LEU 63 72.907 33.124 -9.384 310 HG LEU 63 HG LEU 63 70.587 33.927 -11.196 311 HD11 LEU 63 HD11 LEU 63 72.327 35.573 -9.313 312 HD12 LEU 63 HD12 LEU 63 71.037 36.189 -10.368 313 HD13 LEU 63 HD13 LEU 63 70.635 35.113 -9.022 314 HD21 LEU 63 HD21 LEU 63 72.602 33.711 -12.536 315 HD22 LEU 63 HD22 LEU 63 72.328 35.424 -12.226 316 HD23 LEU 63 HD23 LEU 63 73.568 34.559 -11.307 317 H HIS 64 H HIS 64 74.520 31.152 -9.922 318 HA HIS 64 HA HIS 64 74.090 28.747 -8.243 319 HB2 HIS 64 HB2 HIS 64 76.462 30.448 -9.008 320 HB3 HIS 64 HB3 HIS 64 76.580 29.224 -7.751 321 HD2 HIS 64 HD2 HIS 64 76.931 29.694 -11.417 322 HE1 HIS 64 HE1 HIS 64 76.636 25.472 -10.898 323 HE2 HIS 64 HE2 HIS 64 77.270 27.316 -12.519 324 H ALA 65 H ALA 65 74.016 28.776 -6.007 325 HA ALA 65 HA ALA 65 73.517 31.430 -4.767 326 HB1 ALA 65 HB1 ALA 65 72.793 28.614 -3.872 327 HB2 ALA 65 HB2 ALA 65 72.245 30.134 -3.133 328 HB3 ALA 65 HB3 ALA 65 71.741 29.725 -4.783 329 H GLU 66 H GLU 66 75.990 29.017 -4.693 330 HA GLU 66 HA GLU 66 77.187 30.141 -2.201 331 HB2 GLU 66 HB2 GLU 66 76.733 27.185 -2.797 332 HB3 GLU 66 HB3 GLU 66 77.733 27.816 -1.487 333 HG2 GLU 66 HG2 GLU 66 75.728 28.979 -0.541 334 HG3 GLU 66 HG3 GLU 66 74.729 28.212 -1.782 335 H GLY 67 H GLY 67 79.459 29.519 -1.891 336 HA2 GLY 67 HA2 GLY 67 81.643 29.176 -2.577 337 HA3 GLY 67 HA3 GLY 67 81.019 28.366 -4.009 338 HA PRO 68 HA PRO 68 83.174 32.323 -5.191 339 HB2 PRO 68 HB2 PRO 68 84.586 31.390 -7.353 340 HB3 PRO 68 HB3 PRO 68 85.114 31.181 -5.656 341 HG2 PRO 68 HG2 PRO 68 83.591 29.199 -7.383 342 HG3 PRO 68 HG3 PRO 68 85.076 28.911 -6.416 343 HD2 PRO 68 HD2 PRO 68 82.633 28.282 -5.450 344 HD3 PRO 68 HD3 PRO 68 83.870 29.001 -4.375 345 H LEU 69 H LEU 69 81.003 30.231 -6.938 346 HA LEU 69 HA LEU 69 80.439 32.269 -9.013 347 HB2 LEU 69 HB2 LEU 69 79.506 29.419 -8.614 348 HB3 LEU 69 HB3 LEU 69 78.844 30.473 -9.855 349 HG LEU 69 HG LEU 69 81.802 29.799 -9.690 350 HD11 LEU 69 HD11 LEU 69 79.633 28.593 -11.444 351 HD12 LEU 69 HD12 LEU 69 81.370 28.217 -11.496 352 HD13 LEU 69 HD13 LEU 69 80.418 27.782 -10.072 353 HD21 LEU 69 HD21 LEU 69 81.378 31.855 -10.961 354 HD22 LEU 69 HD22 LEU 69 81.796 30.545 -12.066 355 HD23 LEU 69 HD23 LEU 69 80.102 31.040 -11.902 356 H ALA 70 H ALA 70 79.467 32.146 -5.841 357 HA ALA 70 HA ALA 70 76.665 32.172 -6.007 358 HB1 ALA 70 HB1 ALA 70 78.480 33.710 -4.099 359 HB2 ALA 70 HB2 ALA 70 76.752 33.378 -3.849 360 HB3 ALA 70 HB3 ALA 70 77.913 32.040 -3.893 361 H GLY 71 H GLY 71 75.358 33.360 -7.138 362 HA2 GLY 71 HA2 GLY 71 74.249 35.335 -7.832 363 HA3 GLY 71 HA3 GLY 71 75.684 36.296 -7.496 364 H LEU 72 H LEU 72 76.697 33.597 -9.259 365 HA LEU 72 HA LEU 72 76.615 35.036 -11.853 366 HB2 LEU 72 HB2 LEU 72 78.593 32.991 -10.729 367 HB3 LEU 72 HB3 LEU 72 78.605 33.533 -12.358 368 HG LEU 72 HG LEU 72 78.636 35.967 -11.307 369 HD11 LEU 72 HD11 LEU 72 80.077 34.403 -9.134 370 HD12 LEU 72 HD12 LEU 72 80.020 36.161 -9.320 371 HD13 LEU 72 HD13 LEU 72 78.554 35.280 -8.916 372 HD21 LEU 72 HD21 LEU 72 80.382 35.048 -12.769 373 HD22 LEU 72 HD22 LEU 72 81.105 35.938 -11.432 374 HD23 LEU 72 HD23 LEU 72 81.089 34.162 -11.402 375 HA PRO 73 HA PRO 73 73.844 32.335 -13.720 376 HB2 PRO 73 HB2 PRO 73 74.745 31.998 -16.293 377 HB3 PRO 73 HB3 PRO 73 74.186 33.581 -15.652 378 HG2 PRO 73 HG2 PRO 73 77.025 32.505 -15.836 379 HG3 PRO 73 HG3 PRO 73 76.411 34.085 -16.418 380 HD2 PRO 73 HD2 PRO 73 77.607 33.876 -14.058 381 HD3 PRO 73 HD3 PRO 73 76.168 34.915 -14.221 382 H VAL 74 H VAL 74 73.312 30.189 -14.619 383 HA VAL 74 HA VAL 74 75.397 28.160 -13.954 384 HB VAL 74 HB VAL 74 72.438 27.684 -14.309 385 HG11 VAL 74 HG11 VAL 74 74.643 26.036 -13.010 386 HG12 VAL 74 HG12 VAL 74 72.911 25.644 -13.001 387 HG13 VAL 74 HG13 VAL 74 73.794 25.654 -14.526 388 HG21 VAL 74 HG21 VAL 74 72.718 29.222 -12.419 389 HG22 VAL 74 HG22 VAL 74 72.331 27.608 -11.830 390 HG23 VAL 74 HG23 VAL 74 74.005 28.198 -11.745 391 H THR 75 H THR 75 73.236 29.102 -16.657 392 HA THR 75 HA THR 75 74.777 27.266 -18.458 393 HB THR 75 HB THR 75 72.826 26.998 -19.787 394 HG1 THR 75 HG1 THR 75 70.842 28.031 -18.960 395 HG21 THR 75 HG21 THR 75 71.914 26.762 -16.903 396 HG22 THR 75 HG22 THR 75 71.390 25.803 -18.307 397 HG23 THR 75 HG23 THR 75 73.050 25.643 -17.691 398 H ARG 76 H ARG 76 74.579 27.850 -20.846 399 HA ARG 76 HA ARG 76 75.760 30.410 -21.422 400 HB2 ARG 76 HB2 ARG 76 76.006 28.351 -22.806 401 HB3 ARG 76 HB3 ARG 76 74.290 28.416 -23.221 402 HG2 ARG 76 HG2 ARG 76 74.685 30.631 -24.351 403 HG3 ARG 76 HG3 ARG 76 76.413 30.478 -23.977 404 HD2 ARG 76 HD2 ARG 76 76.498 28.370 -25.302 405 HD3 ARG 76 HD3 ARG 76 74.766 28.483 -25.597 406 HE ARG 76 HE ARG 76 75.064 30.254 -27.101 407 HH11 ARG 76 HH11 ARG 76 78.263 29.290 -25.896 408 HH12 ARG 76 HH12 ARG 76 79.025 30.171 -27.230 409 HH21 ARG 76 HH21 ARG 76 76.272 31.306 -28.712 410 HH22 ARG 76 HH22 ARG 76 78.032 31.167 -28.627 411 H SER 77 H SER 77 72.399 29.233 -21.710 412 HA SER 77 HA SER 77 71.201 31.645 -22.635 413 HB2 SER 77 HB2 SER 77 69.992 29.521 -20.819 414 HB3 SER 77 HB3 SER 77 69.110 30.717 -21.790 415 HG SER 77 HG SER 77 69.257 28.669 -22.858 416 H ASP 78 H ASP 78 71.770 30.472 -19.231 417 HA ASP 78 HA ASP 78 70.659 32.794 -17.983 418 HB2 ASP 78 HB2 ASP 78 72.934 31.026 -17.041 419 HB3 ASP 78 HB3 ASP 78 72.082 32.208 -16.051 420 H ALA 79 H ALA 79 74.083 32.131 -18.969 421 HA ALA 79 HA ALA 79 75.146 34.596 -18.083 422 HB1 ALA 79 HB1 ALA 79 76.013 32.730 -20.342 423 HB2 ALA 79 HB2 ALA 79 76.999 34.044 -19.691 424 HB3 ALA 79 HB3 ALA 79 76.553 32.678 -18.645 425 H ARG 80 H ARG 80 73.692 33.855 -21.292 426 HA ARG 80 HA ARG 80 74.112 36.511 -22.343 427 HB2 ARG 80 HB2 ARG 80 73.638 34.439 -23.653 428 HB3 ARG 80 HB3 ARG 80 71.964 34.474 -23.116 429 HG2 ARG 80 HG2 ARG 80 73.236 36.849 -24.540 430 HG3 ARG 80 HG3 ARG 80 72.642 35.461 -25.443 431 HD2 ARG 80 HD2 ARG 80 70.386 35.774 -24.552 432 HD3 ARG 80 HD3 ARG 80 70.917 37.177 -23.615 433 HE ARG 80 HE ARG 80 71.674 37.712 -26.249 434 HH11 ARG 80 HH11 ARG 80 68.578 37.225 -24.632 435 HH12 ARG 80 HH12 ARG 80 67.758 38.230 -25.823 436 HH21 ARG 80 HH21 ARG 80 70.480 39.037 -27.652 437 HH22 ARG 80 HH22 ARG 80 68.753 39.174 -27.380 438 H VAL 81 H VAL 81 71.299 35.118 -20.586 439 HA VAL 81 HA VAL 81 69.680 37.503 -20.699 440 HB VAL 81 HB VAL 81 69.744 35.219 -18.702 441 HG11 VAL 81 HG11 VAL 81 67.704 37.481 -18.978 442 HG12 VAL 81 HG12 VAL 81 67.416 35.983 -18.076 443 HG13 VAL 81 HG13 VAL 81 68.672 37.095 -17.537 444 HG21 VAL 81 HG21 VAL 81 69.064 34.685 -21.048 445 HG22 VAL 81 HG22 VAL 81 67.752 34.466 -19.882 446 HG23 VAL 81 HG23 VAL 81 67.791 35.905 -20.934 447 H LEU 82 H LEU 82 71.944 36.365 -18.131 448 HA LEU 82 HA LEU 82 71.634 38.697 -16.541 449 HB2 LEU 82 HB2 LEU 82 73.728 36.508 -16.722 450 HB3 LEU 82 HB3 LEU 82 74.101 37.949 -15.804 451 HG LEU 82 HG LEU 82 73.327 36.271 -14.323 452 HD11 LEU 82 HD11 LEU 82 71.063 38.285 -14.544 453 HD12 LEU 82 HD12 LEU 82 71.665 37.484 -13.090 454 HD13 LEU 82 HD13 LEU 82 72.682 38.682 -13.909 455 HD21 LEU 82 HD21 LEU 82 71.921 34.870 -15.660 456 HD22 LEU 82 HD22 LEU 82 70.993 35.448 -14.280 457 HD23 LEU 82 HD23 LEU 82 70.726 36.176 -15.875 458 H ILE 83 H ILE 83 74.128 38.117 -19.113 459 HA ILE 83 HA ILE 83 75.372 40.682 -18.913 460 HB ILE 83 HB ILE 83 74.867 38.826 -21.261 461 HG12 ILE 83 HG12 ILE 83 77.459 39.724 -19.917 462 HG13 ILE 83 HG13 ILE 83 76.541 38.322 -19.381 463 HG21 ILE 83 HG21 ILE 83 76.362 41.493 -21.372 464 HG22 ILE 83 HG22 ILE 83 76.393 40.256 -22.639 465 HG23 ILE 83 HG23 ILE 83 74.897 41.090 -22.285 466 HD11 ILE 83 HD11 ILE 83 77.853 38.640 -22.107 467 HD12 ILE 83 HD12 ILE 83 78.339 37.567 -20.789 468 HD13 ILE 83 HD13 ILE 83 76.802 37.282 -21.630 469 H PHE 84 H PHE 84 72.510 39.704 -20.857 470 HA PHE 84 HA PHE 84 72.018 42.245 -21.929 471 HB2 PHE 84 HB2 PHE 84 71.052 40.012 -22.668 472 HB3 PHE 84 HB3 PHE 84 69.933 40.110 -21.327 473 HD1 PHE 84 HD1 PHE 84 71.144 42.678 -23.851 474 HD2 PHE 84 HD2 PHE 84 67.770 40.557 -22.183 475 HE1 PHE 84 HE1 PHE 84 69.659 43.870 -25.375 476 HE2 PHE 84 HE2 PHE 84 66.258 41.809 -23.704 477 HZ PHE 84 HZ PHE 84 67.190 43.455 -25.319 478 H ASN 85 H ASN 85 70.424 40.801 -19.005 479 HA ASN 85 HA ASN 85 68.873 43.200 -18.689 480 HB2 ASN 85 HB2 ASN 85 68.143 40.847 -18.126 481 HB3 ASN 85 HB3 ASN 85 69.171 40.946 -16.692 482 HD21 ASN 85 HD22 ASN 85 66.742 43.078 -18.384 483 HD22 ASN 85 HD21 ASN 85 65.888 43.458 -16.890 484 H GLU 86 H GLU 86 71.865 42.068 -17.062 485 HA GLU 86 HA GLU 86 71.909 44.246 -15.138 486 HB2 GLU 86 HB2 GLU 86 74.176 42.616 -16.358 487 HB3 GLU 86 HB3 GLU 86 74.379 43.815 -15.091 488 HG2 GLU 86 HG2 GLU 86 72.617 41.341 -14.797 489 HG3 GLU 86 HG3 GLU 86 74.285 41.459 -14.251 490 H TRP 87 H TRP 87 73.221 43.894 -18.543 491 HA TRP 87 HA TRP 87 74.140 46.597 -18.666 492 HB2 TRP 87 HB2 TRP 87 74.822 45.046 -20.349 493 HB3 TRP 87 HB3 TRP 87 73.161 44.682 -20.778 494 HD1 TRP 87 HD1 TRP 87 75.683 47.604 -21.135 495 HE1 TRP 87 HE1 TRP 87 75.119 48.822 -23.315 496 HE3 TRP 87 HE3 TRP 87 71.338 45.169 -22.341 497 HZ2 TRP 87 HZ2 TRP 87 73.104 48.710 -25.354 498 HZ3 TRP 87 HZ3 TRP 87 70.218 45.662 -24.444 499 HH2 TRP 87 HH2 TRP 87 71.043 47.448 -25.975 500 H GLU 88 H GLU 88 70.845 45.267 -19.576 501 HA GLU 88 HA GLU 88 69.703 47.652 -20.433 502 HB2 GLU 88 HB2 GLU 88 68.534 45.330 -18.865 503 HB3 GLU 88 HB3 GLU 88 67.567 46.705 -19.333 504 HG2 GLU 88 HG2 GLU 88 67.973 46.321 -21.688 505 HG3 GLU 88 HG3 GLU 88 68.970 44.920 -21.335 506 H GLU 89 H GLU 89 69.811 46.554 -16.963 507 HA GLU 89 HA GLU 89 68.526 48.960 -16.000 508 HB2 GLU 89 HB2 GLU 89 70.298 46.915 -14.603 509 HB3 GLU 89 HB3 GLU 89 69.460 48.223 -13.770 510 HG2 GLU 89 HG2 GLU 89 68.084 46.043 -15.398 511 HG3 GLU 89 HG3 GLU 89 68.276 46.040 -13.650 512 H ARG 90 H ARG 90 72.005 48.038 -16.095 513 HA ARG 90 HA ARG 90 72.987 50.500 -14.930 514 HB2 ARG 90 HB2 ARG 90 74.292 48.573 -16.900 515 HB3 ARG 90 HB3 ARG 90 75.152 49.859 -16.039 516 HG2 ARG 90 HG2 ARG 90 73.647 47.638 -14.641 517 HG3 ARG 90 HG3 ARG 90 75.346 47.518 -15.105 518 HD2 ARG 90 HD2 ARG 90 75.872 49.493 -13.699 519 HD3 ARG 90 HD3 ARG 90 74.185 49.624 -13.211 520 HE ARG 90 HE ARG 90 76.187 47.675 -12.302 521 HH11 ARG 90 HH11 ARG 90 72.733 48.338 -12.318 522 HH12 ARG 90 HH12 ARG 90 72.430 47.223 -11.016 523 HH21 ARG 90 HH21 ARG 90 75.717 46.275 -10.660 524 HH22 ARG 90 HH22 ARG 90 74.080 46.071 -10.117 525 H LYS 91 H LYS 91 72.521 49.552 -18.265 526 HA LYS 91 HA LYS 91 73.235 52.005 -19.541 527 HB2 LYS 91 HB2 LYS 91 72.932 49.793 -20.721 528 HB3 LYS 91 HB3 LYS 91 71.212 49.858 -20.361 529 HG2 LYS 91 HG2 LYS 91 71.341 50.301 -22.594 530 HG3 LYS 91 HG3 LYS 91 71.030 51.882 -21.888 531 HD2 LYS 91 HD2 LYS 91 73.349 52.546 -22.232 532 HD3 LYS 91 HD3 LYS 91 73.804 50.877 -22.630 533 HE2 LYS 91 HE2 LYS 91 72.308 50.930 -24.613 534 HE3 LYS 91 HE3 LYS 91 71.930 52.623 -24.276 535 HZ1 LYS 91 HZ1 LYS 91 74.716 51.649 -24.777 536 HZ2 LYS 91 HZ2 LYS 91 73.748 52.286 -25.947 537 HZ3 LYS 91 HZ3 LYS 91 74.202 53.221 -24.689 538 H LYS 92 H LYS 92 70.014 51.002 -18.233 539 HA LYS 92 HA LYS 92 68.640 53.386 -19.026 540 HB2 LYS 92 HB2 LYS 92 67.592 51.285 -18.147 541 HB3 LYS 92 HB3 LYS 92 68.163 51.708 -16.523 542 HG2 LYS 92 HG2 LYS 92 66.835 53.781 -16.582 543 HG3 LYS 92 HG3 LYS 92 66.331 53.422 -18.248 544 HD2 LYS 92 HD2 LYS 92 65.212 51.347 -17.456 545 HD3 LYS 92 HD3 LYS 92 65.713 51.717 -15.789 546 HE2 LYS 92 HE2 LYS 92 64.441 53.850 -15.881 547 HE3 LYS 92 HE3 LYS 92 63.953 53.498 -17.542 548 HZ1 LYS 92 HZ1 LYS 92 63.223 51.849 -15.169 549 HZ2 LYS 92 HZ2 LYS 92 62.218 52.863 -15.959 550 HZ3 LYS 92 HZ3 LYS 92 62.771 51.523 -16.708 551 H SER 93 H SER 93 70.735 52.728 -16.179 552 HA SER 93 HA SER 93 70.633 55.553 -15.350 553 HB2 SER 93 HB2 SER 93 72.527 53.332 -14.527 554 HB3 SER 93 HB3 SER 93 72.452 54.951 -13.813 555 HG SER 93 HG SER 93 71.192 53.426 -12.623 556 H GLU 94 H GLU 94 72.549 53.849 -17.686 557 HA GLU 94 HA GLU 94 74.498 56.090 -18.043 558 HB2 GLU 94 HB2 GLU 94 75.102 53.099 -18.020 559 HB3 GLU 94 HB3 GLU 94 76.234 54.408 -18.304 560 HG2 GLU 94 HG2 GLU 94 75.690 55.243 -15.963 561 HG3 GLU 94 HG3 GLU 94 74.769 53.747 -15.751 562 HA PRO 95 HA PRO 95 72.419 54.852 -22.038 563 HB2 PRO 95 HB2 PRO 95 72.616 57.331 -23.317 564 HB3 PRO 95 HB3 PRO 95 71.273 56.788 -22.271 565 HG2 PRO 95 HG2 PRO 95 73.682 58.456 -21.498 566 HG3 PRO 95 HG3 PRO 95 71.957 58.746 -21.102 567 HD2 PRO 95 HD2 PRO 95 73.582 57.593 -19.300 568 HD3 PRO 95 HD3 PRO 95 71.930 56.950 -19.530 569 H TRP 96 H TRP 96 75.604 56.051 -21.430 570 HA TRP 96 HA TRP 96 76.703 55.611 -24.099 571 HB2 TRP 96 HB2 TRP 96 78.850 56.055 -22.897 572 HB3 TRP 96 HB3 TRP 96 77.644 57.316 -22.753 573 HD1 TRP 96 HD1 TRP 96 79.363 54.605 -20.659 574 HE1 TRP 96 HE1 TRP 96 79.029 55.106 -18.155 575 HE3 TRP 96 HE3 TRP 96 76.153 58.586 -21.037 576 HZ2 TRP 96 HZ2 TRP 96 77.568 56.981 -16.536 577 HZ3 TRP 96 HZ3 TRP 96 75.284 59.692 -18.988 578 HH2 TRP 96 HH2 TRP 96 75.974 58.896 -16.739 579 H LEU 97 H LEU 97 75.868 53.337 -21.584 580 HA LEU 97 HA LEU 97 78.171 51.795 -21.577 581 HB2 LEU 97 HB2 LEU 97 76.128 51.838 -19.974 582 HB3 LEU 97 HB3 LEU 97 75.369 50.731 -21.079 583 HG LEU 97 HG LEU 97 77.241 49.162 -20.731 584 HD11 LEU 97 HD11 LEU 97 78.136 51.152 -18.601 585 HD12 LEU 97 HD12 LEU 97 78.709 49.476 -18.718 586 HD13 LEU 97 HD13 LEU 97 79.083 50.615 -20.008 587 HD21 LEU 97 HD21 LEU 97 75.126 49.073 -19.384 588 HD22 LEU 97 HD22 LEU 97 76.521 48.484 -18.459 589 HD23 LEU 97 HD23 LEU 97 75.892 50.127 -18.182 590 H ARG 98 H ARG 98 79.005 50.152 -22.693 591 HA ARG 98 HA ARG 98 77.861 49.338 -25.271 592 HB2 ARG 98 HB2 ARG 98 80.201 50.059 -24.975 593 HB3 ARG 98 HB3 ARG 98 80.496 48.701 -23.881 594 HG2 ARG 98 HG2 ARG 98 80.136 47.104 -25.708 595 HG3 ARG 98 HG3 ARG 98 79.685 48.428 -26.809 596 HD2 ARG 98 HD2 ARG 98 81.949 49.375 -26.602 597 HD3 ARG 98 HD3 ARG 98 82.392 48.094 -25.450 598 HE ARG 98 HE ARG 98 81.445 46.847 -27.822 599 HH11 ARG 98 HH11 ARG 98 84.230 48.754 -26.875 600 HH12 ARG 98 HH12 ARG 98 85.258 48.021 -28.077 601 HH21 ARG 98 HH21 ARG 98 82.813 45.937 -29.319 602 HH22 ARG 98 HH22 ARG 98 84.464 46.469 -29.429 603 H LEU 99 H LEU 99 77.603 47.205 -25.947 604 HA LEU 99 HA LEU 99 77.055 45.112 -23.890 605 HB2 LEU 99 HB2 LEU 99 75.099 46.409 -24.578 606 HB3 LEU 99 HB3 LEU 99 75.358 46.047 -26.249 607 HG LEU 99 HG LEU 99 73.479 44.865 -25.126 608 HD11 LEU 99 HD11 LEU 99 75.455 42.799 -26.099 609 HD12 LEU 99 HD12 LEU 99 73.706 42.934 -26.410 610 HD13 LEU 99 HD13 LEU 99 74.810 44.040 -27.188 611 HD21 LEU 99 HD21 LEU 99 74.795 44.495 -22.960 612 HD22 LEU 99 HD22 LEU 99 73.553 43.384 -23.492 613 HD23 LEU 99 HD23 LEU 99 75.294 42.975 -23.728 614 H ASP 100 H ASP 100 77.954 43.145 -24.422 615 HA ASP 100 HA ASP 100 78.430 42.442 -27.256 616 HB2 ASP 100 HB2 ASP 100 80.517 43.542 -26.275 617 HB3 ASP 100 HB3 ASP 100 80.646 42.153 -25.197 618 H MET 101 H MET 101 78.060 40.343 -27.683 619 HA MET 101 HA MET 101 77.663 38.404 -25.444 620 HB2 MET 101 HB2 MET 101 75.769 38.939 -27.763 621 HB3 MET 101 HB3 MET 101 75.610 37.608 -26.608 622 HG2 MET 101 HG2 MET 101 75.326 39.139 -24.756 623 HG3 MET 101 HG3 MET 101 75.577 40.537 -25.809 624 HE1 MET 101 HE1 MET 101 73.234 41.656 -24.867 625 HE2 MET 101 HE2 MET 101 71.758 40.677 -24.816 626 HE3 MET 101 HE3 MET 101 73.156 40.212 -23.821 627 H SER 102 H SER 102 79.875 38.819 -27.493 628 HA SER 102 HA SER 102 79.853 36.538 -29.290 629 HB2 SER 102 HB2 SER 102 81.326 38.507 -29.585 630 HB3 SER 102 HB3 SER 102 82.190 38.080 -28.093 631 HG SER 102 HG SER 102 83.168 37.299 -30.108 632 H ASP 103 H ASP 103 81.033 34.553 -29.042 633 HA ASP 103 HA ASP 103 80.624 33.100 -26.665 634 HB2 ASP 103 HB2 ASP 103 82.698 32.669 -28.863 635 HB3 ASP 103 HB3 ASP 103 82.248 31.480 -27.643 636 H LYS 104 H LYS 104 83.522 34.882 -27.699 637 HA LYS 104 HA LYS 104 85.299 34.161 -25.584 638 HB2 LYS 104 HB2 LYS 104 85.115 36.712 -27.251 639 HB3 LYS 104 HB3 LYS 104 86.467 36.293 -26.191 640 HG2 LYS 104 HG2 LYS 104 86.892 34.238 -27.502 641 HG3 LYS 104 HG3 LYS 104 85.560 34.651 -28.599 642 HD2 LYS 104 HD2 LYS 104 86.709 36.788 -29.170 643 HD3 LYS 104 HD3 LYS 104 88.076 36.331 -28.152 644 HE2 LYS 104 HE2 LYS 104 87.073 34.736 -30.563 645 HE3 LYS 104 HE3 LYS 104 88.366 35.932 -30.633 646 HZ1 LYS 104 HZ1 LYS 104 88.467 33.425 -29.028 647 HZ2 LYS 104 HZ2 LYS 104 89.294 33.721 -30.399 648 HZ3 LYS 104 HZ3 LYS 104 89.643 34.568 -29.052 649 H ALA 105 H ALA 105 82.750 36.661 -25.642 650 HA ALA 105 HA ALA 105 83.512 37.937 -23.166 651 HB1 ALA 105 HB1 ALA 105 80.773 37.794 -24.479 652 HB2 ALA 105 HB2 ALA 105 81.309 38.943 -23.245 653 HB3 ALA 105 HB3 ALA 105 82.036 38.985 -24.861 654 H ILE 106 H ILE 106 81.355 35.212 -23.921 655 HA ILE 106 HA ILE 106 80.506 34.854 -21.169 656 HB ILE 106 HB ILE 106 80.213 33.230 -23.709 657 HG12 ILE 106 HG12 ILE 106 77.825 33.637 -23.313 658 HG13 ILE 106 HG13 ILE 106 78.183 34.469 -21.800 659 HG21 ILE 106 HG21 ILE 106 79.301 32.381 -20.916 660 HG22 ILE 106 HG22 ILE 106 78.745 31.655 -22.440 661 HG23 ILE 106 HG23 ILE 106 80.436 31.512 -21.978 662 HD11 ILE 106 HD11 ILE 106 79.009 35.456 -24.556 663 HD12 ILE 106 HD12 ILE 106 77.580 35.999 -23.656 664 HD13 ILE 106 HD13 ILE 106 79.199 36.345 -23.028 665 H PHE 107 H PHE 107 82.919 33.123 -23.214 666 HA PHE 107 HA PHE 107 83.889 31.350 -21.241 667 HB2 PHE 107 HB2 PHE 107 85.575 32.852 -23.280 668 HB3 PHE 107 HB3 PHE 107 86.007 31.352 -22.482 669 HD1 PHE 107 HD1 PHE 107 83.030 30.131 -22.973 670 HD2 PHE 107 HD2 PHE 107 86.091 31.951 -25.403 671 HE1 PHE 107 HE1 PHE 107 82.259 28.810 -24.922 672 HE2 PHE 107 HE2 PHE 107 85.309 30.624 -27.370 673 HZ PHE 107 HZ PHE 107 83.400 29.046 -27.120 674 H ARG 108 H ARG 108 85.016 34.705 -21.878 675 HA ARG 108 HA ARG 108 87.061 34.590 -19.876 676 HB2 ARG 108 HB2 ARG 108 86.942 35.806 -22.106 677 HB3 ARG 108 HB3 ARG 108 85.942 37.031 -21.331 678 HG2 ARG 108 HG2 ARG 108 88.485 36.393 -19.895 679 HG3 ARG 108 HG3 ARG 108 88.707 36.929 -21.552 680 HD2 ARG 108 HD2 ARG 108 88.872 38.908 -20.307 681 HD3 ARG 108 HD3 ARG 108 87.283 38.961 -21.042 682 HE ARG 108 HE ARG 108 86.314 38.936 -18.942 683 HH11 ARG 108 HH11 ARG 108 89.664 37.976 -18.496 684 HH12 ARG 108 HH12 ARG 108 89.577 38.146 -16.765 685 HH21 ARG 108 HH21 ARG 108 86.288 39.139 -16.713 686 HH22 ARG 108 HH22 ARG 108 87.713 38.771 -15.794 687 H ARG 109 H ARG 109 83.798 36.064 -19.876 688 HA ARG 109 HA ARG 109 84.086 37.191 -17.184 689 HB2 ARG 109 HB2 ARG 109 82.593 38.093 -18.992 690 HB3 ARG 109 HB3 ARG 109 81.558 36.667 -18.807 691 HG2 ARG 109 HG2 ARG 109 81.091 37.289 -16.467 692 HG3 ARG 109 HG3 ARG 109 82.205 38.661 -16.583 693 HD2 ARG 109 HD2 ARG 109 80.763 39.689 -18.323 694 HD3 ARG 109 HD3 ARG 109 79.704 38.285 -18.282 695 HE ARG 109 HE ARG 109 78.834 38.907 -16.198 696 HH11 ARG 109 HH11 ARG 109 81.317 41.234 -17.065 697 HH12 ARG 109 HH12 ARG 109 80.819 42.358 -15.834 698 HH21 ARG 109 HH21 ARG 109 78.247 40.392 -14.658 699 HH22 ARG 109 HH22 ARG 109 79.122 41.886 -14.506 700 H TYR 110 H TYR 110 82.753 34.176 -18.496 701 HA TYR 110 HA TYR 110 82.257 33.158 -15.727 702 HB2 TYR 110 HB2 TYR 110 80.713 32.514 -18.249 703 HB3 TYR 110 HB3 TYR 110 80.379 31.954 -16.628 704 HD1 TYR 110 HD2 TYR 110 80.246 34.031 -14.818 705 HD2 TYR 110 HD1 TYR 110 79.325 34.198 -19.024 706 HE1 TYR 110 HE2 TYR 110 78.862 36.091 -14.448 707 HE2 TYR 110 HE1 TYR 110 77.872 36.190 -18.637 708 HH TYR 110 HH TYR 110 76.958 37.620 -17.061 709 HA PRO 111 HA PRO 111 85.538 30.634 -17.775 710 HB2 PRO 111 HB2 PRO 111 87.093 30.101 -15.574 711 HB3 PRO 111 HB3 PRO 111 87.154 31.636 -16.492 712 HG2 PRO 111 HG2 PRO 111 85.575 31.046 -13.963 713 HG3 PRO 111 HG3 PRO 111 86.678 32.427 -14.281 714 HD2 PRO 111 HD2 PRO 111 84.012 32.679 -14.594 715 HD3 PRO 111 HD3 PRO 111 85.132 33.435 -15.769 716 H HIS 112 H HIS 112 83.172 29.801 -15.407 717 HA HIS 112 HA HIS 112 83.746 26.919 -15.412 718 HB2 HIS 112 HB2 HIS 112 81.854 26.741 -14.029 719 HB3 HIS 112 HB3 HIS 112 82.692 28.194 -13.506 720 HD2 HIS 112 HD2 HIS 112 79.360 27.046 -13.865 721 HE1 HIS 112 HE1 HIS 112 78.895 31.090 -15.092 722 HE2 HIS 112 HE2 HIS 112 77.703 29.097 -14.229 723 H LEU 113 H LEU 113 82.072 29.152 -17.489 724 HA LEU 113 HA LEU 113 80.280 27.176 -18.641 725 HB2 LEU 113 HB2 LEU 113 80.200 29.884 -17.944 726 HB3 LEU 113 HB3 LEU 113 80.427 29.970 -19.670 727 HG LEU 113 HG LEU 113 78.111 30.143 -18.965 728 HD11 LEU 113 HD11 LEU 113 78.581 27.497 -20.405 729 HD12 LEU 113 HD12 LEU 113 77.144 28.510 -20.517 730 HD13 LEU 113 HD13 LEU 113 78.682 29.101 -21.166 731 HD21 LEU 113 HD21 LEU 113 78.260 28.669 -16.950 732 HD22 LEU 113 HD22 LEU 113 76.845 28.396 -17.961 733 HD23 LEU 113 HD23 LEU 113 78.197 27.252 -18.011 734 H ARG 114 H ARG 114 83.440 28.175 -19.339 735 HA ARG 114 HA ARG 114 83.356 27.954 -22.246 736 HB2 ARG 114 HB2 ARG 114 85.720 28.209 -22.207 737 HB3 ARG 114 HB3 ARG 114 85.018 29.333 -21.060 738 HG2 ARG 114 HG2 ARG 114 86.762 28.590 -19.799 739 HG3 ARG 114 HG3 ARG 114 85.549 27.409 -19.294 740 HD2 ARG 114 HD2 ARG 114 86.479 25.798 -20.970 741 HD3 ARG 114 HD3 ARG 114 87.697 27.007 -21.414 742 HE ARG 114 HE ARG 114 87.825 26.625 -18.606 743 HH11 ARG 114 HH11 ARG 114 88.514 24.730 -21.472 744 HH12 ARG 114 HH12 ARG 114 89.712 23.760 -20.657 745 HH21 ARG 114 HH21 ARG 114 89.365 25.359 -17.629 746 HH22 ARG 114 HH22 ARG 114 90.175 24.113 -18.533
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