NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
554205 | 2m06 | 18796 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 3H ALA 1 117.310 -24.856 8.592 2 H2 ALA 1 2H ALA 1 116.031 -25.077 9.690 3 H3 ALA 1 HT3 ALA 1 117.248 -23.938 10.016 4 HA ALA 1 HA ALA 1 114.995 -23.780 8.146 5 HB1 ALA 1 2HB ALA 1 114.727 -21.616 9.115 6 HB2 ALA 1 3HB ALA 1 116.360 -21.633 9.780 7 HB3 ALA 1 1HB ALA 1 115.122 -22.689 10.459 8 H THR 2 H THR 2 115.138 -21.746 6.734 9 HA THR 2 HA THR 2 117.826 -21.560 5.496 10 HB THR 2 HB THR 2 116.725 -21.352 3.324 11 HG1 THR 2 HG1 THR 2 114.722 -20.790 3.339 12 HG21 THR 2 3HG2 THR 2 117.302 -23.616 4.278 13 HG22 THR 2 1HG2 THR 2 116.012 -23.642 3.075 14 HG23 THR 2 2HG2 THR 2 115.621 -23.759 4.791 15 H SER 3 H SER 3 118.531 -19.554 4.905 16 HA SER 3 HA SER 3 116.733 -17.260 5.440 17 HB2 SER 3 1HB SER 3 118.379 -17.568 7.285 18 HB3 SER 3 2HB SER 3 119.682 -17.422 6.111 19 HG SER 3 HG SER 3 119.457 -15.366 6.568 20 H THR 4 H THR 4 116.889 -15.550 4.030 21 HA THR 4 HA THR 4 118.830 -15.797 1.808 22 HB THR 4 HB THR 4 115.930 -14.980 1.518 23 HG1 THR 4 HG1 THR 4 115.884 -17.125 1.817 24 HG21 THR 4 3HG2 THR 4 116.444 -15.173 -0.895 25 HG22 THR 4 1HG2 THR 4 118.123 -15.542 -0.498 26 HG23 THR 4 2HG2 THR 4 117.454 -13.956 -0.114 27 H VAL 5 H VAL 5 119.873 -13.965 1.297 28 HA VAL 5 HA VAL 5 118.927 -11.433 2.528 29 HB VAL 5 HB VAL 5 121.781 -12.233 1.886 30 HG11 VAL 5 1HG1 VAL 5 122.318 -10.191 3.204 31 HG12 VAL 5 2HG1 VAL 5 120.594 -9.835 3.318 32 HG13 VAL 5 3HG1 VAL 5 121.395 -9.817 1.748 33 HG21 VAL 5 3HG2 VAL 5 120.363 -12.000 4.560 34 HG22 VAL 5 1HG2 VAL 5 122.068 -12.381 4.324 35 HG23 VAL 5 2HG2 VAL 5 120.829 -13.515 3.788 36 H THR 6 H THR 6 118.485 -9.818 1.157 37 HA THR 6 HA THR 6 119.571 -9.919 -1.586 38 HB THR 6 HB THR 6 116.667 -9.425 -0.875 39 HG1 THR 6 HG1 THR 6 116.758 -11.534 -0.834 40 HG21 THR 6 3HG2 THR 6 117.987 -9.722 -3.584 41 HG22 THR 6 1HG2 THR 6 117.552 -8.174 -2.863 42 HG23 THR 6 2HG2 THR 6 116.296 -9.343 -3.266 43 H GLY 7 H GLY 7 119.931 -7.913 -2.531 44 HA2 GLY 7 1HA GLY 7 119.049 -5.520 -1.032 45 HA3 GLY 7 2HA GLY 7 120.739 -5.676 -1.517 46 H GLY 8 H GLY 8 118.772 -3.644 -2.385 47 HA2 GLY 8 1HA GLY 8 119.122 -3.995 -5.264 48 HA3 GLY 8 2HA GLY 8 117.458 -3.941 -4.701 49 H TYR 9 H TYR 9 118.207 -2.135 -6.480 50 HA TYR 9 HA TYR 9 118.374 0.391 -4.948 51 HB2 TYR 9 1HB TYR 9 120.440 -0.049 -6.256 52 HB3 TYR 9 2HB TYR 9 119.472 -0.137 -7.714 53 HD1 TYR 9 HD1 TYR 9 120.671 2.097 -5.011 54 HD2 TYR 9 HD2 TYR 9 118.707 1.850 -8.823 55 HE1 TYR 9 HE1 TYR 9 120.883 4.553 -5.279 56 HE2 TYR 9 HE2 TYR 9 118.918 4.306 -9.091 57 HH TYR 9 HH TYR 9 120.217 6.332 -6.488 58 H ALA 10 H ALA 10 116.955 2.003 -5.566 59 HA ALA 10 HA ALA 10 115.153 1.461 -7.830 60 HB1 ALA 10 1HB ALA 10 113.224 1.512 -6.589 61 HB2 ALA 10 2HB ALA 10 113.932 2.515 -5.322 62 HB3 ALA 10 3HB ALA 10 114.305 0.793 -5.396 63 H GLN 11 H GLN 11 114.300 3.269 -8.815 64 HA GLN 11 HA GLN 11 115.119 5.912 -7.752 65 HB2 GLN 11 1HB GLN 11 114.839 5.023 -10.637 66 HB3 GLN 11 2HB GLN 11 115.146 6.682 -10.119 67 HG2 GLN 11 1HG GLN 11 117.240 5.999 -9.059 68 HG3 GLN 11 2HG GLN 11 116.926 4.316 -9.472 69 HE21 GLN 11 1HE2 GLN 11 119.284 5.673 -10.378 70 HE22 GLN 11 2HE2 GLN 11 119.190 5.830 -12.066 71 H SER 12 H SER 12 113.514 7.528 -7.732 72 HA SER 12 HA SER 12 110.786 6.562 -8.409 73 HB2 SER 12 1HB SER 12 109.943 7.618 -6.423 74 HB3 SER 12 2HB SER 12 111.291 6.590 -5.948 75 HG SER 12 HG SER 12 111.027 9.100 -5.420 76 H ASP 13 H ASP 13 109.400 7.970 -9.313 77 HA ASP 13 HA ASP 13 110.362 10.715 -9.873 78 HB2 ASP 13 1HB ASP 13 110.410 9.234 -11.889 79 HB3 ASP 13 2HB ASP 13 108.676 8.982 -11.697 80 H ALA 14 H ALA 14 108.850 12.341 -9.634 81 HA ALA 14 HA ALA 14 106.380 11.535 -8.238 82 HB1 ALA 14 1HB ALA 14 107.639 14.261 -8.100 83 HB2 ALA 14 2HB ALA 14 108.213 12.946 -7.074 84 HB3 ALA 14 3HB ALA 14 106.540 13.494 -6.955 85 H GLN 15 H GLN 15 104.807 11.518 -9.673 86 HA GLN 15 HA GLN 15 104.560 13.401 -11.832 87 HB2 GLN 15 1HB GLN 15 102.602 11.407 -10.669 88 HB3 GLN 15 2HB GLN 15 102.309 12.360 -12.124 89 HG2 GLN 15 1HG GLN 15 104.262 11.367 -13.208 90 HG3 GLN 15 2HG GLN 15 104.646 10.468 -11.743 91 HE21 GLN 15 1HE2 GLN 15 104.157 9.130 -14.223 92 HE22 GLN 15 2HE2 GLN 15 102.715 8.248 -14.079 93 H GLY 16 H GLY 16 103.818 15.356 -11.714 94 HA2 GLY 16 1HA GLY 16 102.372 17.110 -11.105 95 HA3 GLY 16 2HA GLY 16 101.859 16.182 -9.704 96 H GLN 17 H GLN 17 104.911 15.709 -9.191 97 HA GLN 17 HA GLN 17 105.596 18.425 -8.235 98 HB2 GLN 17 1HB GLN 17 106.541 15.765 -7.136 99 HB3 GLN 17 2HB GLN 17 106.959 17.358 -6.510 100 HG2 GLN 17 1HG GLN 17 104.170 16.171 -6.616 101 HG3 GLN 17 2HG GLN 17 105.163 16.337 -5.172 102 HE21 GLN 17 1HE2 GLN 17 102.535 17.718 -6.433 103 HE22 GLN 17 2HE2 GLN 17 102.788 19.345 -6.018 104 H MET 18 H MET 18 107.819 19.084 -8.499 105 HA MET 18 HA MET 18 109.190 17.657 -10.691 106 HB2 MET 18 1HB MET 18 109.583 20.450 -9.590 107 HB3 MET 18 2HB MET 18 110.499 19.748 -10.924 108 HG2 MET 18 1HG MET 18 108.321 19.368 -12.126 109 HG3 MET 18 2HG MET 18 107.516 20.272 -10.844 110 HE1 MET 18 3HE MET 18 111.152 21.234 -12.830 111 HE2 MET 18 1HE MET 18 110.121 21.487 -14.243 112 HE3 MET 18 2HE MET 18 110.060 19.960 -13.366 113 H ASN 19 H ASN 19 110.303 16.032 -9.662 114 HA ASN 19 HA ASN 19 112.807 16.637 -8.540 115 HB2 ASN 19 1HB ASN 19 112.503 15.859 -6.236 116 HB3 ASN 19 2HB ASN 19 111.531 17.291 -6.538 117 HD21 ASN 19 1HD2 ASN 19 110.900 15.430 -4.441 118 HD22 ASN 19 2HD2 ASN 19 109.429 14.678 -4.831 119 H LYS 20 H LYS 20 114.080 14.790 -8.166 120 HA LYS 20 HA LYS 20 112.795 12.166 -8.619 121 HB2 LYS 20 1HB LYS 20 115.398 13.147 -9.825 122 HB3 LYS 20 2HB LYS 20 114.798 11.491 -9.926 123 HG2 LYS 20 1HG LYS 20 112.738 12.346 -11.043 124 HG3 LYS 20 2HG LYS 20 113.437 13.965 -11.030 125 HD2 LYS 20 1HD LYS 20 115.388 13.088 -12.321 126 HD3 LYS 20 2HD LYS 20 114.573 11.526 -12.426 127 HE2 LYS 20 1HE LYS 20 113.112 13.997 -13.301 128 HE3 LYS 20 2HE LYS 20 114.306 13.274 -14.379 129 HZ1 LYS 20 3HZ LYS 20 113.105 11.336 -14.557 130 HZ2 LYS 20 1HZ LYS 20 111.866 12.492 -14.488 131 HZ3 LYS 20 2HZ LYS 20 112.259 11.586 -13.104 132 H MET 21 H MET 21 113.765 10.419 -7.448 133 HA MET 21 HA MET 21 115.855 11.224 -5.506 134 HB2 MET 21 1HB MET 21 113.269 9.806 -4.830 135 HB3 MET 21 2HB MET 21 114.608 10.071 -3.714 136 HG2 MET 21 1HG MET 21 114.383 12.541 -4.141 137 HG3 MET 21 2HG MET 21 112.927 12.193 -5.073 138 HE1 MET 21 3HE MET 21 114.880 11.424 -2.131 139 HE2 MET 21 1HE MET 21 113.771 10.782 -0.915 140 HE3 MET 21 2HE MET 21 114.085 12.512 -0.998 141 H GLY 22 H GLY 22 117.014 9.470 -4.557 142 HA2 GLY 22 1HA GLY 22 116.752 6.881 -5.976 143 HA3 GLY 22 2HA GLY 22 118.323 7.665 -5.818 144 H GLY 23 H GLY 23 117.038 5.096 -4.674 145 HA2 GLY 23 1HA GLY 23 118.101 5.457 -1.970 146 HA3 GLY 23 2HA GLY 23 116.413 4.982 -2.102 147 H PHE 24 H PHE 24 118.061 3.383 -0.743 148 HA PHE 24 HA PHE 24 118.423 1.040 -2.522 149 HB2 PHE 24 1HB PHE 24 120.608 2.010 -1.819 150 HB3 PHE 24 2HB PHE 24 120.143 1.770 -0.145 151 HD1 PHE 24 HD2 PHE 24 121.205 0.142 -3.264 152 HD2 PHE 24 HD1 PHE 24 120.073 -0.471 0.835 153 HE1 PHE 24 HE2 PHE 24 122.107 -2.166 -3.360 154 HE2 PHE 24 HE1 PHE 24 120.976 -2.779 0.739 155 HZ PHE 24 HZ PHE 24 121.994 -3.626 -1.358 156 H ASN 25 H ASN 25 118.053 -1.027 -1.455 157 HA ASN 25 HA ASN 25 116.559 -0.824 1.088 158 HB2 ASN 25 1HB ASN 25 114.817 -2.294 0.203 159 HB3 ASN 25 2HB ASN 25 114.929 -0.817 -0.750 160 HD21 ASN 25 1HD2 ASN 25 114.809 -1.243 -2.950 161 HD22 ASN 25 2HD2 ASN 25 115.413 -2.635 -3.709 162 H LEU 26 H LEU 26 116.638 -2.582 2.410 163 HA LEU 26 HA LEU 26 118.334 -4.857 1.559 164 HB2 LEU 26 1HB LEU 26 119.459 -3.368 3.225 165 HB3 LEU 26 2HB LEU 26 118.133 -3.682 4.345 166 HG LEU 26 HG LEU 26 118.638 -6.164 4.049 167 HD11 LEU 26 1HD1 LEU 26 120.996 -4.920 2.629 168 HD12 LEU 26 2HD1 LEU 26 119.941 -6.217 2.066 169 HD13 LEU 26 3HD1 LEU 26 121.098 -6.521 3.361 170 HD21 LEU 26 3HD2 LEU 26 120.780 -5.955 5.489 171 HD22 LEU 26 1HD2 LEU 26 119.313 -5.192 6.101 172 HD23 LEU 26 2HD2 LEU 26 120.559 -4.213 5.325 173 H LYS 27 H LYS 27 117.531 -6.886 2.019 174 HA LYS 27 HA LYS 27 114.811 -6.954 3.201 175 HB2 LYS 27 1HB LYS 27 115.841 -8.417 0.764 176 HB3 LYS 27 2HB LYS 27 114.261 -8.673 1.504 177 HG2 LYS 27 1HG LYS 27 113.744 -6.261 1.155 178 HG3 LYS 27 2HG LYS 27 115.285 -6.079 0.317 179 HD2 LYS 27 1HD LYS 27 114.561 -7.838 -1.304 180 HD3 LYS 27 2HD LYS 27 112.986 -7.873 -0.512 181 HE2 LYS 27 1HE LYS 27 114.096 -5.250 -1.461 182 HE3 LYS 27 2HE LYS 27 113.343 -6.343 -2.621 183 HZ1 LYS 27 3HZ LYS 27 111.545 -6.414 -0.684 184 HZ2 LYS 27 1HZ LYS 27 111.496 -5.273 -1.939 185 HZ3 LYS 27 2HZ LYS 27 112.149 -4.846 -0.430 186 H TYR 28 H TYR 28 114.346 -8.556 4.563 187 HA TYR 28 HA TYR 28 116.302 -10.760 4.903 188 HB2 TYR 28 1HB TYR 28 116.256 -9.179 6.818 189 HB3 TYR 28 2HB TYR 28 114.543 -9.497 7.013 190 HD1 TYR 28 HD1 TYR 28 117.939 -10.941 7.282 191 HD2 TYR 28 HD2 TYR 28 113.756 -11.513 8.072 192 HE1 TYR 28 HE1 TYR 28 118.477 -12.878 8.735 193 HE2 TYR 28 HE2 TYR 28 114.294 -13.449 9.525 194 HH TYR 28 HH TYR 28 115.917 -14.633 10.482 195 H ARG 29 H ARG 29 115.476 -12.830 4.998 196 HA ARG 29 HA ARG 29 112.548 -13.108 4.656 197 HB2 ARG 29 1HB ARG 29 113.771 -13.297 2.488 198 HB3 ARG 29 2HB ARG 29 114.652 -14.673 3.154 199 HG2 ARG 29 1HG ARG 29 112.498 -15.837 3.556 200 HG3 ARG 29 2HG ARG 29 111.643 -14.478 2.823 201 HD2 ARG 29 1HD ARG 29 112.956 -14.841 0.728 202 HD3 ARG 29 2HD ARG 29 113.676 -16.269 1.465 203 HE ARG 29 HE ARG 29 111.065 -16.813 1.721 204 HH11 ARG 29 1HH1 ARG 29 112.842 -15.635 -1.067 205 HH12 ARG 29 2HH1 ARG 29 111.760 -16.379 -2.197 206 HH21 ARG 29 1HH2 ARG 29 109.705 -17.747 0.220 207 HH22 ARG 29 2HH2 ARG 29 110.007 -17.559 -1.475 208 H TYR 30 H TYR 30 111.577 -14.792 5.663 209 HA TYR 30 HA TYR 30 113.291 -16.730 7.101 210 HB2 TYR 30 1HB TYR 30 112.445 -14.987 8.643 211 HB3 TYR 30 2HB TYR 30 110.804 -15.395 8.178 212 HD1 TYR 30 HD1 TYR 30 113.837 -16.576 9.938 213 HD2 TYR 30 HD2 TYR 30 109.703 -17.349 9.060 214 HE1 TYR 30 HE1 TYR 30 113.788 -18.320 11.701 215 HE2 TYR 30 HE2 TYR 30 109.656 -19.093 10.823 216 HH TYR 30 HH TYR 30 112.599 -19.993 12.597 217 H GLU 31 H GLU 31 112.594 -18.824 7.070 218 HA GLU 31 HA GLU 31 109.959 -19.391 5.857 219 HB2 GLU 31 1HB GLU 31 112.591 -20.686 5.109 220 HB3 GLU 31 2HB GLU 31 111.005 -21.197 4.531 221 HG2 GLU 31 1HG GLU 31 110.651 -18.924 3.581 222 HG3 GLU 31 2HG GLU 31 112.275 -18.482 4.089 223 H GLU 32 H GLU 32 108.965 -21.297 6.519 224 HA GLU 32 HA GLU 32 110.013 -22.434 9.011 225 HB2 GLU 32 1HB GLU 32 107.641 -21.637 8.866 226 HB3 GLU 32 2HB GLU 32 107.335 -22.916 7.689 227 HG2 GLU 32 1HG GLU 32 108.098 -24.596 9.358 228 HG3 GLU 32 2HG GLU 32 108.300 -23.305 10.534 229 H ASP 33 H ASP 33 110.453 -24.606 9.290 230 HA ASP 33 HA ASP 33 111.563 -25.882 7.015 231 HB2 ASP 33 1HB ASP 33 112.163 -27.675 8.544 232 HB3 ASP 33 2HB ASP 33 112.496 -26.109 9.277 233 H ASN 34 H ASN 34 108.611 -26.589 8.907 234 HA ASN 34 HA ASN 34 108.072 -28.849 7.085 235 HB2 ASN 34 1HB ASN 34 106.826 -28.143 9.744 236 HB3 ASN 34 2HB ASN 34 106.456 -29.574 8.783 237 HD21 ASN 34 1HD2 ASN 34 107.886 -29.150 11.522 238 HD22 ASN 34 2HD2 ASN 34 109.305 -30.067 11.361 239 H SER 35 H SER 35 106.982 -25.634 7.666 240 HA SER 35 HA SER 35 104.908 -26.046 5.649 241 HB2 SER 35 1HB SER 35 104.004 -26.167 8.134 242 HB3 SER 35 2HB SER 35 104.145 -24.415 8.041 243 HG SER 35 HG SER 35 102.100 -25.483 7.310 244 HA PRO 36 HA PRO 36 107.792 -22.412 5.388 245 HB2 PRO 36 1HB PRO 36 107.598 -22.811 2.460 246 HB3 PRO 36 2HB PRO 36 109.032 -22.694 3.496 247 HG2 PRO 36 1HG PRO 36 108.255 -25.002 2.403 248 HG3 PRO 36 2HG PRO 36 109.018 -24.922 4.002 249 HD2 PRO 36 1HD PRO 36 106.122 -25.304 3.320 250 HD3 PRO 36 2HD PRO 36 107.079 -26.033 4.630 251 H LEU 37 H LEU 37 107.125 -20.400 5.402 252 HA LEU 37 HA LEU 37 105.057 -19.499 3.491 253 HB2 LEU 37 1HB LEU 37 104.210 -19.539 5.849 254 HB3 LEU 37 2HB LEU 37 105.508 -18.431 6.294 255 HG LEU 37 HG LEU 37 104.634 -16.880 4.465 256 HD11 LEU 37 1HD1 LEU 37 103.259 -18.252 3.134 257 HD12 LEU 37 2HD1 LEU 37 102.097 -17.326 4.085 258 HD13 LEU 37 3HD1 LEU 37 102.481 -18.987 4.535 259 HD21 LEU 37 3HD2 LEU 37 102.750 -17.516 6.760 260 HD22 LEU 37 1HD2 LEU 37 102.878 -15.974 5.912 261 HD23 LEU 37 2HD2 LEU 37 104.218 -16.549 6.904 262 H GLY 38 H GLY 38 105.625 -17.598 2.334 263 HA2 GLY 38 1HA GLY 38 108.471 -16.916 2.629 264 HA3 GLY 38 2HA GLY 38 107.460 -16.564 1.228 265 H VAL 39 H VAL 39 108.935 -15.193 3.861 266 HA VAL 39 HA VAL 39 107.098 -12.866 3.760 267 HB VAL 39 HB VAL 39 106.834 -14.064 5.900 268 HG11 VAL 39 1HG1 VAL 39 109.705 -13.383 6.522 269 HG12 VAL 39 2HG1 VAL 39 109.265 -14.936 5.811 270 HG13 VAL 39 3HG1 VAL 39 108.621 -14.473 7.386 271 HG21 VAL 39 3HG2 VAL 39 106.648 -11.592 5.822 272 HG22 VAL 39 1HG2 VAL 39 108.371 -11.463 6.179 273 HG23 VAL 39 2HG2 VAL 39 107.271 -12.150 7.375 274 H ILE 40 H ILE 40 108.044 -11.046 3.196 275 HA ILE 40 HA ILE 40 110.983 -10.791 3.521 276 HB ILE 40 HB ILE 40 109.289 -9.683 1.263 277 HG12 ILE 40 1HG1 ILE 40 111.366 -11.894 1.208 278 HG13 ILE 40 2HG1 ILE 40 109.625 -12.177 1.206 279 HG21 ILE 40 1HG2 ILE 40 112.302 -9.760 1.587 280 HG22 ILE 40 2HG2 ILE 40 111.315 -8.349 1.968 281 HG23 ILE 40 3HG2 ILE 40 111.388 -8.953 0.313 282 HD11 ILE 40 3HD1 ILE 40 111.330 -10.913 -0.928 283 HD12 ILE 40 1HD1 ILE 40 109.606 -10.552 -0.835 284 HD13 ILE 40 2HD1 ILE 40 110.146 -12.213 -1.081 285 H GLY 41 H GLY 41 111.581 -9.109 4.719 286 HA2 GLY 41 1HA GLY 41 109.735 -6.788 4.944 287 HA3 GLY 41 2HA GLY 41 110.829 -7.301 6.232 288 H SER 42 H SER 42 110.512 -4.880 4.208 289 HA SER 42 HA SER 42 113.396 -4.707 3.549 290 HB2 SER 42 1HB SER 42 111.977 -5.193 1.541 291 HB3 SER 42 2HB SER 42 111.129 -3.679 1.833 292 HG SER 42 HG SER 42 112.755 -3.157 0.467 293 H PHE 43 H PHE 43 114.389 -2.864 4.094 294 HA PHE 43 HA PHE 43 112.725 -0.553 4.923 295 HB2 PHE 43 1HB PHE 43 115.551 -1.296 5.699 296 HB3 PHE 43 2HB PHE 43 114.729 0.175 6.185 297 HD1 PHE 43 HD1 PHE 43 112.798 0.070 7.753 298 HD2 PHE 43 HD2 PHE 43 115.117 -3.405 6.754 299 HE1 PHE 43 HE1 PHE 43 111.862 -1.120 9.717 300 HE2 PHE 43 HE2 PHE 43 114.180 -4.595 8.718 301 HZ PHE 43 HZ PHE 43 112.553 -3.452 10.200 302 H THR 44 H THR 44 112.863 1.249 3.683 303 HA THR 44 HA THR 44 114.973 1.296 1.592 304 HB THR 44 HB THR 44 113.356 2.561 0.227 305 HG1 THR 44 HG1 THR 44 111.185 2.613 1.015 306 HG21 THR 44 3HG2 THR 44 113.214 0.327 -0.356 307 HG22 THR 44 1HG2 THR 44 111.563 0.606 0.193 308 HG23 THR 44 2HG2 THR 44 112.725 -0.178 1.260 309 H TYR 45 H TYR 45 116.243 3.022 1.450 310 HA TYR 45 HA TYR 45 115.503 5.481 2.934 311 HB2 TYR 45 1HB TYR 45 118.286 4.378 2.502 312 HB3 TYR 45 2HB TYR 45 117.861 5.818 3.407 313 HD1 TYR 45 HD2 TYR 45 117.921 2.142 3.402 314 HD2 TYR 45 HD1 TYR 45 116.892 5.657 5.642 315 HE1 TYR 45 HE2 TYR 45 117.720 0.771 5.459 316 HE2 TYR 45 HE1 TYR 45 116.687 4.286 7.700 317 HH TYR 45 HH TYR 45 117.574 0.866 7.722 318 H THR 46 H THR 46 115.217 7.145 1.533 319 HA THR 46 HA THR 46 116.838 7.162 -0.956 320 HB THR 46 HB THR 46 114.994 8.001 -2.211 321 HG1 THR 46 HG1 THR 46 112.960 8.314 -1.107 322 HG21 THR 46 3HG2 THR 46 113.169 6.158 -1.058 323 HG22 THR 46 1HG2 THR 46 114.776 5.457 -0.871 324 HG23 THR 46 2HG2 THR 46 114.198 5.922 -2.469 325 H GLU 47 H GLU 47 117.438 9.169 -1.750 326 HA GLU 47 HA GLU 47 117.058 11.479 0.051 327 HB2 GLU 47 1HB GLU 47 119.281 10.358 0.423 328 HB3 GLU 47 2HB GLU 47 119.681 10.720 -1.256 329 HG2 GLU 47 1HG GLU 47 119.310 13.136 -0.795 330 HG3 GLU 47 2HG GLU 47 118.995 12.748 0.890 331 H LYS 48 H LYS 48 117.091 13.498 -0.978 332 HA LYS 48 HA LYS 48 116.428 13.429 -3.814 333 HB2 LYS 48 1HB LYS 48 115.103 14.783 -2.185 334 HB3 LYS 48 2HB LYS 48 116.527 15.792 -1.924 335 HG2 LYS 48 1HG LYS 48 116.570 16.311 -4.358 336 HG3 LYS 48 2HG LYS 48 115.087 15.377 -4.560 337 HD2 LYS 48 1HD LYS 48 113.976 16.881 -2.891 338 HD3 LYS 48 2HD LYS 48 115.437 17.869 -2.870 339 HE2 LYS 48 1HE LYS 48 115.212 18.269 -5.292 340 HE3 LYS 48 2HE LYS 48 113.753 17.278 -5.323 341 HZ1 LYS 48 3HZ LYS 48 113.632 19.867 -5.046 342 HZ2 LYS 48 1HZ LYS 48 113.887 19.492 -3.411 343 HZ3 LYS 48 2HZ LYS 48 112.545 18.846 -4.230 344 H SER 49 H SER 49 117.650 14.250 -5.446 345 HA SER 49 HA SER 49 120.446 14.811 -4.834 346 HB2 SER 49 1HB SER 49 119.831 13.279 -6.696 347 HB3 SER 49 2HB SER 49 119.044 14.626 -7.512 348 HG SER 49 HG SER 49 121.203 15.684 -7.203 349 H ARG 50 H ARG 50 121.525 16.706 -5.386 350 HA ARG 50 HA ARG 50 119.767 19.066 -5.660 351 HB2 ARG 50 1HB ARG 50 121.169 18.896 -3.605 352 HB3 ARG 50 2HB ARG 50 122.607 18.927 -4.625 353 HG2 ARG 50 1HG ARG 50 121.838 21.116 -5.561 354 HG3 ARG 50 2HG ARG 50 120.501 21.098 -4.411 355 HD2 ARG 50 1HD ARG 50 123.446 21.048 -3.687 356 HD3 ARG 50 2HD ARG 50 122.386 22.445 -3.569 357 HE ARG 50 HE ARG 50 121.334 21.471 -1.708 358 HH11 ARG 50 1HH1 ARG 50 123.702 19.240 -3.045 359 HH12 ARG 50 2HH1 ARG 50 123.713 18.256 -1.622 360 HH21 ARG 50 1HH2 ARG 50 121.396 20.157 0.087 361 HH22 ARG 50 2HH2 ARG 50 122.426 18.765 0.124 362 H THR 51 H THR 51 120.175 20.619 -7.187 363 HA THR 51 HA THR 51 122.280 20.017 -9.188 364 HB THR 51 HB THR 51 119.621 21.385 -9.667 365 HG1 THR 51 HG1 THR 51 120.516 18.759 -10.258 366 HG21 THR 51 3HG2 THR 51 121.583 21.977 -11.153 367 HG22 THR 51 1HG2 THR 51 120.210 21.258 -11.996 368 HG23 THR 51 2HG2 THR 51 121.635 20.281 -11.639 369 H ALA 52 H ALA 52 123.606 21.668 -9.803 370 HA ALA 52 HA ALA 52 123.575 24.032 -8.105 371 HB1 ALA 52 1HB ALA 52 125.709 22.962 -8.414 372 HB2 ALA 52 2HB ALA 52 125.757 24.513 -9.253 373 HB3 ALA 52 3HB ALA 52 125.541 23.022 -10.170 374 H SER 53 H SER 53 122.686 25.890 -8.671 375 HA SER 53 HA SER 53 123.046 27.173 -11.134 376 HB2 SER 53 1HB SER 53 120.636 25.439 -10.953 377 HB3 SER 53 2HB SER 53 120.413 27.039 -11.650 378 HG SER 53 HG SER 53 121.764 24.839 -12.608 379 H SER 54 H SER 54 120.055 26.945 -9.197 380 HA SER 54 HA SER 54 119.845 29.732 -8.790 381 HB2 SER 54 1HB SER 54 118.666 27.507 -7.109 382 HB3 SER 54 2HB SER 54 118.119 29.179 -7.164 383 HG SER 54 HG SER 54 117.330 27.220 -8.683 384 H GLY 55 H GLY 55 121.339 27.167 -6.874 385 HA2 GLY 55 1HA GLY 55 123.182 27.553 -5.418 386 HA3 GLY 55 2HA GLY 55 122.657 29.217 -5.234 387 H ASP 56 H ASP 56 119.830 27.642 -4.882 388 HA ASP 56 HA ASP 56 119.953 27.731 -1.987 389 HB2 ASP 56 1HB ASP 56 117.704 27.015 -3.883 390 HB3 ASP 56 2HB ASP 56 117.538 27.169 -2.136 391 H TYR 57 H TYR 57 119.733 26.001 -0.589 392 HA TYR 57 HA TYR 57 119.912 23.297 -1.794 393 HB2 TYR 57 1HB TYR 57 121.429 22.650 -0.050 394 HB3 TYR 57 2HB TYR 57 122.064 24.072 -0.853 395 HD1 TYR 57 HD1 TYR 57 120.623 22.723 2.247 396 HD2 TYR 57 HD2 TYR 57 122.175 26.227 0.306 397 HE1 TYR 57 HE1 TYR 57 120.800 23.861 4.443 398 HE2 TYR 57 HE2 TYR 57 122.352 27.364 2.503 399 HH TYR 57 HH TYR 57 120.887 26.129 5.334 400 H ASN 58 H ASN 58 118.622 21.747 -0.972 401 HA ASN 58 HA ASN 58 117.109 22.325 1.498 402 HB2 ASN 58 1HB ASN 58 115.961 21.300 -1.110 403 HB3 ASN 58 2HB ASN 58 115.085 21.368 0.417 404 HD21 ASN 58 1HD2 ASN 58 114.346 22.854 -1.999 405 HD22 ASN 58 2HD2 ASN 58 114.468 24.504 -1.617 406 H LYS 59 H LYS 59 116.928 20.621 2.858 407 HA LYS 59 HA LYS 59 118.115 18.067 1.981 408 HB2 LYS 59 1HB LYS 59 117.482 19.027 4.783 409 HB3 LYS 59 2HB LYS 59 118.370 17.567 4.351 410 HG2 LYS 59 1HG LYS 59 119.241 20.388 3.657 411 HG3 LYS 59 2HG LYS 59 119.882 19.438 4.996 412 HD2 LYS 59 1HD LYS 59 120.553 17.674 3.328 413 HD3 LYS 59 2HD LYS 59 120.081 18.788 2.044 414 HE2 LYS 59 1HE LYS 59 122.053 19.564 4.197 415 HE3 LYS 59 2HE LYS 59 122.558 18.801 2.689 416 HZ1 LYS 59 3HZ LYS 59 122.328 20.710 1.616 417 HZ2 LYS 59 1HZ LYS 59 122.077 21.477 3.108 418 HZ3 LYS 59 2HZ LYS 59 120.748 20.933 2.201 419 H ASN 60 H ASN 60 116.736 16.552 1.351 420 HA ASN 60 HA ASN 60 114.164 16.268 2.793 421 HB2 ASN 60 1HB ASN 60 113.957 17.236 0.452 422 HB3 ASN 60 2HB ASN 60 114.556 15.692 -0.146 423 HD21 ASN 60 1HD2 ASN 60 111.984 16.483 -0.901 424 HD22 ASN 60 2HD2 ASN 60 110.830 15.523 -0.109 425 H GLN 61 H GLN 61 113.917 14.323 3.700 426 HA GLN 61 HA GLN 61 115.393 12.020 2.544 427 HB2 GLN 61 1HB GLN 61 115.082 12.718 5.475 428 HB3 GLN 61 2HB GLN 61 115.752 11.205 4.864 429 HG2 GLN 61 1HG GLN 61 117.539 12.421 3.720 430 HG3 GLN 61 2HG GLN 61 116.852 13.958 4.236 431 HE21 GLN 61 1HE2 GLN 61 119.521 13.223 4.939 432 HE22 GLN 61 2HE2 GLN 61 119.585 12.977 6.618 433 H TYR 62 H TYR 62 114.301 10.071 2.531 434 HA TYR 62 HA TYR 62 111.592 10.029 3.728 435 HB2 TYR 62 1HB TYR 62 111.597 10.587 1.256 436 HB3 TYR 62 2HB TYR 62 112.253 8.989 0.980 437 HD1 TYR 62 HD1 TYR 62 109.309 10.885 2.168 438 HD2 TYR 62 HD2 TYR 62 110.855 7.032 1.065 439 HE1 TYR 62 HE1 TYR 62 107.002 9.978 2.106 440 HE2 TYR 62 HE2 TYR 62 108.547 6.124 1.006 441 HH TYR 62 HH TYR 62 105.860 7.847 2.263 442 H TYR 63 H TYR 63 111.093 8.173 4.739 443 HA TYR 63 HA TYR 63 112.850 5.818 4.338 444 HB2 TYR 63 1HB TYR 63 111.655 6.736 6.958 445 HB3 TYR 63 2HB TYR 63 112.730 5.372 6.716 446 HD1 TYR 63 HD1 TYR 63 112.495 9.076 6.673 447 HD2 TYR 63 HD2 TYR 63 115.101 5.662 6.637 448 HE1 TYR 63 HE1 TYR 63 114.441 10.557 7.091 449 HE2 TYR 63 HE2 TYR 63 117.047 7.143 7.051 450 HH TYR 63 HH TYR 63 117.518 9.739 6.552 451 H GLY 64 H GLY 64 111.760 3.843 4.201 452 HA2 GLY 64 1HA GLY 64 108.850 3.872 4.752 453 HA3 GLY 64 2HA GLY 64 109.435 3.346 3.179 454 H ILE 65 H ILE 65 108.052 2.037 5.624 455 HA ILE 65 HA ILE 65 109.839 -0.328 5.759 456 HB ILE 65 HB ILE 65 109.523 0.733 7.958 457 HG12 ILE 65 1HG1 ILE 65 107.846 -1.781 7.876 458 HG13 ILE 65 2HG1 ILE 65 109.590 -1.814 7.618 459 HG21 ILE 65 1HG2 ILE 65 107.280 1.734 7.387 460 HG22 ILE 65 2HG2 ILE 65 107.344 0.950 8.965 461 HG23 ILE 65 3HG2 ILE 65 106.576 0.132 7.605 462 HD11 ILE 65 3HD1 ILE 65 108.080 -0.979 10.092 463 HD12 ILE 65 1HD1 ILE 65 109.749 -0.476 9.823 464 HD13 ILE 65 2HD1 ILE 65 109.353 -2.190 9.939 465 H THR 66 H THR 66 109.039 -2.175 4.885 466 HA THR 66 HA THR 66 106.138 -2.397 4.459 467 HB THR 66 HB THR 66 107.096 -1.398 2.420 468 HG1 THR 66 HG1 THR 66 105.592 -2.525 1.548 469 HG21 THR 66 3HG2 THR 66 109.344 -2.672 2.796 470 HG22 THR 66 1HG2 THR 66 108.779 -2.408 1.146 471 HG23 THR 66 2HG2 THR 66 108.553 -3.979 1.915 472 H ALA 67 H ALA 67 105.404 -4.533 3.940 473 HA ALA 67 HA ALA 67 107.295 -6.742 4.216 474 HB1 ALA 67 1HB ALA 67 106.381 -7.694 6.126 475 HB2 ALA 67 2HB ALA 67 104.847 -6.845 5.940 476 HB3 ALA 67 3HB ALA 67 106.269 -5.980 6.524 477 H GLY 68 H GLY 68 106.456 -8.731 3.360 478 HA2 GLY 68 1HA GLY 68 103.758 -8.647 2.238 479 HA3 GLY 68 2HA GLY 68 105.083 -8.740 1.102 480 HA PRO 69 HA PRO 69 104.408 -13.163 2.758 481 HB2 PRO 69 1HB PRO 69 102.053 -14.057 1.751 482 HB3 PRO 69 2HB PRO 69 102.193 -13.374 3.383 483 HG2 PRO 69 1HG PRO 69 101.187 -12.111 0.888 484 HG3 PRO 69 2HG PRO 69 100.584 -11.971 2.550 485 HD2 PRO 69 1HD PRO 69 102.153 -10.064 1.349 486 HD3 PRO 69 2HD PRO 69 102.085 -10.323 3.104 487 H ALA 70 H ALA 70 104.554 -15.082 1.233 488 HA ALA 70 HA ALA 70 104.556 -14.319 -1.613 489 HB1 ALA 70 1HB ALA 70 106.892 -14.219 -0.301 490 HB2 ALA 70 2HB ALA 70 106.769 -14.746 -1.978 491 HB3 ALA 70 3HB ALA 70 106.872 -15.940 -0.686 492 H TYR 71 H TYR 71 104.279 -16.040 -3.051 493 HA TYR 71 HA TYR 71 103.469 -18.604 -1.811 494 HB2 TYR 71 1HB TYR 71 102.178 -17.191 -4.150 495 HB3 TYR 71 2HB TYR 71 101.721 -18.765 -3.524 496 HD1 TYR 71 HD1 TYR 71 100.748 -18.933 -1.199 497 HD2 TYR 71 HD2 TYR 71 101.389 -15.174 -3.178 498 HE1 TYR 71 HE1 TYR 71 99.191 -17.832 0.388 499 HE2 TYR 71 HE2 TYR 71 99.831 -14.073 -1.593 500 HH TYR 71 HH TYR 71 97.648 -15.436 0.081 501 H ARG 72 H ARG 72 104.466 -20.351 -2.633 502 HA ARG 72 HA ARG 72 105.794 -20.102 -5.270 503 HB2 ARG 72 1HB ARG 72 107.386 -21.775 -4.507 504 HB3 ARG 72 2HB ARG 72 107.349 -20.428 -3.374 505 HG2 ARG 72 1HG ARG 72 105.735 -21.758 -1.964 506 HG3 ARG 72 2HG ARG 72 106.013 -23.128 -3.042 507 HD2 ARG 72 1HD ARG 72 108.457 -22.961 -2.546 508 HD3 ARG 72 2HD ARG 72 108.099 -21.694 -1.376 509 HE ARG 72 HE ARG 72 107.473 -23.347 0.096 510 HH11 ARG 72 1HH1 ARG 72 107.201 -24.669 -3.145 511 HH12 ARG 72 2HH1 ARG 72 106.771 -26.247 -2.574 512 HH21 ARG 72 1HH2 ARG 72 106.915 -25.398 0.771 513 HH22 ARG 72 2HH2 ARG 72 106.611 -26.653 -0.383 514 H ILE 73 H ILE 73 105.079 -21.363 -6.870 515 HA ILE 73 HA ILE 73 103.507 -23.775 -6.176 516 HB ILE 73 HB ILE 73 102.004 -23.294 -8.045 517 HG12 ILE 73 1HG1 ILE 73 102.240 -20.711 -8.787 518 HG13 ILE 73 2HG1 ILE 73 103.937 -21.041 -8.456 519 HG21 ILE 73 1HG2 ILE 73 102.345 -21.100 -5.987 520 HG22 ILE 73 2HG2 ILE 73 101.304 -22.520 -5.882 521 HG23 ILE 73 3HG2 ILE 73 100.932 -21.238 -7.033 522 HD11 ILE 73 3HD1 ILE 73 104.127 -22.529 -10.204 523 HD12 ILE 73 1HD1 ILE 73 102.839 -21.516 -10.849 524 HD13 ILE 73 2HD1 ILE 73 102.448 -23.055 -10.085 525 H ASN 74 H ASN 74 103.689 -25.520 -7.554 526 HA ASN 74 HA ASN 74 104.837 -26.987 -8.897 527 HB2 ASN 74 1HB ASN 74 104.776 -24.557 -10.693 528 HB3 ASN 74 2HB ASN 74 105.132 -26.199 -11.223 529 HD21 ASN 74 1HD2 ASN 74 102.842 -24.625 -12.140 530 HD22 ASN 74 2HD2 ASN 74 101.444 -25.442 -11.633 531 H ASP 75 H ASP 75 106.520 -25.278 -7.101 532 HA ASP 75 HA ASP 75 108.707 -24.648 -6.761 533 HB2 ASP 75 1HB ASP 75 110.282 -26.468 -7.214 534 HB3 ASP 75 2HB ASP 75 108.775 -27.076 -6.533 535 H TRP 76 H TRP 76 107.592 -23.551 -9.275 536 HA TRP 76 HA TRP 76 109.945 -23.549 -11.038 537 HB2 TRP 76 1HB TRP 76 107.725 -23.952 -12.037 538 HB3 TRP 76 2HB TRP 76 107.188 -22.389 -11.453 539 HD1 TRP 76 HD1 TRP 76 107.645 -20.356 -12.945 540 HE1 TRP 76 HE1 TRP 76 108.889 -19.983 -15.170 541 HE3 TRP 76 HE3 TRP 76 109.922 -24.897 -13.454 542 HZ2 TRP 76 HZ2 TRP 76 110.624 -21.423 -16.938 543 HZ3 TRP 76 HZ3 TRP 76 111.360 -25.370 -15.413 544 HH2 TRP 76 HH2 TRP 76 111.716 -23.642 -17.154 545 H ALA 77 H ALA 77 107.611 -21.111 -9.873 546 HA ALA 77 HA ALA 77 109.845 -19.297 -9.287 547 HB1 ALA 77 1HB ALA 77 108.765 -18.990 -11.667 548 HB2 ALA 77 2HB ALA 77 109.124 -17.581 -10.670 549 HB3 ALA 77 3HB ALA 77 107.476 -18.203 -10.757 550 H SER 78 H SER 78 109.139 -17.404 -8.013 551 HA SER 78 HA SER 78 106.729 -18.000 -6.389 552 HB2 SER 78 1HB SER 78 108.843 -18.526 -5.179 553 HB3 SER 78 2HB SER 78 109.354 -16.856 -5.403 554 HG SER 78 HG SER 78 106.987 -17.739 -4.092 555 H ILE 79 H ILE 79 105.534 -16.232 -5.669 556 HA ILE 79 HA ILE 79 106.340 -13.583 -6.720 557 HB ILE 79 HB ILE 79 104.647 -14.550 -8.223 558 HG12 ILE 79 1HG1 ILE 79 103.252 -12.479 -6.528 559 HG13 ILE 79 2HG1 ILE 79 104.669 -12.065 -7.490 560 HG21 ILE 79 1HG2 ILE 79 103.648 -16.000 -6.357 561 HG22 ILE 79 2HG2 ILE 79 102.507 -15.260 -7.480 562 HG23 ILE 79 3HG2 ILE 79 102.744 -14.563 -5.877 563 HD11 ILE 79 3HD1 ILE 79 102.960 -11.615 -9.005 564 HD12 ILE 79 1HD1 ILE 79 101.946 -12.927 -8.406 565 HD13 ILE 79 2HD1 ILE 79 103.344 -13.285 -9.420 566 H TYR 80 H TYR 80 105.600 -11.805 -5.463 567 HA TYR 80 HA TYR 80 104.197 -12.433 -2.970 568 HB2 TYR 80 1HB TYR 80 105.865 -11.471 -1.554 569 HB3 TYR 80 2HB TYR 80 106.620 -12.721 -2.520 570 HD1 TYR 80 HD1 TYR 80 108.157 -12.104 -4.380 571 HD2 TYR 80 HD2 TYR 80 106.497 -9.165 -1.724 572 HE1 TYR 80 HE1 TYR 80 109.867 -10.468 -5.122 573 HE2 TYR 80 HE2 TYR 80 108.206 -7.529 -2.466 574 HH TYR 80 HH TYR 80 110.585 -8.372 -4.984 575 H GLY 81 H GLY 81 103.452 -10.551 -1.832 576 HA2 GLY 81 1HA GLY 81 103.492 -8.043 -3.419 577 HA3 GLY 81 2HA GLY 81 101.970 -8.674 -2.787 578 H VAL 82 H VAL 82 103.399 -6.147 -2.165 579 HA VAL 82 HA VAL 82 103.795 -6.525 0.738 580 HB VAL 82 HB VAL 82 105.729 -4.979 0.632 581 HG11 VAL 82 1HG1 VAL 82 105.757 -7.610 -0.813 582 HG12 VAL 82 2HG1 VAL 82 106.449 -7.189 0.752 583 HG13 VAL 82 3HG1 VAL 82 107.232 -6.648 -0.731 584 HG21 VAL 82 3HG2 VAL 82 105.116 -3.855 -1.487 585 HG22 VAL 82 1HG2 VAL 82 105.447 -5.348 -2.366 586 HG23 VAL 82 2HG2 VAL 82 106.758 -4.495 -1.550 587 H VAL 83 H VAL 83 103.328 -4.785 2.020 588 HA VAL 83 HA VAL 83 102.487 -2.266 0.741 589 HB VAL 83 HB VAL 83 101.000 -3.619 3.014 590 HG11 VAL 83 1HG1 VAL 83 100.577 -1.028 1.500 591 HG12 VAL 83 2HG1 VAL 83 100.908 -1.214 3.223 592 HG13 VAL 83 3HG1 VAL 83 99.364 -1.750 2.559 593 HG21 VAL 83 3HG2 VAL 83 100.671 -4.675 0.751 594 HG22 VAL 83 1HG2 VAL 83 100.101 -3.114 0.161 595 HG23 VAL 83 2HG2 VAL 83 99.203 -3.962 1.419 596 H GLY 84 H GLY 84 102.829 -0.402 2.142 597 HA2 GLY 84 1HA GLY 84 104.004 -0.771 4.751 598 HA3 GLY 84 2HA GLY 84 105.187 -0.336 3.524 599 H VAL 85 H VAL 85 105.233 1.435 5.296 600 HA VAL 85 HA VAL 85 103.504 3.667 4.412 601 HB VAL 85 HB VAL 85 104.311 3.102 7.280 602 HG11 VAL 85 1HG1 VAL 85 102.858 5.001 7.805 603 HG12 VAL 85 2HG1 VAL 85 102.466 5.200 6.097 604 HG13 VAL 85 3HG1 VAL 85 104.106 5.508 6.667 605 HG21 VAL 85 3HG2 VAL 85 101.959 2.598 7.663 606 HG22 VAL 85 1HG2 VAL 85 102.557 1.553 6.373 607 HG23 VAL 85 2HG2 VAL 85 101.572 2.963 5.982 608 H GLY 86 H GLY 86 104.575 5.612 4.169 609 HA2 GLY 86 1HA GLY 86 107.462 5.623 4.848 610 HA3 GLY 86 2HA GLY 86 106.896 6.108 3.255 611 H TYR 87 H TYR 87 108.358 7.595 5.352 612 HA TYR 87 HA TYR 87 106.510 9.894 5.596 613 HB2 TYR 87 1HB TYR 87 108.587 9.014 7.608 614 HB3 TYR 87 2HB TYR 87 107.600 10.458 7.720 615 HD1 TYR 87 HD1 TYR 87 107.665 6.796 8.013 616 HD2 TYR 87 HD2 TYR 87 105.227 10.321 8.299 617 HE1 TYR 87 HE1 TYR 87 105.916 5.491 9.190 618 HE2 TYR 87 HE2 TYR 87 103.477 9.015 9.476 619 HH TYR 87 HH TYR 87 103.845 6.402 10.994 620 H GLY 88 H GLY 88 107.399 11.886 5.160 621 HA2 GLY 88 1HA GLY 88 110.244 11.959 4.341 622 HA3 GLY 88 2HA GLY 88 108.980 12.678 3.347 623 H LYS 89 H LYS 89 111.361 13.777 4.879 624 HA LYS 89 HA LYS 89 109.903 15.949 6.246 625 HB2 LYS 89 1HB LYS 89 111.524 15.994 8.033 626 HB3 LYS 89 2HB LYS 89 110.852 14.371 7.918 627 HG2 LYS 89 1HG LYS 89 112.851 13.690 6.571 628 HG3 LYS 89 2HG LYS 89 113.535 15.293 6.846 629 HD2 LYS 89 1HD LYS 89 113.251 14.849 9.339 630 HD3 LYS 89 2HD LYS 89 112.913 13.171 8.910 631 HE2 LYS 89 1HE LYS 89 115.111 13.197 7.616 632 HE3 LYS 89 2HE LYS 89 115.457 14.730 8.415 633 HZ1 LYS 89 3HZ LYS 89 115.048 13.551 10.559 634 HZ2 LYS 89 1HZ LYS 89 116.422 13.024 9.715 635 HZ3 LYS 89 2HZ LYS 89 115.001 12.092 9.688 636 H PHE 90 H PHE 90 110.674 17.973 5.948 637 HA PHE 90 HA PHE 90 113.097 18.319 4.307 638 HB2 PHE 90 1HB PHE 90 111.952 19.921 2.890 639 HB3 PHE 90 2HB PHE 90 111.144 18.367 2.817 640 HD1 PHE 90 HD1 PHE 90 108.954 18.038 3.953 641 HD2 PHE 90 HD2 PHE 90 110.877 21.876 3.775 642 HE1 PHE 90 HE1 PHE 90 106.818 19.136 4.567 643 HE2 PHE 90 HE2 PHE 90 108.739 22.973 4.390 644 HZ PHE 90 HZ PHE 90 106.710 21.604 4.787 645 H GLN 91 H GLN 91 114.018 20.470 4.444 646 HA GLN 91 HA GLN 91 114.299 21.470 7.007 647 HB2 GLN 91 1HB GLN 91 115.799 21.969 5.079 648 HB3 GLN 91 2HB GLN 91 114.576 23.078 4.458 649 HG2 GLN 91 1HG GLN 91 114.707 24.409 6.513 650 HG3 GLN 91 2HG GLN 91 115.884 23.287 7.185 651 HE21 GLN 91 1HE2 GLN 91 116.717 25.893 7.033 652 HE22 GLN 91 2HE2 GLN 91 117.822 26.106 5.762 653 H THR 92 H THR 92 113.481 23.270 8.130 654 HA THR 92 HA THR 92 110.720 23.968 7.305 655 HB THR 92 HB THR 92 111.837 23.806 10.110 656 HG1 THR 92 HG1 THR 92 110.077 22.001 8.840 657 HG21 THR 92 3HG2 THR 92 109.338 23.717 10.612 658 HG22 THR 92 1HG2 THR 92 109.078 24.205 8.938 659 HG23 THR 92 2HG2 THR 92 109.948 25.270 10.042 660 H THR 93 H THR 93 110.035 26.004 7.375 661 HA THR 93 HA THR 93 111.938 28.120 8.174 662 HB THR 93 HB THR 93 109.573 28.325 6.289 663 HG1 THR 93 HG1 THR 93 112.352 28.011 5.861 664 HG21 THR 93 3HG2 THR 93 110.941 30.456 5.681 665 HG22 THR 93 1HG2 THR 93 111.700 30.223 7.256 666 HG23 THR 93 2HG2 THR 93 109.958 30.477 7.146 667 H GLU 94 H GLU 94 110.953 30.023 9.247 668 HA GLU 94 HA GLU 94 109.170 29.076 11.310 669 HB2 GLU 94 1HB GLU 94 110.353 31.820 10.815 670 HB3 GLU 94 2HB GLU 94 109.472 31.341 12.266 671 HG2 GLU 94 1HG GLU 94 112.014 30.034 11.257 672 HG3 GLU 94 2HG GLU 94 111.925 31.184 12.585 673 H TYR 95 H TYR 95 107.143 28.809 10.759 674 HA TYR 95 HA TYR 95 105.712 30.957 9.330 675 HB2 TYR 95 1HB TYR 95 105.447 27.976 9.292 676 HB3 TYR 95 2HB TYR 95 104.044 28.971 8.953 677 HD1 TYR 95 HD1 TYR 95 104.847 31.108 7.310 678 HD2 TYR 95 HD2 TYR 95 106.435 27.118 7.393 679 HE1 TYR 95 HE1 TYR 95 105.614 31.366 4.966 680 HE2 TYR 95 HE2 TYR 95 107.202 27.374 5.047 681 HH TYR 95 HH TYR 95 107.180 30.436 3.434 682 HA PRO 96 HA PRO 96 103.334 31.618 13.034 683 HB2 PRO 96 1HB PRO 96 100.869 31.687 11.364 684 HB3 PRO 96 2HB PRO 96 101.513 32.911 12.476 685 HG2 PRO 96 1HG PRO 96 101.636 33.219 9.835 686 HG3 PRO 96 2HG PRO 96 102.927 33.794 10.906 687 HD2 PRO 96 1HD PRO 96 102.898 31.395 9.120 688 HD3 PRO 96 2HD PRO 96 104.251 32.462 9.559 689 H THR 97 H THR 97 101.712 30.523 14.392 690 HA THR 97 HA THR 97 101.998 27.684 13.936 691 HB THR 97 HB THR 97 100.646 29.105 16.239 692 HG1 THR 97 HG1 THR 97 102.717 29.818 16.180 693 HG21 THR 97 3HG2 THR 97 101.275 27.001 17.435 694 HG22 THR 97 1HG2 THR 97 101.815 26.331 15.896 695 HG23 THR 97 2HG2 THR 97 100.116 26.735 16.134 696 H TYR 98 H TYR 98 100.568 26.352 13.149 697 HA TYR 98 HA TYR 98 97.703 26.813 13.488 698 HB2 TYR 98 1HB TYR 98 98.299 27.856 11.315 699 HB3 TYR 98 2HB TYR 98 98.962 26.323 10.784 700 HD1 TYR 98 HD1 TYR 98 95.861 28.128 11.687 701 HD2 TYR 98 HD2 TYR 98 97.535 24.536 10.031 702 HE1 TYR 98 HE1 TYR 98 93.616 27.457 10.873 703 HE2 TYR 98 HE2 TYR 98 95.290 23.865 9.218 704 HH TYR 98 HH TYR 98 93.178 24.707 8.754 705 H LYS 99 H LYS 99 96.456 24.849 13.128 706 HA LYS 99 HA LYS 99 97.881 22.531 14.009 707 HB2 LYS 99 1HB LYS 99 95.738 21.436 14.068 708 HB3 LYS 99 2HB LYS 99 95.550 23.068 14.697 709 HG2 LYS 99 1HG LYS 99 94.742 23.782 12.425 710 HG3 LYS 99 2HG LYS 99 94.792 22.090 11.928 711 HD2 LYS 99 1HD LYS 99 93.295 21.584 13.923 712 HD3 LYS 99 2HD LYS 99 93.067 23.327 14.079 713 HE2 LYS 99 1HE LYS 99 92.350 23.345 11.645 714 HE3 LYS 99 2HE LYS 99 92.338 21.582 11.716 715 HZ1 LYS 99 3HZ LYS 99 90.896 22.025 13.826 716 HZ2 LYS 99 1HZ LYS 99 90.192 22.053 12.283 717 HZ3 LYS 99 2HZ LYS 99 90.586 23.511 13.061 718 H HIS 100 H HIS 100 98.918 21.093 12.843 719 HA HIS 100 HA HIS 100 97.988 20.011 10.396 720 HB2 HIS 100 1HB HIS 100 98.724 22.289 9.620 721 HB3 HIS 100 2HB HIS 100 100.351 21.868 10.115 722 HD1 HIS 100 HD1 HIS 100 101.716 20.420 8.536 723 HD2 HIS 100 HD2 HIS 100 97.732 20.767 7.358 724 HE1 HIS 100 HE1 HIS 100 101.565 19.409 6.220 725 H ASP 101 H ASP 101 99.516 18.443 9.487 726 HA ASP 101 HA ASP 101 100.980 17.084 11.538 727 HB2 ASP 101 1HB ASP 101 100.844 16.620 8.551 728 HB3 ASP 101 2HB ASP 101 101.606 15.527 9.703 729 H THR 102 H THR 102 103.126 17.052 11.961 730 HA THR 102 HA THR 102 104.769 19.163 10.984 731 HB THR 102 HB THR 102 106.537 18.133 12.333 732 HG1 THR 102 HG1 THR 102 106.472 16.059 12.494 733 HG21 THR 102 3HG2 THR 102 103.883 17.913 13.772 734 HG22 THR 102 1HG2 THR 102 104.653 19.452 13.385 735 HG23 THR 102 2HG2 THR 102 105.451 18.315 14.472 736 H SER 103 H SER 103 104.469 15.747 10.155 737 HA SER 103 HA SER 103 106.403 16.170 7.952 738 HB2 SER 103 1HB SER 103 107.199 13.893 8.244 739 HB3 SER 103 2HB SER 103 107.370 14.765 9.764 740 HG SER 103 HG SER 103 106.115 13.307 10.599 741 H ASP 104 H ASP 104 106.074 14.652 6.126 742 HA ASP 104 HA ASP 104 103.180 14.295 5.675 743 HB2 ASP 104 1HB ASP 104 105.480 14.347 3.705 744 HB3 ASP 104 2HB ASP 104 103.772 14.211 3.289 745 H TYR 105 H TYR 105 102.324 12.311 5.062 746 HA TYR 105 HA TYR 105 104.181 10.023 4.920 747 HB2 TYR 105 1HB TYR 105 102.853 8.729 6.434 748 HB3 TYR 105 2HB TYR 105 103.293 10.228 7.225 749 HD1 TYR 105 HD2 TYR 105 101.602 11.925 7.735 750 HD2 TYR 105 HD1 TYR 105 100.554 8.240 5.793 751 HE1 TYR 105 HE2 TYR 105 99.208 12.350 8.220 752 HE2 TYR 105 HE1 TYR 105 98.160 8.665 6.279 753 HH TYR 105 HH TYR 105 97.132 11.114 8.446 754 H GLY 106 H GLY 106 103.318 8.148 3.880 755 HA2 GLY 106 1HA GLY 106 100.740 8.363 2.539 756 HA3 GLY 106 2HA GLY 106 102.146 8.380 1.481 757 H PHE 107 H PHE 107 100.511 6.398 0.991 758 HA PHE 107 HA PHE 107 101.526 4.018 2.448 759 HB2 PHE 107 1HB PHE 107 98.913 4.399 0.981 760 HB3 PHE 107 2HB PHE 107 99.453 2.896 1.706 761 HD1 PHE 107 HD1 PHE 107 99.624 2.693 4.182 762 HD2 PHE 107 HD2 PHE 107 97.998 6.189 2.288 763 HE1 PHE 107 HE1 PHE 107 98.612 3.389 6.336 764 HE2 PHE 107 HE2 PHE 107 96.986 6.886 4.443 765 HZ PHE 107 HZ PHE 107 97.293 5.485 6.467 766 H SER 108 H SER 108 102.323 2.290 1.254 767 HA SER 108 HA SER 108 102.445 2.658 -1.684 768 HB2 SER 108 1HB SER 108 104.749 1.836 0.100 769 HB3 SER 108 2HB SER 108 104.786 1.952 -1.657 770 HG SER 108 HG SER 108 105.513 3.891 -0.995 771 H TYR 109 H TYR 109 102.445 0.787 -2.900 772 HA TYR 109 HA TYR 109 102.656 -1.802 -1.589 773 HB2 TYR 109 1HB TYR 109 100.515 -2.612 -2.297 774 HB3 TYR 109 2HB TYR 109 100.270 -1.156 -1.355 775 HD1 TYR 109 HD1 TYR 109 99.602 0.962 -2.477 776 HD2 TYR 109 HD2 TYR 109 99.921 -2.747 -4.620 777 HE1 TYR 109 HE1 TYR 109 98.285 1.928 -4.343 778 HE2 TYR 109 HE2 TYR 109 98.603 -1.782 -6.486 779 HH TYR 109 HH TYR 109 96.695 0.552 -6.372 780 H GLY 110 H GLY 110 102.747 -3.584 -3.160 781 HA2 GLY 110 1HA GLY 110 102.681 -3.235 -5.953 782 HA3 GLY 110 2HA GLY 110 104.342 -2.998 -5.417 783 H ALA 111 H ALA 111 104.327 -4.976 -7.007 784 HA ALA 111 HA ALA 111 104.425 -7.377 -5.310 785 HB1 ALA 111 1HB ALA 111 102.266 -7.274 -6.686 786 HB2 ALA 111 2HB ALA 111 103.244 -8.731 -6.857 787 HB3 ALA 111 3HB ALA 111 103.291 -7.485 -8.104 788 H GLY 112 H GLY 112 105.834 -9.051 -6.166 789 HA2 GLY 112 1HA GLY 112 107.673 -8.175 -8.290 790 HA3 GLY 112 2HA GLY 112 108.340 -8.520 -6.698 791 H LEU 113 H LEU 113 109.073 -9.862 -9.058 792 HA LEU 113 HA LEU 113 108.074 -12.599 -8.533 793 HB2 LEU 113 1HB LEU 113 109.024 -11.474 -11.181 794 HB3 LEU 113 2HB LEU 113 108.440 -13.112 -10.893 795 HG LEU 113 HG LEU 113 106.793 -10.603 -10.459 796 HD11 LEU 113 1HD1 LEU 113 107.000 -12.551 -12.758 797 HD12 LEU 113 2HD1 LEU 113 107.066 -10.790 -12.808 798 HD13 LEU 113 3HD1 LEU 113 105.537 -11.606 -12.481 799 HD21 LEU 113 3HD2 LEU 113 104.930 -12.316 -10.399 800 HD22 LEU 113 1HD2 LEU 113 106.045 -12.408 -9.036 801 HD23 LEU 113 2HD2 LEU 113 106.170 -13.569 -10.358 802 H GLN 114 H GLN 114 109.630 -14.272 -8.643 803 HA GLN 114 HA GLN 114 112.435 -13.347 -8.424 804 HB2 GLN 114 1HB GLN 114 111.459 -14.445 -6.408 805 HB3 GLN 114 2HB GLN 114 111.192 -15.899 -7.370 806 HG2 GLN 114 1HG GLN 114 113.595 -16.067 -7.828 807 HG3 GLN 114 2HG GLN 114 113.886 -14.583 -6.925 808 HE21 GLN 114 1HE2 GLN 114 115.260 -16.786 -6.034 809 HE22 GLN 114 2HE2 GLN 114 114.582 -17.384 -4.598 810 H PHE 115 H PHE 115 113.913 -14.093 -9.846 811 HA PHE 115 HA PHE 115 113.057 -16.203 -11.749 812 HB2 PHE 115 1HB PHE 115 114.661 -13.707 -12.314 813 HB3 PHE 115 2HB PHE 115 114.365 -14.997 -13.465 814 HD1 PHE 115 HD1 PHE 115 112.062 -15.395 -14.332 815 HD2 PHE 115 HD2 PHE 115 113.002 -12.055 -11.801 816 HE1 PHE 115 HE1 PHE 115 109.945 -14.292 -15.002 817 HE2 PHE 115 HE2 PHE 115 110.885 -10.951 -12.471 818 HZ PHE 115 HZ PHE 115 109.356 -12.070 -14.071 819 H ASN 116 H ASN 116 114.754 -17.480 -12.647 820 HA ASN 116 HA ASN 116 116.593 -18.826 -12.442 821 HB2 ASN 116 1HB ASN 116 117.627 -16.102 -11.774 822 HB3 ASN 116 2HB ASN 116 118.672 -17.487 -11.472 823 HD21 ASN 116 1HD2 ASN 116 118.767 -15.294 -13.628 824 HD22 ASN 116 2HD2 ASN 116 118.868 -16.159 -15.085 825 HA PRO 117 HA PRO 117 115.986 -19.331 -7.884 826 HB2 PRO 117 1HB PRO 117 114.350 -21.471 -7.825 827 HB3 PRO 117 2HB PRO 117 113.728 -19.831 -8.104 828 HG2 PRO 117 1HG PRO 117 114.133 -22.046 -10.020 829 HG3 PRO 117 2HG PRO 117 112.911 -20.766 -10.007 830 HD2 PRO 117 1HD PRO 117 115.259 -20.803 -11.572 831 HD3 PRO 117 2HD PRO 117 114.185 -19.411 -11.317 832 H MET 118 H MET 118 118.092 -20.326 -9.702 833 HA MET 118 HA MET 118 118.707 -22.894 -8.358 834 HB2 MET 118 1HB MET 118 119.460 -21.956 -11.137 835 HB3 MET 118 2HB MET 118 120.096 -23.410 -10.367 836 HG2 MET 118 1HG MET 118 117.765 -24.253 -10.109 837 HG3 MET 118 2HG MET 118 117.183 -22.835 -10.981 838 HE1 MET 118 3HE MET 118 116.005 -24.209 -12.935 839 HE2 MET 118 1HE MET 118 116.351 -25.513 -11.791 840 HE3 MET 118 2HE MET 118 116.700 -25.725 -13.505 841 H GLU 119 H GLU 119 121.050 -23.265 -8.062 842 HA GLU 119 HA GLU 119 123.044 -22.620 -7.123 843 HB2 GLU 119 1HB GLU 119 122.694 -20.320 -9.063 844 HB3 GLU 119 2HB GLU 119 124.190 -20.710 -8.215 845 HG2 GLU 119 1HG GLU 119 124.152 -22.973 -9.246 846 HG3 GLU 119 2HG GLU 119 122.713 -22.517 -10.147 847 H ASN 120 H ASN 120 124.133 -20.270 -6.319 848 HA ASN 120 HA ASN 120 122.338 -19.550 -4.150 849 HB2 ASN 120 1HB ASN 120 124.279 -18.522 -3.134 850 HB3 ASN 120 2HB ASN 120 124.696 -20.132 -3.712 851 HD21 ASN 120 1HD2 ASN 120 126.697 -18.121 -3.296 852 HD22 ASN 120 2HD2 ASN 120 127.346 -17.697 -4.806 853 H VAL 121 H VAL 121 122.263 -18.383 -7.120 854 HA VAL 121 HA VAL 121 122.016 -15.560 -6.238 855 HB VAL 121 HB VAL 121 122.845 -16.535 -8.984 856 HG11 VAL 121 1HG1 VAL 121 122.693 -13.761 -7.762 857 HG12 VAL 121 2HG1 VAL 121 121.631 -14.397 -9.017 858 HG13 VAL 121 3HG1 VAL 121 123.341 -14.134 -9.360 859 HG21 VAL 121 3HG2 VAL 121 124.734 -16.924 -7.630 860 HG22 VAL 121 1HG2 VAL 121 124.397 -15.530 -6.603 861 HG23 VAL 121 2HG2 VAL 121 125.009 -15.293 -8.239 862 H ALA 122 H ALA 122 120.075 -14.693 -6.471 863 HA ALA 122 HA ALA 122 118.328 -15.594 -8.663 864 HB1 ALA 122 1HB ALA 122 116.412 -15.271 -6.908 865 HB2 ALA 122 2HB ALA 122 117.688 -15.576 -5.729 866 HB3 ALA 122 3HB ALA 122 117.300 -16.793 -6.945 867 H LEU 123 H LEU 123 116.738 -13.977 -9.282 868 HA LEU 123 HA LEU 123 117.612 -11.241 -8.523 869 HB2 LEU 123 1HB LEU 123 116.464 -12.176 -11.164 870 HB3 LEU 123 2HB LEU 123 117.006 -10.544 -10.780 871 HG LEU 123 HG LEU 123 118.777 -13.006 -10.733 872 HD11 LEU 123 1HD1 LEU 123 118.492 -10.765 -12.758 873 HD12 LEU 123 2HD1 LEU 123 118.136 -12.472 -13.022 874 HD13 LEU 123 3HD1 LEU 123 119.800 -11.949 -12.761 875 HD21 LEU 123 3HD2 LEU 123 119.196 -10.076 -10.173 876 HD22 LEU 123 1HD2 LEU 123 120.527 -11.056 -10.786 877 HD23 LEU 123 2HD2 LEU 123 119.760 -11.470 -9.253 878 H ASP 124 H ASP 124 116.041 -9.686 -8.125 879 HA ASP 124 HA ASP 124 113.230 -10.639 -8.111 880 HB2 ASP 124 1HB ASP 124 114.629 -8.935 -6.035 881 HB3 ASP 124 2HB ASP 124 112.907 -9.304 -6.052 882 H PHE 125 H PHE 125 111.890 -9.387 -9.236 883 HA PHE 125 HA PHE 125 112.602 -6.537 -9.646 884 HB2 PHE 125 1HB PHE 125 113.044 -7.989 -11.670 885 HB3 PHE 125 2HB PHE 125 111.323 -8.318 -11.722 886 HD1 PHE 125 HD1 PHE 125 113.905 -5.681 -12.037 887 HD2 PHE 125 HD2 PHE 125 109.772 -6.706 -12.598 888 HE1 PHE 125 HE1 PHE 125 113.570 -3.606 -13.353 889 HE2 PHE 125 HE2 PHE 125 109.437 -4.631 -13.913 890 HZ PHE 125 HZ PHE 125 111.335 -3.081 -14.291 891 H SER 126 H SER 126 110.959 -5.147 -9.200 892 HA SER 126 HA SER 126 108.218 -6.193 -9.060 893 HB2 SER 126 1HB SER 126 107.888 -5.373 -6.802 894 HB3 SER 126 2HB SER 126 109.247 -6.491 -6.815 895 HG SER 126 HG SER 126 109.158 -3.828 -6.233 896 H TYR 127 H TYR 127 106.590 -4.578 -8.998 897 HA TYR 127 HA TYR 127 107.485 -1.897 -9.880 898 HB2 TYR 127 1HB TYR 127 104.798 -3.241 -10.223 899 HB3 TYR 127 2HB TYR 127 105.238 -1.654 -10.824 900 HD1 TYR 127 HD1 TYR 127 106.998 -1.465 -12.629 901 HD2 TYR 127 HD2 TYR 127 105.313 -5.225 -11.415 902 HE1 TYR 127 HE1 TYR 127 107.794 -2.501 -14.737 903 HE2 TYR 127 HE2 TYR 127 106.109 -6.262 -13.522 904 HH TYR 127 HH TYR 127 107.453 -4.347 -16.118 905 H GLU 128 H GLU 128 107.060 -0.190 -8.585 906 HA GLU 128 HA GLU 128 105.317 -0.650 -6.225 907 HB2 GLU 128 1HB GLU 128 107.762 -0.488 -5.714 908 HB3 GLU 128 2HB GLU 128 107.743 1.149 -6.373 909 HG2 GLU 128 1HG GLU 128 105.970 1.755 -4.736 910 HG3 GLU 128 2HG GLU 128 106.088 0.145 -4.042 911 H GLN 129 H GLN 129 103.734 0.758 -5.854 912 HA GLN 129 HA GLN 129 103.876 3.441 -7.072 913 HB2 GLN 129 1HB GLN 129 101.459 1.613 -7.031 914 HB3 GLN 129 2HB GLN 129 101.425 3.313 -7.500 915 HG2 GLN 129 1HG GLN 129 102.991 2.876 -9.325 916 HG3 GLN 129 2HG GLN 129 103.126 1.190 -8.836 917 HE21 GLN 129 1HE2 GLN 129 102.225 1.925 -11.455 918 HE22 GLN 129 2HE2 GLN 129 100.592 1.478 -11.599 919 H SER 130 H SER 130 103.188 5.079 -5.717 920 HA SER 130 HA SER 130 101.898 4.325 -3.183 921 HB2 SER 130 1HB SER 130 103.519 5.519 -1.853 922 HB3 SER 130 2HB SER 130 104.374 4.338 -2.839 923 HG SER 130 HG SER 130 105.378 5.937 -3.757 924 H ARG 131 H ARG 131 100.739 5.958 -2.191 925 HA ARG 131 HA ARG 131 100.344 8.415 -3.805 926 HB2 ARG 131 1HB ARG 131 98.369 6.884 -2.092 927 HB3 ARG 131 2HB ARG 131 98.041 8.440 -2.856 928 HG2 ARG 131 1HG ARG 131 98.563 7.413 -5.074 929 HG3 ARG 131 2HG ARG 131 98.738 5.852 -4.272 930 HD2 ARG 131 1HD ARG 131 96.236 7.562 -4.322 931 HD3 ARG 131 2HD ARG 131 96.487 6.062 -5.210 932 HE ARG 131 HE ARG 131 95.953 6.338 -2.357 933 HH11 ARG 131 1HH1 ARG 131 96.983 4.188 -4.935 934 HH12 ARG 131 2HH1 ARG 131 96.614 2.761 -4.028 935 HH21 ARG 131 1HH2 ARG 131 95.497 4.463 -1.237 936 HH22 ARG 131 2HH2 ARG 131 95.783 2.915 -1.960 937 H ILE 132 H ILE 132 100.766 10.279 -2.832 938 HA ILE 132 HA ILE 132 100.962 10.369 0.114 939 HB ILE 132 HB ILE 132 102.902 11.671 -1.825 940 HG12 ILE 132 1HG1 ILE 132 103.386 9.414 0.142 941 HG13 ILE 132 2HG1 ILE 132 103.160 9.178 -1.592 942 HG21 ILE 132 1HG2 ILE 132 102.460 12.950 0.258 943 HG22 ILE 132 2HG2 ILE 132 104.108 12.321 0.211 944 HG23 ILE 132 3HG2 ILE 132 102.888 11.524 1.205 945 HD11 ILE 132 3HD1 ILE 132 105.423 10.549 -0.157 946 HD12 ILE 132 1HD1 ILE 132 105.071 10.931 -1.842 947 HD13 ILE 132 2HD1 ILE 132 105.498 9.283 -1.381 948 H ARG 133 H ARG 133 99.118 11.506 0.415 949 HA ARG 133 HA ARG 133 97.214 12.591 -0.513 950 HB2 ARG 133 1HB ARG 133 99.065 14.747 0.506 951 HB3 ARG 133 2HB ARG 133 97.309 14.839 0.413 952 HG2 ARG 133 1HG ARG 133 98.812 12.761 2.028 953 HG3 ARG 133 2HG ARG 133 98.169 14.257 2.702 954 HD2 ARG 133 1HD ARG 133 95.895 13.575 1.892 955 HD3 ARG 133 2HD ARG 133 96.581 12.031 1.397 956 HE ARG 133 HE ARG 133 97.274 12.417 4.073 957 HH11 ARG 133 1HH1 ARG 133 94.329 11.963 2.217 958 HH12 ARG 133 2HH1 ARG 133 93.490 11.227 3.542 959 HH21 ARG 133 1HH2 ARG 133 96.142 11.463 5.741 960 HH22 ARG 133 2HH2 ARG 133 94.504 10.948 5.511 961 H SER 134 H SER 134 97.176 12.380 -2.772 962 HA SER 134 HA SER 134 96.491 13.440 -4.691 963 HB2 SER 134 1HB SER 134 96.060 15.477 -3.300 964 HB3 SER 134 2HB SER 134 97.705 15.996 -3.647 965 HG SER 134 HG SER 134 96.200 16.855 -5.142 966 H VAL 135 H VAL 135 99.746 13.255 -3.641 967 HA VAL 135 HA VAL 135 100.713 13.857 -6.367 968 HB VAL 135 HB VAL 135 102.291 13.415 -3.816 969 HG11 VAL 135 1HG1 VAL 135 104.134 14.422 -5.184 970 HG12 VAL 135 2HG1 VAL 135 103.075 14.348 -6.593 971 HG13 VAL 135 3HG1 VAL 135 103.589 12.861 -5.797 972 HG21 VAL 135 3HG2 VAL 135 100.991 15.480 -3.672 973 HG22 VAL 135 1HG2 VAL 135 101.517 15.954 -5.287 974 HG23 VAL 135 2HG2 VAL 135 102.684 15.881 -3.967 975 H ASP 136 H ASP 136 101.526 12.244 -7.644 976 HA ASP 136 HA ASP 136 101.248 9.496 -6.566 977 HB2 ASP 136 1HB ASP 136 101.179 10.518 -9.412 978 HB3 ASP 136 2HB ASP 136 101.081 8.820 -8.952 979 H VAL 137 H VAL 137 103.033 8.261 -6.328 980 HA VAL 137 HA VAL 137 105.518 9.141 -7.695 981 HB VAL 137 HB VAL 137 105.290 7.840 -4.969 982 HG11 VAL 137 1HG1 VAL 137 107.706 8.438 -4.837 983 HG12 VAL 137 2HG1 VAL 137 107.639 8.984 -6.512 984 HG13 VAL 137 3HG1 VAL 137 107.372 7.283 -6.128 985 HG21 VAL 137 3HG2 VAL 137 104.465 10.189 -5.002 986 HG22 VAL 137 1HG2 VAL 137 105.995 10.696 -5.719 987 HG23 VAL 137 2HG2 VAL 137 105.964 10.028 -4.088 988 H GLY 138 H GLY 138 106.602 7.642 -8.822 989 HA2 GLY 138 1HA GLY 138 105.699 4.820 -8.632 990 HA3 GLY 138 2HA GLY 138 106.120 5.594 -10.158 991 H THR 139 H THR 139 107.261 3.398 -8.141 992 HA THR 139 HA THR 139 110.084 4.150 -8.610 993 HB THR 139 HB THR 139 109.024 2.796 -6.119 994 HG1 THR 139 HG1 THR 139 109.619 5.461 -6.769 995 HG21 THR 139 3HG2 THR 139 111.230 2.099 -6.299 996 HG22 THR 139 1HG2 THR 139 111.434 3.610 -5.413 997 HG23 THR 139 2HG2 THR 139 111.735 3.559 -7.151 998 H TRP 140 H TRP 140 111.324 2.580 -9.460 999 HA TRP 140 HA TRP 140 110.177 -0.140 -9.684 1000 HB2 TRP 140 1HB TRP 140 112.276 1.279 -11.331 1001 HB3 TRP 140 2HB TRP 140 111.855 -0.412 -11.519 1002 HD1 TRP 140 HD1 TRP 140 109.211 -0.878 -12.224 1003 HE1 TRP 140 HE1 TRP 140 107.723 0.479 -13.832 1004 HE3 TRP 140 HE3 TRP 140 111.767 3.542 -12.271 1005 HZ2 TRP 140 HZ2 TRP 140 107.629 3.098 -14.988 1006 HZ3 TRP 140 HZ3 TRP 140 110.959 5.447 -13.630 1007 HH2 TRP 140 HH2 TRP 140 108.896 5.233 -14.988 1008 H ILE 141 H ILE 141 111.190 -1.801 -8.699 1009 HA ILE 141 HA ILE 141 113.802 -1.243 -7.402 1010 HB ILE 141 HB ILE 141 111.566 -3.001 -6.355 1011 HG12 ILE 141 1HG1 ILE 141 112.518 -0.308 -5.332 1012 HG13 ILE 141 2HG1 ILE 141 111.070 -0.529 -6.314 1013 HG21 ILE 141 1HG2 ILE 141 114.144 -2.052 -5.067 1014 HG22 ILE 141 2HG2 ILE 141 113.871 -3.676 -5.698 1015 HG23 ILE 141 3HG2 ILE 141 112.931 -3.094 -4.324 1016 HD11 ILE 141 3HD1 ILE 141 111.604 -1.768 -3.599 1017 HD12 ILE 141 1HD1 ILE 141 110.191 -2.110 -4.597 1018 HD13 ILE 141 2HD1 ILE 141 110.445 -0.487 -3.955 1019 H ALA 142 H ALA 142 115.409 -2.541 -7.990 1020 HA ALA 142 HA ALA 142 114.796 -5.355 -8.627 1021 HB1 ALA 142 1HB ALA 142 116.744 -5.057 -10.380 1022 HB2 ALA 142 2HB ALA 142 116.224 -3.372 -10.362 1023 HB3 ALA 142 3HB ALA 142 115.087 -4.641 -10.817 1024 H GLY 143 H GLY 143 116.345 -6.813 -7.893 1025 HA2 GLY 143 1HA GLY 143 118.920 -5.866 -6.947 1026 HA3 GLY 143 2HA GLY 143 117.801 -6.305 -5.664 1027 H VAL 144 H VAL 144 119.815 -7.764 -5.405 1028 HA VAL 144 HA VAL 144 119.227 -10.352 -6.673 1029 HB VAL 144 HB VAL 144 121.095 -9.354 -7.937 1030 HG11 VAL 144 1HG1 VAL 144 121.901 -7.962 -5.961 1031 HG12 VAL 144 2HG1 VAL 144 123.164 -8.750 -6.906 1032 HG13 VAL 144 3HG1 VAL 144 122.669 -9.430 -5.356 1033 HG21 VAL 144 3HG2 VAL 144 122.107 -11.551 -6.114 1034 HG22 VAL 144 1HG2 VAL 144 122.590 -11.237 -7.780 1035 HG23 VAL 144 2HG2 VAL 144 120.968 -11.832 -7.430 1036 H GLY 145 H GLY 145 119.641 -12.132 -5.341 1037 HA2 GLY 145 1HA GLY 145 120.707 -11.594 -2.655 1038 HA3 GLY 145 2HA GLY 145 119.065 -12.213 -2.784 1039 H TYR 146 H TYR 146 120.834 -13.643 -1.366 1040 HA TYR 146 HA TYR 146 121.187 -16.047 -3.023 1041 HB2 TYR 146 1HB TYR 146 123.350 -16.502 -2.086 1042 HB3 TYR 146 2HB TYR 146 123.376 -14.902 -2.798 1043 HD1 TYR 146 HD1 TYR 146 123.394 -12.885 -1.337 1044 HD2 TYR 146 HD2 TYR 146 123.662 -16.861 0.266 1045 HE1 TYR 146 HE1 TYR 146 124.210 -11.963 0.816 1046 HE2 TYR 146 HE2 TYR 146 124.478 -15.940 2.418 1047 HH TYR 146 HH TYR 146 125.647 -12.873 2.778 1048 H ARG 147 H ARG 147 120.778 -17.973 -1.967 1049 HA ARG 147 HA ARG 147 119.702 -17.720 0.786 1050 HB2 ARG 147 1HB ARG 147 118.017 -18.227 -0.989 1051 HB3 ARG 147 2HB ARG 147 118.896 -19.716 -1.341 1052 HG2 ARG 147 1HG ARG 147 118.551 -20.500 0.949 1053 HG3 ARG 147 2HG ARG 147 117.745 -18.989 1.369 1054 HD2 ARG 147 1HD ARG 147 116.027 -20.616 0.916 1055 HD3 ARG 147 2HD ARG 147 116.054 -19.484 -0.432 1056 HE ARG 147 HE ARG 147 117.734 -21.782 -0.865 1057 HH11 ARG 147 1HH1 ARG 147 114.430 -20.623 -1.118 1058 HH12 ARG 147 2HH1 ARG 147 114.011 -21.779 -2.337 1059 HH21 ARG 147 1HH2 ARG 147 117.138 -23.246 -2.438 1060 HH22 ARG 147 2HH2 ARG 147 115.526 -23.245 -3.074 1061 H PHE 148 H PHE 148 120.383 -19.116 2.317 1062 HA PHE 148 HA PHE 148 121.964 -21.461 1.562 1063 HB2 PHE 148 1HB PHE 148 123.811 -20.868 3.016 1064 HB3 PHE 148 2HB PHE 148 123.597 -19.641 1.782 1065 HD1 PHE 148 HD1 PHE 148 123.331 -20.426 5.362 1066 HD2 PHE 148 HD2 PHE 148 122.798 -17.399 2.360 1067 HE1 PHE 148 HE1 PHE 148 123.188 -18.694 7.132 1068 HE2 PHE 148 HE2 PHE 148 122.655 -15.668 4.131 1069 HZ PHE 148 HZ PHE 148 122.850 -16.317 6.517 Start of MODEL 2 1 H1 ALA 1 3H ALA 1 118.006 -24.621 8.789 2 H2 ALA 1 2H ALA 1 116.387 -24.945 8.388 3 H3 ALA 1 HT3 ALA 1 116.851 -24.805 10.017 4 HA ALA 1 HA ALA 1 115.670 -22.831 8.905 5 HB1 ALA 1 2HB ALA 1 118.292 -22.442 10.381 6 HB2 ALA 1 3HB ALA 1 116.750 -22.818 11.148 7 HB3 ALA 1 1HB ALA 1 116.962 -21.287 10.299 8 H THR 2 H THR 2 115.718 -21.707 7.070 9 HA THR 2 HA THR 2 118.329 -21.205 5.756 10 HB THR 2 HB THR 2 115.657 -21.623 4.395 11 HG1 THR 2 HG1 THR 2 117.888 -23.344 4.333 12 HG21 THR 2 3HG2 THR 2 116.920 -21.574 2.352 13 HG22 THR 2 1HG2 THR 2 118.449 -21.554 3.230 14 HG23 THR 2 2HG2 THR 2 117.387 -20.146 3.277 15 H SER 3 H SER 3 118.718 -19.156 5.041 16 HA SER 3 HA SER 3 116.560 -17.154 5.336 17 HB2 SER 3 1HB SER 3 118.064 -17.083 7.319 18 HB3 SER 3 2HB SER 3 119.426 -16.794 6.243 19 HG SER 3 HG SER 3 118.288 -14.915 5.513 20 H THR 4 H THR 4 116.620 -15.457 3.883 21 HA THR 4 HA THR 4 118.700 -15.587 1.774 22 HB THR 4 HB THR 4 115.775 -14.912 1.378 23 HG1 THR 4 HG1 THR 4 115.492 -16.955 1.064 24 HG21 THR 4 3HG2 THR 4 117.172 -13.801 -0.243 25 HG22 THR 4 1HG2 THR 4 116.444 -15.198 -1.039 26 HG23 THR 4 2HG2 THR 4 118.122 -15.264 -0.501 27 H VAL 5 H VAL 5 119.671 -13.695 1.284 28 HA VAL 5 HA VAL 5 118.503 -11.206 2.411 29 HB VAL 5 HB VAL 5 121.448 -11.904 2.228 30 HG11 VAL 5 1HG1 VAL 5 119.935 -9.523 3.336 31 HG12 VAL 5 2HG1 VAL 5 121.098 -9.523 2.011 32 HG13 VAL 5 3HG1 VAL 5 121.640 -9.833 3.660 33 HG21 VAL 5 3HG2 VAL 5 121.399 -12.130 4.634 34 HG22 VAL 5 1HG2 VAL 5 120.137 -13.175 3.981 35 HG23 VAL 5 2HG2 VAL 5 119.711 -11.621 4.698 36 H THR 6 H THR 6 118.240 -9.600 0.953 37 HA THR 6 HA THR 6 119.746 -9.766 -1.590 38 HB THR 6 HB THR 6 117.852 -9.321 -2.917 39 HG1 THR 6 HG1 THR 6 116.884 -7.780 -1.618 40 HG21 THR 6 3HG2 THR 6 116.248 -11.038 -1.172 41 HG22 THR 6 1HG2 THR 6 117.887 -11.643 -1.404 42 HG23 THR 6 2HG2 THR 6 116.853 -11.339 -2.799 43 H GLY 7 H GLY 7 119.897 -7.756 -2.741 44 HA2 GLY 7 1HA GLY 7 119.078 -5.332 -1.296 45 HA3 GLY 7 2HA GLY 7 120.782 -5.501 -1.727 46 H GLY 8 H GLY 8 118.812 -3.522 -2.711 47 HA2 GLY 8 1HA GLY 8 119.301 -3.929 -5.563 48 HA3 GLY 8 2HA GLY 8 117.614 -3.863 -5.077 49 H TYR 9 H TYR 9 118.422 -2.096 -6.855 50 HA TYR 9 HA TYR 9 118.700 0.462 -5.391 51 HB2 TYR 9 1HB TYR 9 119.576 -0.191 -8.211 52 HB3 TYR 9 2HB TYR 9 119.710 1.376 -7.435 53 HD1 TYR 9 HD2 TYR 9 121.399 1.786 -5.710 54 HD2 TYR 9 HD1 TYR 9 121.049 -2.042 -7.627 55 HE1 TYR 9 HE2 TYR 9 123.622 1.139 -4.823 56 HE2 TYR 9 HE1 TYR 9 123.273 -2.689 -6.741 57 HH TYR 9 HH TYR 9 125.374 -1.453 -5.970 58 H ALA 10 H ALA 10 117.278 2.108 -5.940 59 HA ALA 10 HA ALA 10 115.291 1.549 -8.046 60 HB1 ALA 10 1HB ALA 10 113.466 1.778 -6.656 61 HB2 ALA 10 2HB ALA 10 114.359 2.708 -5.452 62 HB3 ALA 10 3HB ALA 10 114.592 0.963 -5.572 63 H GLN 11 H GLN 11 114.513 3.317 -9.095 64 HA GLN 11 HA GLN 11 115.302 5.996 -8.100 65 HB2 GLN 11 1HB GLN 11 114.861 5.153 -10.979 66 HB3 GLN 11 2HB GLN 11 115.358 6.749 -10.421 67 HG2 GLN 11 1HG GLN 11 116.935 4.181 -10.086 68 HG3 GLN 11 2HG GLN 11 117.297 5.469 -11.229 69 HE21 GLN 11 1HE2 GLN 11 118.536 4.308 -8.495 70 HE22 GLN 11 2HE2 GLN 11 119.001 5.738 -7.709 71 H SER 12 H SER 12 113.652 7.568 -8.059 72 HA SER 12 HA SER 12 110.932 6.505 -8.612 73 HB2 SER 12 1HB SER 12 111.808 8.242 -6.294 74 HB3 SER 12 2HB SER 12 110.161 7.717 -6.626 75 HG SER 12 HG SER 12 111.953 6.450 -5.235 76 H ASP 13 H ASP 13 109.554 7.779 -9.648 77 HA ASP 13 HA ASP 13 110.371 10.563 -10.251 78 HB2 ASP 13 1HB ASP 13 108.594 8.676 -11.825 79 HB3 ASP 13 2HB ASP 13 108.911 10.356 -12.248 80 H ALA 14 H ALA 14 108.871 12.190 -9.839 81 HA ALA 14 HA ALA 14 106.421 11.338 -8.405 82 HB1 ALA 14 1HB ALA 14 107.932 12.064 -6.718 83 HB2 ALA 14 2HB ALA 14 106.812 13.400 -6.981 84 HB3 ALA 14 3HB ALA 14 108.436 13.461 -7.669 85 H GLN 15 H GLN 15 104.835 11.828 -9.732 86 HA GLN 15 HA GLN 15 104.800 14.109 -11.471 87 HB2 GLN 15 1HB GLN 15 102.515 12.353 -10.530 88 HB3 GLN 15 2HB GLN 15 102.458 13.489 -11.876 89 HG2 GLN 15 1HG GLN 15 104.262 11.060 -11.684 90 HG3 GLN 15 2HG GLN 15 102.822 11.194 -12.687 91 HE21 GLN 15 1HE2 GLN 15 106.022 11.142 -13.096 92 HE22 GLN 15 2HE2 GLN 15 106.212 12.287 -14.335 93 H GLY 16 H GLY 16 104.354 16.113 -10.955 94 HA2 GLY 16 1HA GLY 16 103.194 17.869 -9.846 95 HA3 GLY 16 2HA GLY 16 102.808 16.758 -8.541 96 H GLN 17 H GLN 17 105.831 15.913 -8.745 97 HA GLN 17 HA GLN 17 106.966 18.268 -7.355 98 HB2 GLN 17 1HB GLN 17 106.676 16.164 -5.976 99 HB3 GLN 17 2HB GLN 17 107.841 15.392 -7.047 100 HG2 GLN 17 1HG GLN 17 109.541 17.036 -6.454 101 HG3 GLN 17 2HG GLN 17 108.383 17.916 -5.463 102 HE21 GLN 17 1HE2 GLN 17 110.651 17.105 -4.159 103 HE22 GLN 17 2HE2 GLN 17 110.333 15.776 -3.152 104 H MET 18 H MET 18 109.255 18.669 -7.764 105 HA MET 18 HA MET 18 109.903 18.202 -10.558 106 HB2 MET 18 1HB MET 18 111.316 19.790 -8.405 107 HB3 MET 18 2HB MET 18 111.800 19.737 -10.101 108 HG2 MET 18 1HG MET 18 109.497 20.548 -10.711 109 HG3 MET 18 2HG MET 18 109.177 20.768 -8.990 110 HE1 MET 18 3HE MET 18 111.198 21.298 -11.908 111 HE2 MET 18 1HE MET 18 112.692 21.866 -11.151 112 HE3 MET 18 2HE MET 18 111.616 23.010 -11.951 113 H ASN 19 H ASN 19 112.092 17.599 -11.185 114 HA ASN 19 HA ASN 19 113.736 16.041 -11.358 115 HB2 ASN 19 1HB ASN 19 115.359 16.071 -9.562 116 HB3 ASN 19 2HB ASN 19 114.746 17.695 -9.848 117 HD21 ASN 19 1HD2 ASN 19 114.551 18.725 -7.859 118 HD22 ASN 19 2HD2 ASN 19 113.922 18.012 -6.453 119 H LYS 20 H LYS 20 114.907 14.193 -9.891 120 HA LYS 20 HA LYS 20 112.772 12.370 -8.987 121 HB2 LYS 20 1HB LYS 20 113.739 10.551 -10.244 122 HB3 LYS 20 2HB LYS 20 113.417 11.886 -11.343 123 HG2 LYS 20 1HG LYS 20 115.816 12.573 -11.133 124 HG3 LYS 20 2HG LYS 20 116.104 11.135 -10.152 125 HD2 LYS 20 1HD LYS 20 115.150 9.780 -12.090 126 HD3 LYS 20 2HD LYS 20 115.252 11.256 -13.052 127 HE2 LYS 20 1HE LYS 20 117.655 10.306 -11.517 128 HE3 LYS 20 2HE LYS 20 117.267 9.582 -13.078 129 HZ1 LYS 20 3HZ LYS 20 118.740 11.425 -13.404 130 HZ2 LYS 20 1HZ LYS 20 117.728 12.462 -12.523 131 HZ3 LYS 20 2HZ LYS 20 117.212 11.841 -14.018 132 H MET 21 H MET 21 113.685 10.450 -7.761 133 HA MET 21 HA MET 21 115.916 11.415 -6.048 134 HB2 MET 21 1HB MET 21 113.383 9.990 -5.198 135 HB3 MET 21 2HB MET 21 114.714 10.445 -4.135 136 HG2 MET 21 1HG MET 21 114.374 12.835 -4.845 137 HG3 MET 21 2HG MET 21 112.928 12.316 -5.708 138 HE1 MET 21 3HE MET 21 110.442 11.210 -3.382 139 HE2 MET 21 1HE MET 21 111.708 9.984 -3.237 140 HE3 MET 21 2HE MET 21 111.392 10.748 -4.792 141 H GLY 22 H GLY 22 116.942 9.615 -4.760 142 HA2 GLY 22 1HA GLY 22 116.882 7.053 -6.258 143 HA3 GLY 22 2HA GLY 22 118.409 7.851 -5.886 144 H GLY 23 H GLY 23 117.169 5.212 -4.992 145 HA2 GLY 23 1HA GLY 23 117.820 5.529 -2.161 146 HA3 GLY 23 2HA GLY 23 116.186 4.991 -2.529 147 H PHE 24 H PHE 24 117.750 3.413 -1.015 148 HA PHE 24 HA PHE 24 118.311 1.128 -2.815 149 HB2 PHE 24 1HB PHE 24 120.138 0.436 -1.381 150 HB3 PHE 24 2HB PHE 24 120.433 2.053 -1.990 151 HD1 PHE 24 HD1 PHE 24 120.298 4.006 -0.488 152 HD2 PHE 24 HD2 PHE 24 119.754 0.000 0.963 153 HE1 PHE 24 HE1 PHE 24 120.618 4.804 1.837 154 HE2 PHE 24 HE2 PHE 24 120.074 0.799 3.289 155 HZ PHE 24 HZ PHE 24 120.506 3.201 3.726 156 H ASN 25 H ASN 25 117.950 -0.960 -1.841 157 HA ASN 25 HA ASN 25 116.090 -0.886 0.464 158 HB2 ASN 25 1HB ASN 25 114.887 -0.967 -1.735 159 HB3 ASN 25 2HB ASN 25 115.683 -2.505 -2.055 160 HD21 ASN 25 1HD2 ASN 25 114.501 -4.292 -1.418 161 HD22 ASN 25 2HD2 ASN 25 113.326 -4.302 -0.195 162 H LEU 26 H LEU 26 116.275 -2.512 1.901 163 HA LEU 26 HA LEU 26 118.034 -4.800 1.228 164 HB2 LEU 26 1HB LEU 26 119.062 -3.207 2.868 165 HB3 LEU 26 2HB LEU 26 117.707 -3.520 3.953 166 HG LEU 26 HG LEU 26 118.304 -6.010 3.708 167 HD11 LEU 26 1HD1 LEU 26 120.726 -6.383 3.156 168 HD12 LEU 26 2HD1 LEU 26 120.814 -4.708 2.611 169 HD13 LEU 26 3HD1 LEU 26 119.767 -5.854 1.775 170 HD21 LEU 26 3HD2 LEU 26 120.183 -4.056 5.069 171 HD22 LEU 26 1HD2 LEU 26 120.161 -5.789 5.391 172 HD23 LEU 26 2HD2 LEU 26 118.747 -4.805 5.769 173 H LYS 27 H LYS 27 117.222 -6.823 1.720 174 HA LYS 27 HA LYS 27 114.490 -6.875 2.890 175 HB2 LYS 27 1HB LYS 27 115.587 -8.523 0.608 176 HB3 LYS 27 2HB LYS 27 113.986 -8.702 1.320 177 HG2 LYS 27 1HG LYS 27 113.492 -6.332 0.730 178 HG3 LYS 27 2HG LYS 27 115.059 -6.233 -0.074 179 HD2 LYS 27 1HD LYS 27 114.382 -8.139 -1.539 180 HD3 LYS 27 2HD LYS 27 112.784 -8.101 -0.797 181 HE2 LYS 27 1HE LYS 27 112.620 -5.674 -1.494 182 HE3 LYS 27 2HE LYS 27 114.100 -5.912 -2.423 183 HZ1 LYS 27 3HZ LYS 27 111.586 -7.458 -2.753 184 HZ2 LYS 27 1HZ LYS 27 113.007 -7.673 -3.656 185 HZ3 LYS 27 2HZ LYS 27 112.129 -6.223 -3.786 186 H TYR 28 H TYR 28 113.959 -8.533 4.222 187 HA TYR 28 HA TYR 28 115.956 -10.669 4.688 188 HB2 TYR 28 1HB TYR 28 115.874 -9.060 6.574 189 HB3 TYR 28 2HB TYR 28 114.157 -9.369 6.741 190 HD1 TYR 28 HD1 TYR 28 117.543 -10.819 7.104 191 HD2 TYR 28 HD2 TYR 28 113.343 -11.356 7.831 192 HE1 TYR 28 HE1 TYR 28 118.047 -12.722 8.611 193 HE2 TYR 28 HE2 TYR 28 113.848 -13.260 9.338 194 HH TYR 28 HH TYR 28 115.957 -13.942 10.792 195 H ARG 29 H ARG 29 115.142 -12.739 4.745 196 HA ARG 29 HA ARG 29 112.213 -13.074 4.589 197 HB2 ARG 29 1HB ARG 29 113.169 -13.012 2.288 198 HB3 ARG 29 2HB ARG 29 114.181 -14.394 2.707 199 HG2 ARG 29 1HG ARG 29 112.119 -15.686 3.264 200 HG3 ARG 29 2HG ARG 29 111.149 -14.319 2.710 201 HD2 ARG 29 1HD ARG 29 113.151 -15.845 1.020 202 HD3 ARG 29 2HD ARG 29 111.402 -16.023 0.935 203 HE ARG 29 HE ARG 29 112.306 -13.304 0.568 204 HH11 ARG 29 1HH1 ARG 29 111.666 -16.333 -1.088 205 HH12 ARG 29 2HH1 ARG 29 111.445 -15.563 -2.623 206 HH21 ARG 29 1HH2 ARG 29 112.009 -12.368 -1.435 207 HH22 ARG 29 2HH2 ARG 29 111.637 -13.345 -2.815 208 H TYR 30 H TYR 30 111.424 -14.887 5.547 209 HA TYR 30 HA TYR 30 113.377 -16.834 6.637 210 HB2 TYR 30 1HB TYR 30 112.479 -15.331 8.387 211 HB3 TYR 30 2HB TYR 30 110.854 -15.830 7.960 212 HD1 TYR 30 HD1 TYR 30 114.062 -16.915 9.449 213 HD2 TYR 30 HD2 TYR 30 109.962 -17.947 8.688 214 HE1 TYR 30 HE1 TYR 30 114.248 -18.820 11.026 215 HE2 TYR 30 HE2 TYR 30 110.148 -19.852 10.265 216 HH TYR 30 HH TYR 30 113.171 -20.466 12.054 217 H GLU 31 H GLU 31 112.891 -18.959 6.361 218 HA GLU 31 HA GLU 31 110.224 -19.661 5.307 219 HB2 GLU 31 1HB GLU 31 112.878 -20.525 4.140 220 HB3 GLU 31 2HB GLU 31 111.300 -21.141 3.644 221 HG2 GLU 31 1HG GLU 31 110.609 -18.821 3.067 222 HG3 GLU 31 2HG GLU 31 112.223 -18.259 3.480 223 H GLU 32 H GLU 32 109.506 -21.735 5.782 224 HA GLU 32 HA GLU 32 110.988 -23.110 7.919 225 HB2 GLU 32 1HB GLU 32 108.138 -23.435 6.952 226 HB3 GLU 32 2HB GLU 32 108.859 -24.311 8.302 227 HG2 GLU 32 1HG GLU 32 109.339 -22.137 9.416 228 HG3 GLU 32 2HG GLU 32 108.526 -21.306 8.097 229 H ASP 33 H ASP 33 111.482 -25.315 7.807 230 HA ASP 33 HA ASP 33 112.342 -26.153 5.233 231 HB2 ASP 33 1HB ASP 33 112.242 -27.631 7.865 232 HB3 ASP 33 2HB ASP 33 113.058 -28.217 6.419 233 H ASN 34 H ASN 34 109.693 -27.303 7.346 234 HA ASN 34 HA ASN 34 108.962 -29.246 5.243 235 HB2 ASN 34 1HB ASN 34 108.193 -29.105 8.158 236 HB3 ASN 34 2HB ASN 34 107.628 -30.330 7.025 237 HD21 ASN 34 1HD2 ASN 34 109.245 -30.907 9.384 238 HD22 ASN 34 2HD2 ASN 34 110.722 -31.540 8.834 239 H SER 35 H SER 35 107.874 -26.260 6.557 240 HA SER 35 HA SER 35 105.479 -26.457 4.891 241 HB2 SER 35 1HB SER 35 105.457 -26.046 7.869 242 HB3 SER 35 2HB SER 35 104.208 -25.319 6.863 243 HG SER 35 HG SER 35 103.846 -27.536 7.714 244 HA PRO 36 HA PRO 36 107.996 -22.576 4.888 245 HB2 PRO 36 1HB PRO 36 108.204 -22.179 2.204 246 HB3 PRO 36 2HB PRO 36 109.263 -23.285 3.102 247 HG2 PRO 36 1HG PRO 36 106.901 -23.891 1.404 248 HG3 PRO 36 2HG PRO 36 108.433 -24.768 1.569 249 HD2 PRO 36 1HD PRO 36 106.102 -25.540 2.810 250 HD3 PRO 36 2HD PRO 36 107.724 -25.937 3.417 251 H LEU 37 H LEU 37 107.169 -20.640 5.134 252 HA LEU 37 HA LEU 37 104.973 -19.720 3.382 253 HB2 LEU 37 1HB LEU 37 104.214 -20.087 5.745 254 HB3 LEU 37 2HB LEU 37 105.423 -18.915 6.271 255 HG LEU 37 HG LEU 37 104.357 -17.265 4.657 256 HD11 LEU 37 1HD1 LEU 37 102.442 -19.579 4.471 257 HD12 LEU 37 2HD1 LEU 37 103.083 -18.565 3.178 258 HD13 LEU 37 3HD1 LEU 37 101.853 -17.929 4.271 259 HD21 LEU 37 3HD2 LEU 37 103.953 -17.225 7.104 260 HD22 LEU 37 1HD2 LEU 37 102.614 -18.353 6.893 261 HD23 LEU 37 2HD2 LEU 37 102.519 -16.730 6.205 262 H GLY 38 H GLY 38 105.328 -17.647 2.453 263 HA2 GLY 38 1HA GLY 38 108.151 -16.861 2.644 264 HA3 GLY 38 2HA GLY 38 107.038 -16.433 1.348 265 H VAL 39 H VAL 39 108.630 -15.250 4.005 266 HA VAL 39 HA VAL 39 106.716 -12.986 4.221 267 HB VAL 39 HB VAL 39 108.645 -13.975 6.343 268 HG11 VAL 39 1HG1 VAL 39 108.282 -11.589 6.520 269 HG12 VAL 39 2HG1 VAL 39 107.310 -12.374 7.765 270 HG13 VAL 39 3HG1 VAL 39 106.546 -11.789 6.288 271 HG21 VAL 39 3HG2 VAL 39 105.617 -14.166 6.209 272 HG22 VAL 39 1HG2 VAL 39 106.633 -14.709 7.545 273 HG23 VAL 39 2HG2 VAL 39 106.727 -15.518 5.981 274 H ILE 40 H ILE 40 107.494 -11.084 3.608 275 HA ILE 40 HA ILE 40 110.438 -10.758 3.388 276 HB ILE 40 HB ILE 40 109.423 -11.063 1.169 277 HG12 ILE 40 1HG1 ILE 40 110.076 -8.132 1.551 278 HG13 ILE 40 2HG1 ILE 40 111.307 -9.394 1.589 279 HG21 ILE 40 1HG2 ILE 40 107.150 -10.261 1.793 280 HG22 ILE 40 2HG2 ILE 40 107.757 -9.502 0.322 281 HG23 ILE 40 3HG2 ILE 40 107.774 -8.612 1.846 282 HD11 ILE 40 3HD1 ILE 40 111.101 -9.859 -0.666 283 HD12 ILE 40 1HD1 ILE 40 110.689 -8.145 -0.680 284 HD13 ILE 40 2HD1 ILE 40 109.411 -9.357 -0.730 285 H GLY 41 H GLY 41 111.202 -9.102 4.496 286 HA2 GLY 41 1HA GLY 41 109.436 -6.771 5.003 287 HA3 GLY 41 2HA GLY 41 110.617 -7.347 6.182 288 H SER 42 H SER 42 110.231 -4.860 4.253 289 HA SER 42 HA SER 42 113.041 -4.820 3.302 290 HB2 SER 42 1HB SER 42 110.634 -3.698 1.856 291 HB3 SER 42 2HB SER 42 112.304 -3.626 1.312 292 HG SER 42 HG SER 42 111.667 -5.433 0.364 293 H PHE 43 H PHE 43 114.184 -3.048 3.753 294 HA PHE 43 HA PHE 43 112.762 -0.684 4.840 295 HB2 PHE 43 1HB PHE 43 115.619 -1.586 5.260 296 HB3 PHE 43 2HB PHE 43 114.912 -0.121 5.911 297 HD1 PHE 43 HD1 PHE 43 113.274 -0.223 7.748 298 HD2 PHE 43 HD2 PHE 43 115.130 -3.768 6.187 299 HE1 PHE 43 HE1 PHE 43 112.527 -1.493 9.743 300 HE2 PHE 43 HE2 PHE 43 114.383 -5.038 8.182 301 HZ PHE 43 HZ PHE 43 113.083 -3.900 9.961 302 H THR 44 H THR 44 112.836 1.119 3.589 303 HA THR 44 HA THR 44 114.880 1.206 1.432 304 HB THR 44 HB THR 44 112.660 0.718 0.519 305 HG1 THR 44 HG1 THR 44 113.796 1.950 -0.836 306 HG21 THR 44 3HG2 THR 44 111.841 3.325 1.832 307 HG22 THR 44 1HG2 THR 44 111.312 1.718 2.327 308 HG23 THR 44 2HG2 THR 44 110.838 2.356 0.754 309 H TYR 45 H TYR 45 116.004 3.012 1.196 310 HA TYR 45 HA TYR 45 115.166 5.427 2.697 311 HB2 TYR 45 1HB TYR 45 117.079 4.383 3.803 312 HB3 TYR 45 2HB TYR 45 117.961 4.352 2.288 313 HD1 TYR 45 HD1 TYR 45 116.398 6.647 4.777 314 HD2 TYR 45 HD2 TYR 45 119.284 6.193 1.631 315 HE1 TYR 45 HE1 TYR 45 117.302 8.902 5.283 316 HE2 TYR 45 HE2 TYR 45 120.187 8.448 2.133 317 HH TYR 45 HH TYR 45 118.912 10.376 4.842 318 H THR 46 H THR 46 114.880 7.132 1.451 319 HA THR 46 HA THR 46 116.140 7.198 -1.232 320 HB THR 46 HB THR 46 113.454 8.356 -0.445 321 HG1 THR 46 HG1 THR 46 113.591 6.022 -0.468 322 HG21 THR 46 3HG2 THR 46 113.310 8.253 -3.059 323 HG22 THR 46 1HG2 THR 46 115.071 8.208 -2.972 324 HG23 THR 46 2HG2 THR 46 114.189 9.577 -2.295 325 H GLU 47 H GLU 47 117.021 9.148 -1.900 326 HA GLU 47 HA GLU 47 116.975 11.386 0.004 327 HB2 GLU 47 1HB GLU 47 118.885 9.855 0.575 328 HB3 GLU 47 2HB GLU 47 119.545 10.170 -1.028 329 HG2 GLU 47 1HG GLU 47 119.593 12.599 -0.507 330 HG3 GLU 47 2HG GLU 47 119.000 12.248 1.111 331 H LYS 48 H LYS 48 117.464 13.378 -0.905 332 HA LYS 48 HA LYS 48 118.161 13.452 -3.766 333 HB2 LYS 48 1HB LYS 48 115.703 13.774 -3.525 334 HB3 LYS 48 2HB LYS 48 116.013 15.156 -2.476 335 HG2 LYS 48 1HG LYS 48 115.659 16.088 -4.631 336 HG3 LYS 48 2HG LYS 48 117.405 16.116 -4.413 337 HD2 LYS 48 1HD LYS 48 117.607 14.021 -5.701 338 HD3 LYS 48 2HD LYS 48 115.857 13.978 -5.903 339 HE2 LYS 48 1HE LYS 48 116.430 15.011 -7.883 340 HE3 LYS 48 2HE LYS 48 116.289 16.442 -6.865 341 HZ1 LYS 48 3HZ LYS 48 118.353 16.485 -8.077 342 HZ2 LYS 48 1HZ LYS 48 118.788 14.959 -7.476 343 HZ3 LYS 48 2HZ LYS 48 118.676 16.286 -6.421 344 H SER 49 H SER 49 119.794 14.820 -4.166 345 HA SER 49 HA SER 49 120.397 16.926 -2.161 346 HB2 SER 49 1HB SER 49 122.336 15.383 -3.904 347 HB3 SER 49 2HB SER 49 122.759 16.668 -2.777 348 HG SER 49 HG SER 49 121.690 15.301 -1.154 349 H ARG 50 H ARG 50 120.720 18.960 -2.891 350 HA ARG 50 HA ARG 50 120.907 19.418 -5.797 351 HB2 ARG 50 1HB ARG 50 119.053 20.942 -3.950 352 HB3 ARG 50 2HB ARG 50 119.257 21.206 -5.679 353 HG2 ARG 50 1HG ARG 50 118.320 18.578 -4.503 354 HG3 ARG 50 2HG ARG 50 117.218 19.843 -5.042 355 HD2 ARG 50 1HD ARG 50 119.309 18.497 -6.781 356 HD3 ARG 50 2HD ARG 50 117.589 18.134 -6.796 357 HE ARG 50 HE ARG 50 117.558 20.767 -7.270 358 HH11 ARG 50 1HH1 ARG 50 119.541 18.258 -8.716 359 HH12 ARG 50 2HH1 ARG 50 119.690 19.104 -10.220 360 HH21 ARG 50 1HH2 ARG 50 117.785 21.809 -9.229 361 HH22 ARG 50 2HH2 ARG 50 118.709 21.090 -10.505 362 H THR 51 H THR 51 122.110 21.210 -6.383 363 HA THR 51 HA THR 51 123.302 22.791 -4.174 364 HB THR 51 HB THR 51 125.401 22.852 -5.417 365 HG1 THR 51 HG1 THR 51 124.968 22.626 -7.490 366 HG21 THR 51 3HG2 THR 51 124.438 19.988 -5.226 367 HG22 THR 51 1HG2 THR 51 124.899 20.958 -3.827 368 HG23 THR 51 2HG2 THR 51 126.095 20.571 -5.065 369 H ALA 52 H ALA 52 123.471 24.957 -4.486 370 HA ALA 52 HA ALA 52 122.643 26.056 -7.106 371 HB1 ALA 52 1HB ALA 52 121.911 27.427 -4.540 372 HB2 ALA 52 2HB ALA 52 120.896 26.124 -5.157 373 HB3 ALA 52 3HB ALA 52 121.166 27.569 -6.132 374 H SER 53 H SER 53 123.509 28.155 -7.586 375 HA SER 53 HA SER 53 126.188 28.562 -6.872 376 HB2 SER 53 1HB SER 53 124.230 30.655 -7.848 377 HB3 SER 53 2HB SER 53 125.986 30.730 -7.950 378 HG SER 53 HG SER 53 124.423 28.645 -9.076 379 H SER 54 H SER 54 123.215 30.009 -5.584 380 HA SER 54 HA SER 54 124.469 31.726 -3.704 381 HB2 SER 54 1HB SER 54 122.277 31.920 -2.699 382 HB3 SER 54 2HB SER 54 122.098 31.910 -4.451 383 HG SER 54 HG SER 54 121.622 29.665 -4.281 384 H GLY 55 H GLY 55 123.640 28.309 -3.616 385 HA2 GLY 55 1HA GLY 55 124.697 26.778 -2.133 386 HA3 GLY 55 2HA GLY 55 124.969 28.096 -1.005 387 H ASP 56 H ASP 56 121.807 28.421 -2.006 388 HA ASP 56 HA ASP 56 120.812 27.248 0.463 389 HB2 ASP 56 1HB ASP 56 120.044 29.478 -0.308 390 HB3 ASP 56 2HB ASP 56 119.329 28.720 -1.727 391 H TYR 57 H TYR 57 120.179 25.197 0.563 392 HA TYR 57 HA TYR 57 118.759 24.025 -1.735 393 HB2 TYR 57 1HB TYR 57 120.032 22.000 -1.631 394 HB3 TYR 57 2HB TYR 57 121.139 23.343 -1.827 395 HD1 TYR 57 HD1 TYR 57 122.555 24.084 0.083 396 HD2 TYR 57 HD2 TYR 57 120.042 20.608 0.324 397 HE1 TYR 57 HE1 TYR 57 123.811 23.315 2.078 398 HE2 TYR 57 HE2 TYR 57 121.299 19.839 2.319 399 HH TYR 57 HH TYR 57 124.224 21.457 3.385 400 H ASN 58 H ASN 58 117.324 22.331 -1.209 401 HA ASN 58 HA ASN 58 116.509 22.312 1.632 402 HB2 ASN 58 1HB ASN 58 114.839 23.086 -0.051 403 HB3 ASN 58 2HB ASN 58 114.918 21.497 -0.810 404 HD21 ASN 58 1HD2 ASN 58 114.180 23.060 2.346 405 HD22 ASN 58 2HD2 ASN 58 113.085 21.863 2.846 406 H LYS 59 H LYS 59 117.130 20.578 2.748 407 HA LYS 59 HA LYS 59 117.774 18.094 1.338 408 HB2 LYS 59 1HB LYS 59 119.342 19.052 3.035 409 HB3 LYS 59 2HB LYS 59 118.113 18.768 4.268 410 HG2 LYS 59 1HG LYS 59 118.107 16.354 3.672 411 HG3 LYS 59 2HG LYS 59 119.405 16.658 2.517 412 HD2 LYS 59 1HD LYS 59 120.788 17.574 4.398 413 HD3 LYS 59 2HD LYS 59 119.518 17.075 5.517 414 HE2 LYS 59 1HE LYS 59 120.942 15.229 5.584 415 HE3 LYS 59 2HE LYS 59 119.789 14.741 4.342 416 HZ1 LYS 59 3HZ LYS 59 122.578 15.229 4.108 417 HZ2 LYS 59 1HZ LYS 59 121.707 16.206 3.028 418 HZ3 LYS 59 2HZ LYS 59 121.513 14.518 2.991 419 H ASN 60 H ASN 60 116.354 16.495 1.183 420 HA ASN 60 HA ASN 60 114.297 16.186 3.293 421 HB2 ASN 60 1HB ASN 60 113.953 15.834 0.307 422 HB3 ASN 60 2HB ASN 60 112.745 15.413 1.519 423 HD21 ASN 60 1HD2 ASN 60 112.267 17.391 -0.525 424 HD22 ASN 60 2HD2 ASN 60 112.095 18.897 0.241 425 H GLN 61 H GLN 61 113.982 14.140 4.039 426 HA GLN 61 HA GLN 61 115.331 11.919 2.607 427 HB2 GLN 61 1HB GLN 61 115.329 12.444 5.590 428 HB3 GLN 61 2HB GLN 61 115.901 10.956 4.834 429 HG2 GLN 61 1HG GLN 61 117.591 12.202 3.582 430 HG3 GLN 61 2HG GLN 61 116.991 13.722 4.239 431 HE21 GLN 61 1HE2 GLN 61 119.709 12.815 4.623 432 HE22 GLN 61 2HE2 GLN 61 119.925 12.522 6.279 433 H TYR 62 H TYR 62 114.241 9.983 2.582 434 HA TYR 62 HA TYR 62 111.622 9.882 3.969 435 HB2 TYR 62 1HB TYR 62 112.228 8.909 1.175 436 HB3 TYR 62 2HB TYR 62 110.690 8.770 2.005 437 HD1 TYR 62 HD2 TYR 62 109.240 10.719 2.304 438 HD2 TYR 62 HD1 TYR 62 113.015 11.032 0.279 439 HE1 TYR 62 HE2 TYR 62 108.578 12.936 1.412 440 HE2 TYR 62 HE1 TYR 62 112.353 13.248 -0.614 441 HH TYR 62 HH TYR 62 110.778 15.079 -0.002 442 H TYR 63 H TYR 63 111.109 7.987 4.943 443 HA TYR 63 HA TYR 63 112.842 5.633 4.443 444 HB2 TYR 63 1HB TYR 63 111.703 6.493 7.108 445 HB3 TYR 63 2HB TYR 63 112.676 5.067 6.813 446 HD1 TYR 63 HD1 TYR 63 112.712 8.783 6.849 447 HD2 TYR 63 HD2 TYR 63 115.056 5.184 6.810 448 HE1 TYR 63 HE1 TYR 63 114.750 10.107 7.342 449 HE2 TYR 63 HE2 TYR 63 117.096 6.509 7.300 450 HH TYR 63 HH TYR 63 117.872 8.523 7.924 451 H GLY 64 H GLY 64 111.711 3.695 4.197 452 HA2 GLY 64 1HA GLY 64 108.806 3.749 4.788 453 HA3 GLY 64 2HA GLY 64 109.381 3.252 3.202 454 H ILE 65 H ILE 65 107.989 1.916 5.628 455 HA ILE 65 HA ILE 65 109.730 -0.483 5.704 456 HB ILE 65 HB ILE 65 109.458 0.548 7.923 457 HG12 ILE 65 1HG1 ILE 65 108.478 -1.447 9.085 458 HG13 ILE 65 2HG1 ILE 65 107.940 -2.045 7.516 459 HG21 ILE 65 1HG2 ILE 65 106.498 -0.003 7.601 460 HG22 ILE 65 2HG2 ILE 65 107.222 1.592 7.392 461 HG23 ILE 65 3HG2 ILE 65 107.297 0.788 8.960 462 HD11 ILE 65 3HD1 ILE 65 110.820 -1.284 7.871 463 HD12 ILE 65 1HD1 ILE 65 110.106 -2.472 6.780 464 HD13 ILE 65 2HD1 ILE 65 110.258 -2.832 8.500 465 H THR 66 H THR 66 108.892 -2.295 4.798 466 HA THR 66 HA THR 66 105.972 -2.386 4.298 467 HB THR 66 HB THR 66 106.363 -3.340 2.108 468 HG1 THR 66 HG1 THR 66 109.028 -3.244 2.978 469 HG21 THR 66 3HG2 THR 66 106.235 -0.965 2.013 470 HG22 THR 66 1HG2 THR 66 107.623 -1.404 1.023 471 HG23 THR 66 2HG2 THR 66 107.867 -0.772 2.649 472 H ALA 67 H ALA 67 105.089 -4.518 4.062 473 HA ALA 67 HA ALA 67 106.786 -6.814 4.590 474 HB1 ALA 67 1HB ALA 67 105.784 -7.508 6.609 475 HB2 ALA 67 2HB ALA 67 104.454 -6.362 6.442 476 HB3 ALA 67 3HB ALA 67 106.071 -5.784 6.845 477 H GLY 68 H GLY 68 105.792 -8.799 3.909 478 HA2 GLY 68 1HA GLY 68 102.969 -8.965 3.478 479 HA3 GLY 68 2HA GLY 68 103.804 -8.656 1.972 480 HA PRO 69 HA PRO 69 103.927 -13.305 3.025 481 HB2 PRO 69 1HB PRO 69 101.730 -14.266 1.772 482 HB3 PRO 69 2HB PRO 69 101.702 -13.716 3.460 483 HG2 PRO 69 1HG PRO 69 100.789 -12.314 1.002 484 HG3 PRO 69 2HG PRO 69 100.049 -12.373 2.611 485 HD2 PRO 69 1HD PRO 69 101.552 -10.254 1.718 486 HD3 PRO 69 2HD PRO 69 101.366 -10.678 3.432 487 H ALA 70 H ALA 70 104.315 -15.068 1.425 488 HA ALA 70 HA ALA 70 104.474 -14.148 -1.371 489 HB1 ALA 70 1HB ALA 70 106.710 -14.331 -1.504 490 HB2 ALA 70 2HB ALA 70 106.731 -15.865 -0.643 491 HB3 ALA 70 3HB ALA 70 106.719 -14.348 0.256 492 H TYR 71 H TYR 71 104.554 -15.913 -2.925 493 HA TYR 71 HA TYR 71 103.346 -18.403 -1.869 494 HB2 TYR 71 1HB TYR 71 102.653 -16.917 -4.407 495 HB3 TYR 71 2HB TYR 71 102.007 -18.478 -3.941 496 HD1 TYR 71 HD2 TYR 71 100.359 -18.676 -2.145 497 HD2 TYR 71 HD1 TYR 71 101.957 -14.859 -3.301 498 HE1 TYR 71 HE2 TYR 71 98.547 -17.537 -0.892 499 HE2 TYR 71 HE1 TYR 71 100.144 -13.721 -2.049 500 HH TYR 71 HH TYR 71 97.739 -15.589 -0.195 501 H ARG 72 H ARG 72 104.347 -20.228 -2.465 502 HA ARG 72 HA ARG 72 106.398 -20.080 -4.583 503 HB2 ARG 72 1HB ARG 72 105.951 -22.258 -2.525 504 HB3 ARG 72 2HB ARG 72 107.328 -22.100 -3.610 505 HG2 ARG 72 1HG ARG 72 106.589 -20.018 -1.538 506 HG3 ARG 72 2HG ARG 72 107.754 -21.308 -1.246 507 HD2 ARG 72 1HD ARG 72 107.974 -19.266 -3.477 508 HD3 ARG 72 2HD ARG 72 108.832 -19.173 -1.945 509 HE ARG 72 HE ARG 72 109.210 -21.629 -3.470 510 HH11 ARG 72 1HH1 ARG 72 110.492 -18.460 -2.672 511 HH12 ARG 72 2HH1 ARG 72 112.095 -18.872 -3.180 512 HH21 ARG 72 1HH2 ARG 72 111.292 -22.101 -4.108 513 HH22 ARG 72 2HH2 ARG 72 112.541 -20.908 -3.984 514 H ILE 73 H ILE 73 106.098 -21.104 -6.474 515 HA ILE 73 HA ILE 73 103.866 -23.051 -6.676 516 HB ILE 73 HB ILE 73 104.812 -21.146 -8.827 517 HG12 ILE 73 1HG1 ILE 73 103.719 -19.874 -7.050 518 HG13 ILE 73 2HG1 ILE 73 102.657 -19.973 -8.447 519 HG21 ILE 73 1HG2 ILE 73 102.751 -21.877 -9.974 520 HG22 ILE 73 2HG2 ILE 73 102.414 -22.990 -8.649 521 HG23 ILE 73 3HG2 ILE 73 103.833 -23.236 -9.666 522 HD11 ILE 73 3HD1 ILE 73 101.067 -20.697 -7.016 523 HD12 ILE 73 1HD1 ILE 73 102.240 -20.951 -5.729 524 HD13 ILE 73 2HD1 ILE 73 101.954 -22.216 -6.921 525 H ASN 74 H ASN 74 104.615 -25.020 -7.021 526 HA ASN 74 HA ASN 74 105.898 -26.771 -7.763 527 HB2 ASN 74 1HB ASN 74 106.331 -24.930 -10.123 528 HB3 ASN 74 2HB ASN 74 106.551 -26.678 -10.111 529 HD21 ASN 74 1HD2 ASN 74 104.260 -27.508 -8.685 530 HD22 ASN 74 2HD2 ASN 74 102.873 -27.082 -9.565 531 H ASP 75 H ASP 75 107.262 -24.762 -6.112 532 HA ASP 75 HA ASP 75 109.372 -24.105 -5.466 533 HB2 ASP 75 1HB ASP 75 109.276 -26.584 -5.070 534 HB3 ASP 75 2HB ASP 75 110.130 -26.798 -6.595 535 H TRP 76 H TRP 76 108.692 -23.445 -8.327 536 HA TRP 76 HA TRP 76 111.367 -23.520 -9.553 537 HB2 TRP 76 1HB TRP 76 109.429 -24.264 -10.902 538 HB3 TRP 76 2HB TRP 76 108.715 -22.673 -10.724 539 HD1 TRP 76 HD1 TRP 76 109.373 -20.901 -12.447 540 HE1 TRP 76 HE1 TRP 76 111.070 -20.787 -14.383 541 HE3 TRP 76 HE3 TRP 76 111.965 -25.218 -11.601 542 HZ2 TRP 76 HZ2 TRP 76 113.245 -22.327 -15.436 543 HZ3 TRP 76 HZ3 TRP 76 113.840 -25.870 -13.081 544 HH2 TRP 76 HH2 TRP 76 114.484 -24.434 -14.995 545 H ALA 77 H ALA 77 108.700 -21.191 -9.106 546 HA ALA 77 HA ALA 77 110.699 -19.086 -8.591 547 HB1 ALA 77 1HB ALA 77 109.042 -17.578 -9.934 548 HB2 ALA 77 2HB ALA 77 108.536 -19.096 -10.674 549 HB3 ALA 77 3HB ALA 77 110.211 -18.563 -10.812 550 H SER 78 H SER 78 109.824 -17.242 -7.442 551 HA SER 78 HA SER 78 107.370 -17.887 -5.905 552 HB2 SER 78 1HB SER 78 109.445 -18.235 -4.568 553 HB3 SER 78 2HB SER 78 109.877 -16.553 -4.855 554 HG SER 78 HG SER 78 108.546 -16.038 -3.316 555 H ILE 79 H ILE 79 106.007 -16.180 -5.429 556 HA ILE 79 HA ILE 79 106.757 -13.533 -6.550 557 HB ILE 79 HB ILE 79 104.013 -14.826 -6.630 558 HG12 ILE 79 1HG1 ILE 79 105.908 -14.198 -8.914 559 HG13 ILE 79 2HG1 ILE 79 105.714 -15.806 -8.215 560 HG21 ILE 79 1HG2 ILE 79 105.070 -12.209 -7.745 561 HG22 ILE 79 2HG2 ILE 79 103.930 -12.383 -6.410 562 HG23 ILE 79 3HG2 ILE 79 103.456 -12.856 -8.041 563 HD11 ILE 79 3HD1 ILE 79 103.204 -15.530 -8.686 564 HD12 ILE 79 1HD1 ILE 79 104.249 -15.777 -10.084 565 HD13 ILE 79 2HD1 ILE 79 103.662 -14.160 -9.698 566 H TYR 80 H TYR 80 105.891 -11.727 -5.379 567 HA TYR 80 HA TYR 80 104.533 -12.343 -2.854 568 HB2 TYR 80 1HB TYR 80 106.155 -11.254 -1.486 569 HB3 TYR 80 2HB TYR 80 106.979 -12.473 -2.434 570 HD1 TYR 80 HD1 TYR 80 108.450 -11.798 -4.333 571 HD2 TYR 80 HD2 TYR 80 106.645 -8.922 -1.704 572 HE1 TYR 80 HE1 TYR 80 110.045 -10.073 -5.126 573 HE2 TYR 80 HE2 TYR 80 108.240 -7.195 -2.496 574 HH TYR 80 HH TYR 80 110.262 -7.689 -5.245 575 H GLY 81 H GLY 81 103.590 -10.535 -1.823 576 HA2 GLY 81 1HA GLY 81 103.674 -7.981 -3.319 577 HA3 GLY 81 2HA GLY 81 102.114 -8.678 -2.875 578 H VAL 82 H VAL 82 103.424 -6.142 -1.974 579 HA VAL 82 HA VAL 82 103.315 -6.648 0.922 580 HB VAL 82 HB VAL 82 105.350 -5.292 1.275 581 HG11 VAL 82 1HG1 VAL 82 106.959 -7.013 0.472 582 HG12 VAL 82 2HG1 VAL 82 105.684 -7.705 -0.529 583 HG13 VAL 82 3HG1 VAL 82 105.537 -7.731 1.228 584 HG21 VAL 82 3HG2 VAL 82 105.361 -3.971 -0.760 585 HG22 VAL 82 1HG2 VAL 82 105.487 -5.424 -1.752 586 HG23 VAL 82 2HG2 VAL 82 106.836 -4.937 -0.727 587 H VAL 83 H VAL 83 102.956 -4.817 2.202 588 HA VAL 83 HA VAL 83 102.305 -2.298 0.809 589 HB VAL 83 HB VAL 83 100.390 -1.984 2.360 590 HG11 VAL 83 1HG1 VAL 83 100.123 -3.008 0.074 591 HG12 VAL 83 2HG1 VAL 83 98.872 -3.487 1.222 592 HG13 VAL 83 3HG1 VAL 83 100.188 -4.597 0.837 593 HG21 VAL 83 3HG2 VAL 83 99.577 -3.906 3.666 594 HG22 VAL 83 1HG2 VAL 83 101.215 -3.479 4.162 595 HG23 VAL 83 2HG2 VAL 83 100.946 -4.873 3.114 596 H GLY 84 H GLY 84 102.640 -0.393 2.199 597 HA2 GLY 84 1HA GLY 84 103.781 -0.763 4.824 598 HA3 GLY 84 2HA GLY 84 104.986 -0.397 3.599 599 H VAL 85 H VAL 85 105.153 1.401 5.289 600 HA VAL 85 HA VAL 85 103.478 3.684 4.429 601 HB VAL 85 HB VAL 85 104.358 3.128 7.277 602 HG11 VAL 85 1HG1 VAL 85 102.526 5.267 6.150 603 HG12 VAL 85 2HG1 VAL 85 104.210 5.536 6.602 604 HG13 VAL 85 3HG1 VAL 85 103.026 5.090 7.831 605 HG21 VAL 85 3HG2 VAL 85 101.564 3.095 6.097 606 HG22 VAL 85 1HG2 VAL 85 102.024 2.684 7.750 607 HG23 VAL 85 2HG2 VAL 85 102.510 1.641 6.414 608 H GLY 86 H GLY 86 104.596 5.560 4.088 609 HA2 GLY 86 1HA GLY 86 107.495 5.542 4.719 610 HA3 GLY 86 2HA GLY 86 106.895 6.045 3.141 611 H TYR 87 H TYR 87 108.325 7.457 5.466 612 HA TYR 87 HA TYR 87 106.512 9.793 5.531 613 HB2 TYR 87 1HB TYR 87 107.131 10.288 7.785 614 HB3 TYR 87 2HB TYR 87 106.531 8.644 7.723 615 HD1 TYR 87 HD1 TYR 87 108.028 6.744 8.093 616 HD2 TYR 87 HD2 TYR 87 109.469 10.788 8.247 617 HE1 TYR 87 HE1 TYR 87 110.104 5.962 9.202 618 HE2 TYR 87 HE2 TYR 87 111.545 10.006 9.355 619 HH TYR 87 HH TYR 87 112.521 6.838 9.403 620 H GLY 88 H GLY 88 107.481 11.794 5.413 621 HA2 GLY 88 1HA GLY 88 110.363 11.819 4.743 622 HA3 GLY 88 2HA GLY 88 109.174 12.663 3.759 623 H LYS 89 H LYS 89 111.518 13.572 5.376 624 HA LYS 89 HA LYS 89 110.123 15.707 6.871 625 HB2 LYS 89 1HB LYS 89 112.635 14.236 7.713 626 HB3 LYS 89 2HB LYS 89 111.991 15.672 8.510 627 HG2 LYS 89 1HG LYS 89 109.933 14.504 9.069 628 HG3 LYS 89 2HG LYS 89 110.449 13.088 8.155 629 HD2 LYS 89 1HD LYS 89 110.894 12.638 10.480 630 HD3 LYS 89 2HD LYS 89 112.446 12.928 9.694 631 HE2 LYS 89 1HE LYS 89 112.259 14.129 11.863 632 HE3 LYS 89 2HE LYS 89 112.462 15.237 10.507 633 HZ1 LYS 89 3HZ LYS 89 109.776 14.487 11.473 634 HZ2 LYS 89 1HZ LYS 89 110.237 15.846 10.571 635 HZ3 LYS 89 2HZ LYS 89 110.651 15.739 12.215 636 H PHE 90 H PHE 90 110.954 17.745 6.601 637 HA PHE 90 HA PHE 90 113.279 18.022 4.781 638 HB2 PHE 90 1HB PHE 90 112.179 19.924 3.757 639 HB3 PHE 90 2HB PHE 90 111.170 18.496 3.618 640 HD1 PHE 90 HD1 PHE 90 109.128 18.266 5.024 641 HD2 PHE 90 HD2 PHE 90 111.498 21.848 5.017 642 HE1 PHE 90 HE1 PHE 90 107.257 19.506 6.079 643 HE2 PHE 90 HE2 PHE 90 109.628 23.087 6.074 644 HZ PHE 90 HZ PHE 90 107.507 21.916 6.604 645 H GLN 91 H GLN 91 114.491 19.995 5.018 646 HA GLN 91 HA GLN 91 114.608 20.832 7.818 647 HB2 GLN 91 1HB GLN 91 116.481 21.443 5.519 648 HB3 GLN 91 2HB GLN 91 116.774 21.798 7.219 649 HG2 GLN 91 1HG GLN 91 116.412 19.037 6.020 650 HG3 GLN 91 2HG GLN 91 117.936 19.737 6.553 651 HE21 GLN 91 1HE2 GLN 91 115.891 17.454 7.545 652 HE22 GLN 91 2HE2 GLN 91 115.928 17.685 9.226 653 H THR 92 H THR 92 113.675 22.626 8.489 654 HA THR 92 HA THR 92 113.630 24.994 6.767 655 HB THR 92 HB THR 92 111.485 23.898 6.335 656 HG1 THR 92 HG1 THR 92 110.435 25.722 6.538 657 HG21 THR 92 3HG2 THR 92 109.864 23.740 8.288 658 HG22 THR 92 1HG2 THR 92 111.254 23.954 9.351 659 HG23 THR 92 2HG2 THR 92 111.169 22.555 8.283 660 H THR 93 H THR 93 112.792 26.936 8.070 661 HA THR 93 HA THR 93 113.945 26.785 10.776 662 HB THR 93 HB THR 93 113.982 29.238 10.678 663 HG1 THR 93 HG1 THR 93 112.133 29.525 9.404 664 HG21 THR 93 3HG2 THR 93 115.525 29.464 8.696 665 HG22 THR 93 1HG2 THR 93 115.085 27.818 8.240 666 HG23 THR 93 2HG2 THR 93 115.916 28.118 9.767 667 H GLU 94 H GLU 94 112.686 26.823 12.527 668 HA GLU 94 HA GLU 94 109.942 27.810 12.382 669 HB2 GLU 94 1HB GLU 94 110.598 24.922 12.999 670 HB3 GLU 94 2HB GLU 94 109.027 25.673 13.269 671 HG2 GLU 94 1HG GLU 94 110.427 25.432 10.589 672 HG3 GLU 94 2HG GLU 94 109.078 24.448 11.132 673 H TYR 95 H TYR 95 109.038 28.288 14.366 674 HA TYR 95 HA TYR 95 110.794 28.392 16.669 675 HB2 TYR 95 1HB TYR 95 108.863 29.400 17.801 676 HB3 TYR 95 2HB TYR 95 109.188 30.197 16.273 677 HD1 TYR 95 HD1 TYR 95 107.651 29.959 14.377 678 HD2 TYR 95 HD2 TYR 95 106.866 28.057 18.147 679 HE1 TYR 95 HE1 TYR 95 105.304 29.555 13.684 680 HE2 TYR 95 HE2 TYR 95 104.519 27.652 17.454 681 HH TYR 95 HH TYR 95 102.989 29.191 15.167 682 HA PRO 96 HA PRO 96 110.337 24.456 18.039 683 HB2 PRO 96 1HB PRO 96 109.717 24.614 20.765 684 HB3 PRO 96 2HB PRO 96 111.339 24.750 20.062 685 HG2 PRO 96 1HG PRO 96 109.492 26.880 20.973 686 HG3 PRO 96 2HG PRO 96 111.261 26.798 21.053 687 HD2 PRO 96 1HD PRO 96 109.990 28.333 19.220 688 HD3 PRO 96 2HD PRO 96 111.538 27.532 18.864 689 H THR 97 H THR 97 108.913 22.882 17.902 690 HA THR 97 HA THR 97 106.060 23.469 18.393 691 HB THR 97 HB THR 97 106.587 23.365 15.999 692 HG1 THR 97 HG1 THR 97 104.600 22.601 16.511 693 HG21 THR 97 3HG2 THR 97 107.413 21.294 14.992 694 HG22 THR 97 1HG2 THR 97 107.505 20.536 16.582 695 HG23 THR 97 2HG2 THR 97 108.571 21.883 16.185 696 H TYR 98 H TYR 98 104.720 21.679 19.007 697 HA TYR 98 HA TYR 98 106.183 19.542 20.401 698 HB2 TYR 98 1HB TYR 98 104.396 20.772 21.612 699 HB3 TYR 98 2HB TYR 98 103.236 20.225 20.415 700 HD1 TYR 98 HD1 TYR 98 105.449 19.176 23.188 701 HD2 TYR 98 HD2 TYR 98 102.353 17.982 20.460 702 HE1 TYR 98 HE1 TYR 98 105.080 17.111 24.511 703 HE2 TYR 98 HE2 TYR 98 101.985 15.916 21.784 704 HH TYR 98 HH TYR 98 103.080 15.489 24.865 705 H LYS 99 H LYS 99 106.252 17.510 19.617 706 HA LYS 99 HA LYS 99 105.485 17.200 16.862 707 HB2 LYS 99 1HB LYS 99 106.807 15.254 18.763 708 HB3 LYS 99 2HB LYS 99 106.673 15.054 17.015 709 HG2 LYS 99 1HG LYS 99 107.873 17.275 16.772 710 HG3 LYS 99 2HG LYS 99 108.190 17.209 18.506 711 HD2 LYS 99 1HD LYS 99 109.004 15.059 16.528 712 HD3 LYS 99 2HD LYS 99 110.083 16.309 17.149 713 HE2 LYS 99 1HE LYS 99 108.638 14.223 18.811 714 HE3 LYS 99 2HE LYS 99 110.362 14.240 18.440 715 HZ1 LYS 99 3HZ LYS 99 110.389 15.283 20.440 716 HZ2 LYS 99 1HZ LYS 99 108.834 15.938 20.264 717 HZ3 LYS 99 2HZ LYS 99 110.148 16.643 19.450 718 H HIS 100 H HIS 100 104.020 15.869 15.961 719 HA HIS 100 HA HIS 100 102.704 13.757 17.356 720 HB2 HIS 100 1HB HIS 100 100.410 14.716 17.196 721 HB3 HIS 100 2HB HIS 100 101.425 15.483 18.399 722 HD1 HIS 100 HD1 HIS 100 98.913 16.482 16.331 723 HD2 HIS 100 HD2 HIS 100 102.845 17.825 16.648 724 HE1 HIS 100 HE1 HIS 100 98.947 18.822 15.370 725 H ASP 101 H ASP 101 102.289 16.097 14.700 726 HA ASP 101 HA ASP 101 102.278 13.878 12.788 727 HB2 ASP 101 1HB ASP 101 100.068 15.928 13.022 728 HB3 ASP 101 2HB ASP 101 100.297 14.885 11.621 729 H THR 102 H THR 102 104.231 15.949 13.407 730 HA THR 102 HA THR 102 104.033 18.142 11.619 731 HB THR 102 HB THR 102 106.407 18.499 12.115 732 HG1 THR 102 HG1 THR 102 107.354 16.586 12.204 733 HG21 THR 102 3HG2 THR 102 106.215 18.659 14.564 734 HG22 THR 102 1HG2 THR 102 104.825 17.574 14.531 735 HG23 THR 102 2HG2 THR 102 104.717 19.169 13.784 736 H SER 103 H SER 103 105.470 14.924 11.317 737 HA SER 103 HA SER 103 106.706 15.508 8.774 738 HB2 SER 103 1HB SER 103 107.397 13.217 8.784 739 HB3 SER 103 2HB SER 103 107.536 13.794 10.441 740 HG SER 103 HG SER 103 106.427 11.926 10.614 741 H ASP 104 H ASP 104 106.171 14.342 6.786 742 HA ASP 104 HA ASP 104 103.242 14.034 6.484 743 HB2 ASP 104 1HB ASP 104 105.386 14.454 4.384 744 HB3 ASP 104 2HB ASP 104 103.652 14.351 4.080 745 H TYR 105 H TYR 105 102.377 12.126 5.624 746 HA TYR 105 HA TYR 105 104.282 9.940 5.071 747 HB2 TYR 105 1HB TYR 105 103.117 8.424 6.502 748 HB3 TYR 105 2HB TYR 105 103.559 9.836 7.439 749 HD1 TYR 105 HD1 TYR 105 101.818 11.474 8.129 750 HD2 TYR 105 HD2 TYR 105 100.828 7.819 6.101 751 HE1 TYR 105 HE1 TYR 105 99.451 11.728 8.825 752 HE2 TYR 105 HE2 TYR 105 98.462 8.073 6.796 753 HH TYR 105 HH TYR 105 97.191 10.933 7.977 754 H GLY 106 H GLY 106 103.377 8.129 3.946 755 HA2 GLY 106 1HA GLY 106 100.723 8.423 2.762 756 HA3 GLY 106 2HA GLY 106 102.084 8.462 1.645 757 H PHE 107 H PHE 107 100.487 6.500 1.078 758 HA PHE 107 HA PHE 107 101.419 4.077 2.523 759 HB2 PHE 107 1HB PHE 107 98.836 4.538 1.026 760 HB3 PHE 107 2HB PHE 107 99.327 3.017 1.746 761 HD1 PHE 107 HD1 PHE 107 99.468 2.794 4.223 762 HD2 PHE 107 HD2 PHE 107 97.945 6.338 2.334 763 HE1 PHE 107 HE1 PHE 107 98.444 3.498 6.370 764 HE2 PHE 107 HE2 PHE 107 96.921 7.042 4.481 765 HZ PHE 107 HZ PHE 107 97.171 5.623 6.499 766 H SER 108 H SER 108 102.187 2.334 1.318 767 HA SER 108 HA SER 108 102.277 2.689 -1.619 768 HB2 SER 108 1HB SER 108 104.620 2.076 -1.664 769 HB3 SER 108 2HB SER 108 104.416 3.460 -0.595 770 HG SER 108 HG SER 108 105.512 2.136 0.680 771 H TYR 109 H TYR 109 102.375 0.784 -2.821 772 HA TYR 109 HA TYR 109 102.686 -1.768 -1.486 773 HB2 TYR 109 1HB TYR 109 100.561 -2.687 -2.062 774 HB3 TYR 109 2HB TYR 109 100.286 -1.212 -1.158 775 HD1 TYR 109 HD1 TYR 109 99.475 0.836 -2.329 776 HD2 TYR 109 HD2 TYR 109 99.858 -2.942 -4.337 777 HE1 TYR 109 HE1 TYR 109 98.017 1.660 -4.159 778 HE2 TYR 109 HE2 TYR 109 98.401 -2.118 -6.166 779 HH TYR 109 HH TYR 109 96.394 0.070 -6.069 780 H GLY 110 H GLY 110 102.816 -3.570 -3.016 781 HA2 GLY 110 1HA GLY 110 102.662 -3.286 -5.813 782 HA3 GLY 110 2HA GLY 110 104.317 -2.941 -5.325 783 H ALA 111 H ALA 111 104.388 -4.949 -6.872 784 HA ALA 111 HA ALA 111 104.685 -7.304 -5.145 785 HB1 ALA 111 1HB ALA 111 102.465 -7.540 -6.174 786 HB2 ALA 111 2HB ALA 111 103.582 -8.753 -6.797 787 HB3 ALA 111 3HB ALA 111 103.182 -7.340 -7.773 788 H GLY 112 H GLY 112 106.043 -8.980 -6.125 789 HA2 GLY 112 1HA GLY 112 107.667 -8.117 -8.411 790 HA3 GLY 112 2HA GLY 112 108.495 -8.354 -6.876 791 H LEU 113 H LEU 113 109.167 -9.809 -9.133 792 HA LEU 113 HA LEU 113 108.219 -12.534 -8.464 793 HB2 LEU 113 1HB LEU 113 109.029 -11.447 -11.173 794 HB3 LEU 113 2HB LEU 113 108.647 -13.133 -10.829 795 HG LEU 113 HG LEU 113 106.414 -12.106 -9.852 796 HD11 LEU 113 1HD1 LEU 113 107.577 -9.932 -11.568 797 HD12 LEU 113 2HD1 LEU 113 106.714 -9.796 -10.037 798 HD13 LEU 113 3HD1 LEU 113 105.828 -10.156 -11.519 799 HD21 LEU 113 3HD2 LEU 113 105.372 -12.388 -12.072 800 HD22 LEU 113 1HD2 LEU 113 106.564 -13.654 -11.774 801 HD23 LEU 113 2HD2 LEU 113 106.961 -12.300 -12.832 802 H GLN 114 H GLN 114 109.775 -14.160 -8.414 803 HA GLN 114 HA GLN 114 112.581 -13.213 -8.326 804 HB2 GLN 114 1HB GLN 114 111.615 -13.844 -6.125 805 HB3 GLN 114 2HB GLN 114 111.293 -15.459 -6.754 806 HG2 GLN 114 1HG GLN 114 113.686 -15.800 -7.167 807 HG3 GLN 114 2HG GLN 114 114.032 -14.169 -6.599 808 HE21 GLN 114 1HE2 GLN 114 115.320 -16.214 -5.264 809 HE22 GLN 114 2HE2 GLN 114 114.634 -16.451 -3.730 810 H PHE 115 H PHE 115 114.042 -14.253 -9.575 811 HA PHE 115 HA PHE 115 113.230 -16.803 -10.857 812 HB2 PHE 115 1HB PHE 115 114.884 -14.555 -12.018 813 HB3 PHE 115 2HB PHE 115 114.595 -16.101 -12.793 814 HD1 PHE 115 HD1 PHE 115 112.309 -16.687 -13.595 815 HD2 PHE 115 HD2 PHE 115 113.245 -12.807 -12.009 816 HE1 PHE 115 HE1 PHE 115 110.234 -15.775 -14.601 817 HE2 PHE 115 HE2 PHE 115 111.170 -11.895 -13.015 818 HZ PHE 115 HZ PHE 115 109.664 -13.379 -14.312 819 H ASN 116 H ASN 116 114.852 -18.356 -11.132 820 HA ASN 116 HA ASN 116 117.312 -17.897 -9.542 821 HB2 ASN 116 1HB ASN 116 115.406 -19.499 -8.690 822 HB3 ASN 116 2HB ASN 116 116.110 -20.621 -9.850 823 HD21 ASN 116 1HD2 ASN 116 116.485 -19.252 -6.703 824 HD22 ASN 116 2HD2 ASN 116 118.008 -19.917 -6.360 825 HA PRO 117 HA PRO 117 118.512 -18.902 -13.901 826 HB2 PRO 117 1HB PRO 117 121.008 -17.710 -13.736 827 HB3 PRO 117 2HB PRO 117 119.527 -16.891 -14.266 828 HG2 PRO 117 1HG PRO 117 120.871 -16.835 -11.618 829 HG3 PRO 117 2HG PRO 117 120.055 -15.532 -12.504 830 HD2 PRO 117 1HD PRO 117 118.867 -16.797 -10.427 831 HD3 PRO 117 2HD PRO 117 117.938 -16.195 -11.817 832 H MET 118 H MET 118 121.264 -18.770 -11.611 833 HA MET 118 HA MET 118 122.252 -21.285 -12.637 834 HB2 MET 118 1HB MET 118 123.264 -19.576 -10.348 835 HB3 MET 118 2HB MET 118 124.128 -20.918 -11.091 836 HG2 MET 118 1HG MET 118 123.289 -18.356 -12.482 837 HG3 MET 118 2HG MET 118 124.927 -18.773 -11.988 838 HE1 MET 118 3HE MET 118 126.016 -20.795 -12.493 839 HE2 MET 118 1HE MET 118 126.150 -21.455 -14.127 840 HE3 MET 118 2HE MET 118 124.981 -22.130 -12.995 841 H GLU 119 H GLU 119 121.813 -20.308 -9.223 842 HA GLU 119 HA GLU 119 120.015 -22.389 -8.567 843 HB2 GLU 119 1HB GLU 119 122.033 -23.780 -9.094 844 HB3 GLU 119 2HB GLU 119 122.880 -22.962 -7.780 845 HG2 GLU 119 1HG GLU 119 121.098 -23.704 -6.210 846 HG3 GLU 119 2HG GLU 119 120.336 -24.587 -7.525 847 H ASN 120 H ASN 120 122.961 -21.171 -6.949 848 HA ASN 120 HA ASN 120 121.387 -20.497 -4.599 849 HB2 ASN 120 1HB ASN 120 124.347 -20.199 -5.126 850 HB3 ASN 120 2HB ASN 120 123.549 -19.994 -3.568 851 HD21 ASN 120 1HD2 ASN 120 121.753 -22.163 -3.566 852 HD22 ASN 120 2HD2 ASN 120 122.629 -23.616 -3.613 853 H VAL 121 H VAL 121 121.837 -18.817 -7.396 854 HA VAL 121 HA VAL 121 121.856 -16.212 -5.978 855 HB VAL 121 HB VAL 121 122.747 -16.773 -8.820 856 HG11 VAL 121 1HG1 VAL 121 123.042 -14.272 -7.133 857 HG12 VAL 121 2HG1 VAL 121 121.767 -14.500 -8.330 858 HG13 VAL 121 3HG1 VAL 121 123.457 -14.461 -8.837 859 HG21 VAL 121 3HG2 VAL 121 124.357 -16.156 -6.321 860 HG22 VAL 121 1HG2 VAL 121 125.015 -16.276 -7.953 861 HG23 VAL 121 2HG2 VAL 121 124.328 -17.701 -7.172 862 H ALA 122 H ALA 122 120.121 -14.924 -6.275 863 HA ALA 122 HA ALA 122 118.183 -15.652 -8.398 864 HB1 ALA 122 1HB ALA 122 117.404 -14.737 -5.628 865 HB2 ALA 122 2HB ALA 122 117.520 -16.439 -6.077 866 HB3 ALA 122 3HB ALA 122 116.358 -15.390 -6.890 867 H LEU 123 H LEU 123 116.859 -13.949 -9.147 868 HA LEU 123 HA LEU 123 117.801 -11.219 -8.487 869 HB2 LEU 123 1HB LEU 123 118.593 -12.297 -10.740 870 HB3 LEU 123 2HB LEU 123 116.943 -11.976 -11.267 871 HG LEU 123 HG LEU 123 118.448 -9.762 -9.916 872 HD11 LEU 123 1HD1 LEU 123 120.070 -10.620 -11.545 873 HD12 LEU 123 2HD1 LEU 123 119.411 -9.081 -12.100 874 HD13 LEU 123 3HD1 LEU 123 118.839 -10.592 -12.808 875 HD21 LEU 123 3HD2 LEU 123 117.148 -8.601 -11.932 876 HD22 LEU 123 1HD2 LEU 123 116.302 -9.062 -10.459 877 HD23 LEU 123 2HD2 LEU 123 116.210 -10.093 -11.884 878 H ASP 124 H ASP 124 116.143 -9.652 -8.388 879 HA ASP 124 HA ASP 124 113.391 -10.697 -8.736 880 HB2 ASP 124 1HB ASP 124 114.100 -10.838 -6.352 881 HB3 ASP 124 2HB ASP 124 114.358 -9.095 -6.362 882 H PHE 125 H PHE 125 111.962 -9.343 -9.578 883 HA PHE 125 HA PHE 125 112.663 -6.470 -9.810 884 HB2 PHE 125 1HB PHE 125 111.202 -8.214 -11.800 885 HB3 PHE 125 2HB PHE 125 111.303 -6.469 -11.904 886 HD1 PHE 125 HD1 PHE 125 113.659 -5.423 -12.081 887 HD2 PHE 125 HD2 PHE 125 112.842 -9.588 -12.748 888 HE1 PHE 125 HE1 PHE 125 115.773 -5.633 -13.359 889 HE2 PHE 125 HE2 PHE 125 114.957 -9.799 -14.023 890 HZ PHE 125 HZ PHE 125 116.423 -7.822 -14.331 891 H SER 126 H SER 126 111.084 -5.067 -9.110 892 HA SER 126 HA SER 126 108.362 -6.106 -8.727 893 HB2 SER 126 1HB SER 126 109.608 -6.438 -6.585 894 HB3 SER 126 2HB SER 126 109.879 -4.701 -6.521 895 HG SER 126 HG SER 126 107.949 -4.560 -5.717 896 H TYR 127 H TYR 127 106.774 -4.613 -8.955 897 HA TYR 127 HA TYR 127 107.604 -1.832 -9.538 898 HB2 TYR 127 1HB TYR 127 106.479 -3.016 -11.384 899 HB3 TYR 127 2HB TYR 127 105.102 -3.325 -10.344 900 HD1 TYR 127 HD1 TYR 127 107.034 -0.691 -12.096 901 HD2 TYR 127 HD2 TYR 127 103.443 -1.641 -9.940 902 HE1 TYR 127 HE1 TYR 127 106.052 1.482 -12.775 903 HE2 TYR 127 HE2 TYR 127 102.461 0.533 -10.618 904 HH TYR 127 HH TYR 127 103.155 2.220 -12.931 905 H GLU 128 H GLU 128 107.142 -0.385 -8.025 906 HA GLU 128 HA GLU 128 104.880 -0.902 -6.180 907 HB2 GLU 128 1HB GLU 128 107.576 0.317 -5.536 908 HB3 GLU 128 2HB GLU 128 106.221 0.187 -4.414 909 HG2 GLU 128 1HG GLU 128 106.244 -2.283 -4.718 910 HG3 GLU 128 2HG GLU 128 107.654 -2.121 -5.757 911 H GLN 129 H GLN 129 103.516 0.750 -5.816 912 HA GLN 129 HA GLN 129 104.260 3.441 -6.794 913 HB2 GLN 129 1HB GLN 129 101.999 3.777 -7.609 914 HB3 GLN 129 2HB GLN 129 102.687 2.346 -8.370 915 HG2 GLN 129 1HG GLN 129 101.531 0.977 -6.561 916 HG3 GLN 129 2HG GLN 129 100.674 2.450 -6.112 917 HE21 GLN 129 1HE2 GLN 129 98.571 1.990 -6.889 918 HE22 GLN 129 2HE2 GLN 129 98.230 1.621 -8.511 919 H SER 130 H SER 130 103.486 5.179 -5.579 920 HA SER 130 HA SER 130 102.206 4.500 -3.003 921 HB2 SER 130 1HB SER 130 104.640 6.273 -3.312 922 HB3 SER 130 2HB SER 130 103.801 5.897 -1.811 923 HG SER 130 HG SER 130 105.592 4.537 -2.087 924 H ARG 131 H ARG 131 100.963 6.101 -2.093 925 HA ARG 131 HA ARG 131 100.560 8.558 -3.703 926 HB2 ARG 131 1HB ARG 131 98.608 6.993 -3.703 927 HB3 ARG 131 2HB ARG 131 98.530 7.153 -1.947 928 HG2 ARG 131 1HG ARG 131 98.249 9.606 -2.200 929 HG3 ARG 131 2HG ARG 131 98.259 9.411 -3.953 930 HD2 ARG 131 1HD ARG 131 96.294 7.883 -3.751 931 HD3 ARG 131 2HD ARG 131 96.251 8.219 -2.022 932 HE ARG 131 HE ARG 131 96.203 10.623 -3.582 933 HH11 ARG 131 1HH1 ARG 131 94.148 8.027 -2.414 934 HH12 ARG 131 2HH1 ARG 131 92.714 8.996 -2.485 935 HH21 ARG 131 1HH2 ARG 131 94.323 11.820 -3.652 936 HH22 ARG 131 2HH2 ARG 131 92.814 11.116 -3.179 937 H ILE 132 H ILE 132 101.107 10.377 -2.693 938 HA ILE 132 HA ILE 132 101.195 10.423 0.261 939 HB ILE 132 HB ILE 132 103.301 11.593 -1.588 940 HG12 ILE 132 1HG1 ILE 132 103.530 9.287 0.370 941 HG13 ILE 132 2HG1 ILE 132 103.364 9.088 -1.375 942 HG21 ILE 132 1HG2 ILE 132 102.897 12.895 0.478 943 HG22 ILE 132 2HG2 ILE 132 104.477 12.111 0.513 944 HG23 ILE 132 3HG2 ILE 132 103.136 11.434 1.437 945 HD11 ILE 132 3HD1 ILE 132 105.609 10.541 0.052 946 HD12 ILE 132 1HD1 ILE 132 105.423 10.447 -1.700 947 HD13 ILE 132 2HD1 ILE 132 105.729 8.983 -0.765 948 H ARG 133 H ARG 133 99.430 11.690 0.510 949 HA ARG 133 HA ARG 133 97.650 12.927 -0.462 950 HB2 ARG 133 1HB ARG 133 98.581 13.892 1.619 951 HB3 ARG 133 2HB ARG 133 99.619 14.929 0.647 952 HG2 ARG 133 1HG ARG 133 97.745 16.277 1.185 953 HG3 ARG 133 2HG ARG 133 97.450 15.765 -0.473 954 HD2 ARG 133 1HD ARG 133 96.015 13.918 0.383 955 HD3 ARG 133 2HD ARG 133 96.277 14.506 2.022 956 HE ARG 133 HE ARG 133 95.200 16.440 0.122 957 HH11 ARG 133 1HH1 ARG 133 94.479 14.139 2.675 958 HH12 ARG 133 2HH1 ARG 133 92.930 14.841 3.005 959 HH21 ARG 133 1HH2 ARG 133 93.196 17.297 0.590 960 HH22 ARG 133 2HH2 ARG 133 92.213 16.606 1.838 961 H SER 134 H SER 134 97.687 12.753 -2.732 962 HA SER 134 HA SER 134 97.165 13.890 -4.660 963 HB2 SER 134 1HB SER 134 98.528 16.331 -3.525 964 HB3 SER 134 2HB SER 134 97.432 16.258 -4.900 965 HG SER 134 HG SER 134 95.812 16.247 -3.556 966 H VAL 135 H VAL 135 100.352 13.438 -3.477 967 HA VAL 135 HA VAL 135 101.493 14.038 -6.129 968 HB VAL 135 HB VAL 135 102.900 13.311 -3.543 969 HG11 VAL 135 1HG1 VAL 135 104.288 12.737 -5.415 970 HG12 VAL 135 2HG1 VAL 135 104.870 14.293 -4.823 971 HG13 VAL 135 3HG1 VAL 135 103.860 14.221 -6.267 972 HG21 VAL 135 3HG2 VAL 135 103.443 15.672 -3.366 973 HG22 VAL 135 1HG2 VAL 135 101.692 15.516 -3.501 974 HG23 VAL 135 2HG2 VAL 135 102.643 16.012 -4.900 975 H ASP 136 H ASP 136 102.113 12.435 -7.474 976 HA ASP 136 HA ASP 136 101.617 9.662 -6.556 977 HB2 ASP 136 1HB ASP 136 101.665 10.842 -9.342 978 HB3 ASP 136 2HB ASP 136 101.416 9.137 -8.976 979 H VAL 137 H VAL 137 103.321 8.330 -6.295 980 HA VAL 137 HA VAL 137 105.873 9.061 -7.630 981 HB VAL 137 HB VAL 137 105.519 7.693 -4.950 982 HG11 VAL 137 1HG1 VAL 137 107.997 8.815 -6.290 983 HG12 VAL 137 2HG1 VAL 137 107.579 7.102 -6.253 984 HG13 VAL 137 3HG1 VAL 137 107.929 7.958 -4.751 985 HG21 VAL 137 3HG2 VAL 137 104.862 10.112 -4.956 986 HG22 VAL 137 1HG2 VAL 137 106.467 10.508 -5.570 987 HG23 VAL 137 2HG2 VAL 137 106.287 9.788 -3.971 988 H GLY 138 H GLY 138 106.808 7.550 -8.853 989 HA2 GLY 138 1HA GLY 138 105.824 4.757 -8.669 990 HA3 GLY 138 2HA GLY 138 106.236 5.533 -10.198 991 H THR 139 H THR 139 107.365 3.295 -8.204 992 HA THR 139 HA THR 139 110.203 4.046 -8.597 993 HB THR 139 HB THR 139 109.066 2.601 -6.193 994 HG1 THR 139 HG1 THR 139 108.478 4.634 -5.864 995 HG21 THR 139 3HG2 THR 139 111.377 1.996 -6.702 996 HG22 THR 139 1HG2 THR 139 111.340 3.038 -5.280 997 HG23 THR 139 2HG2 THR 139 111.816 3.698 -6.845 998 H TRP 140 H TRP 140 111.508 2.493 -9.392 999 HA TRP 140 HA TRP 140 110.338 -0.178 -9.879 1000 HB2 TRP 140 1HB TRP 140 112.561 1.325 -11.261 1001 HB3 TRP 140 2HB TRP 140 112.187 -0.358 -11.575 1002 HD1 TRP 140 HD1 TRP 140 111.089 3.153 -12.341 1003 HE1 TRP 140 HE1 TRP 140 109.168 3.099 -14.058 1004 HE3 TRP 140 HE3 TRP 140 110.070 -1.850 -12.365 1005 HZ2 TRP 140 HZ2 TRP 140 107.427 1.183 -15.284 1006 HZ3 TRP 140 HZ3 TRP 140 108.282 -2.761 -13.813 1007 HH2 TRP 140 HH2 TRP 140 106.960 -1.255 -15.271 1008 H ILE 141 H ILE 141 111.356 -1.990 -9.124 1009 HA ILE 141 HA ILE 141 113.770 -1.559 -7.448 1010 HB ILE 141 HB ILE 141 111.612 -3.631 -7.020 1011 HG12 ILE 141 1HG1 ILE 141 110.660 -1.404 -6.621 1012 HG13 ILE 141 2HG1 ILE 141 110.896 -2.247 -5.093 1013 HG21 ILE 141 1HG2 ILE 141 112.730 -3.696 -4.734 1014 HG22 ILE 141 2HG2 ILE 141 114.031 -2.741 -5.446 1015 HG23 ILE 141 3HG2 ILE 141 113.674 -4.351 -6.072 1016 HD11 ILE 141 3HD1 ILE 141 112.750 -0.155 -6.265 1017 HD12 ILE 141 1HD1 ILE 141 113.012 -1.008 -4.744 1018 HD13 ILE 141 2HD1 ILE 141 111.642 0.089 -4.917 1019 H ALA 142 H ALA 142 115.531 -2.591 -8.194 1020 HA ALA 142 HA ALA 142 115.158 -5.361 -9.161 1021 HB1 ALA 142 1HB ALA 142 115.495 -3.814 -11.113 1022 HB2 ALA 142 2HB ALA 142 116.748 -5.045 -10.948 1023 HB3 ALA 142 3HB ALA 142 117.066 -3.388 -10.435 1024 H GLY 143 H GLY 143 116.551 -6.788 -8.222 1025 HA2 GLY 143 1HA GLY 143 119.139 -5.936 -7.239 1026 HA3 GLY 143 2HA GLY 143 117.973 -6.247 -5.960 1027 H VAL 144 H VAL 144 119.905 -7.799 -5.598 1028 HA VAL 144 HA VAL 144 119.218 -10.406 -6.801 1029 HB VAL 144 HB VAL 144 121.625 -10.986 -6.850 1030 HG11 VAL 144 1HG1 VAL 144 120.972 -8.450 -8.381 1031 HG12 VAL 144 2HG1 VAL 144 120.474 -10.072 -8.862 1032 HG13 VAL 144 3HG1 VAL 144 122.187 -9.651 -8.822 1033 HG21 VAL 144 3HG2 VAL 144 121.913 -8.085 -6.018 1034 HG22 VAL 144 1HG2 VAL 144 123.237 -9.028 -6.704 1035 HG23 VAL 144 2HG2 VAL 144 122.517 -9.508 -5.168 1036 H GLY 145 H GLY 145 119.853 -12.238 -5.439 1037 HA2 GLY 145 1HA GLY 145 120.284 -11.552 -2.605 1038 HA3 GLY 145 2HA GLY 145 118.867 -12.493 -3.055 1039 H TYR 146 H TYR 146 120.921 -13.322 -1.286 1040 HA TYR 146 HA TYR 146 121.960 -15.676 -2.745 1041 HB2 TYR 146 1HB TYR 146 123.349 -14.134 -0.548 1042 HB3 TYR 146 2HB TYR 146 123.929 -15.625 -1.266 1043 HD1 TYR 146 HD2 TYR 146 124.874 -15.651 -3.523 1044 HD2 TYR 146 HD1 TYR 146 123.449 -12.012 -1.739 1045 HE1 TYR 146 HE2 TYR 146 126.044 -14.336 -5.270 1046 HE2 TYR 146 HE1 TYR 146 124.620 -10.697 -3.487 1047 HH TYR 146 HH TYR 146 126.004 -12.188 -6.288 1048 H ARG 147 H ARG 147 121.797 -17.623 -1.669 1049 HA ARG 147 HA ARG 147 120.099 -17.592 0.741 1050 HB2 ARG 147 1HB ARG 147 119.317 -18.854 -1.268 1051 HB3 ARG 147 2HB ARG 147 120.732 -19.897 -1.116 1052 HG2 ARG 147 1HG ARG 147 120.020 -20.584 1.125 1053 HG3 ARG 147 2HG ARG 147 118.635 -19.495 1.038 1054 HD2 ARG 147 1HD ARG 147 117.847 -21.701 0.472 1055 HD3 ARG 147 2HD ARG 147 117.876 -20.752 -1.010 1056 HE ARG 147 HE ARG 147 120.309 -22.239 -0.538 1057 HH11 ARG 147 1HH1 ARG 147 117.098 -22.414 -1.946 1058 HH12 ARG 147 2HH1 ARG 147 117.532 -23.700 -3.022 1059 HH21 ARG 147 1HH2 ARG 147 120.808 -23.893 -1.946 1060 HH22 ARG 147 2HH2 ARG 147 119.606 -24.527 -3.020 1061 H PHE 148 H PHE 148 120.763 -18.455 2.641 1062 HA PHE 148 HA PHE 148 123.302 -19.951 2.712 1063 HB2 PHE 148 1HB PHE 148 122.586 -17.597 4.465 1064 HB3 PHE 148 2HB PHE 148 123.955 -18.660 4.731 1065 HD1 PHE 148 HD1 PHE 148 125.865 -18.666 3.135 1066 HD2 PHE 148 HD2 PHE 148 122.611 -15.883 2.786 1067 HE1 PHE 148 HE1 PHE 148 127.235 -17.252 1.627 1068 HE2 PHE 148 HE2 PHE 148 123.981 -14.471 1.277 1069 HZ PHE 148 HZ PHE 148 126.293 -15.155 0.697 Start of MODEL 3 1 H1 ALA 1 3H ALA 1 115.671 -21.479 9.459 2 H2 ALA 1 2H ALA 1 117.293 -21.318 9.936 3 H3 ALA 1 HT3 ALA 1 116.268 -22.397 10.754 4 HA ALA 1 HA ALA 1 117.513 -23.783 9.396 5 HB1 ALA 1 2HB ALA 1 115.835 -24.226 7.415 6 HB2 ALA 1 3HB ALA 1 114.835 -23.042 8.258 7 HB3 ALA 1 1HB ALA 1 115.325 -24.526 9.076 8 H THR 2 H THR 2 116.022 -21.519 7.069 9 HA THR 2 HA THR 2 118.657 -21.268 5.731 10 HB THR 2 HB THR 2 115.936 -21.232 4.404 11 HG1 THR 2 HG1 THR 2 116.155 -23.307 4.628 12 HG21 THR 2 3HG2 THR 2 118.700 -21.439 3.188 13 HG22 THR 2 1HG2 THR 2 117.828 -19.915 3.356 14 HG23 THR 2 2HG2 THR 2 117.171 -21.199 2.342 15 H SER 3 H SER 3 119.298 -19.234 5.142 16 HA SER 3 HA SER 3 117.449 -16.998 5.749 17 HB2 SER 3 1HB SER 3 119.183 -17.263 7.517 18 HB3 SER 3 2HB SER 3 120.427 -17.078 6.287 19 HG SER 3 HG SER 3 119.559 -15.147 7.559 20 H THR 4 H THR 4 117.520 -15.260 4.362 21 HA THR 4 HA THR 4 119.316 -15.490 2.015 22 HB THR 4 HB THR 4 116.440 -14.544 1.979 23 HG1 THR 4 HG1 THR 4 115.999 -16.574 1.844 24 HG21 THR 4 3HG2 THR 4 116.729 -14.599 -0.446 25 HG22 THR 4 1HG2 THR 4 118.380 -15.192 -0.259 26 HG23 THR 4 2HG2 THR 4 117.963 -13.561 0.270 27 H VAL 5 H VAL 5 120.403 -13.692 1.485 28 HA VAL 5 HA VAL 5 119.619 -11.144 2.804 29 HB VAL 5 HB VAL 5 122.409 -12.043 2.028 30 HG11 VAL 5 1HG1 VAL 5 121.325 -9.593 3.441 31 HG12 VAL 5 2HG1 VAL 5 122.211 -9.640 1.918 32 HG13 VAL 5 3HG1 VAL 5 123.033 -10.033 3.429 33 HG21 VAL 5 3HG2 VAL 5 122.818 -12.322 4.399 34 HG22 VAL 5 1HG2 VAL 5 121.394 -13.275 3.982 35 HG23 VAL 5 2HG2 VAL 5 121.207 -11.720 4.793 36 H THR 6 H THR 6 119.186 -9.483 1.438 37 HA THR 6 HA THR 6 120.136 -9.685 -1.354 38 HB THR 6 HB THR 6 117.988 -9.190 -2.258 39 HG1 THR 6 HG1 THR 6 117.269 -8.818 0.444 40 HG21 THR 6 3HG2 THR 6 116.873 -11.082 -0.319 41 HG22 THR 6 1HG2 THR 6 118.444 -11.590 -0.939 42 HG23 THR 6 2HG2 THR 6 117.118 -11.265 -2.054 43 H GLY 7 H GLY 7 120.006 -7.685 -2.533 44 HA2 GLY 7 1HA GLY 7 119.299 -5.255 -1.082 45 HA3 GLY 7 2HA GLY 7 120.980 -5.376 -1.605 46 H GLY 8 H GLY 8 118.862 -3.504 -2.526 47 HA2 GLY 8 1HA GLY 8 119.311 -3.899 -5.380 48 HA3 GLY 8 2HA GLY 8 117.629 -3.943 -4.866 49 H TYR 9 H TYR 9 118.283 -2.096 -6.649 50 HA TYR 9 HA TYR 9 118.271 0.437 -5.121 51 HB2 TYR 9 1HB TYR 9 119.604 1.504 -6.805 52 HB3 TYR 9 2HB TYR 9 120.457 0.086 -6.234 53 HD1 TYR 9 HD1 TYR 9 120.623 -1.938 -7.677 54 HD2 TYR 9 HD2 TYR 9 118.854 1.718 -9.073 55 HE1 TYR 9 HE1 TYR 9 120.831 -2.732 -10.017 56 HE2 TYR 9 HE2 TYR 9 119.060 0.924 -11.414 57 HH TYR 9 HH TYR 9 120.942 -1.792 -12.272 58 H ALA 10 H ALA 10 116.856 1.999 -5.830 59 HA ALA 10 HA ALA 10 115.268 1.430 -8.245 60 HB1 ALA 10 1HB ALA 10 113.225 1.476 -7.171 61 HB2 ALA 10 2HB ALA 10 113.843 2.405 -5.805 62 HB3 ALA 10 3HB ALA 10 114.210 0.686 -5.940 63 H GLN 11 H GLN 11 114.468 3.221 -9.289 64 HA GLN 11 HA GLN 11 115.191 5.872 -8.180 65 HB2 GLN 11 1HB GLN 11 114.978 4.977 -11.068 66 HB3 GLN 11 2HB GLN 11 115.262 6.639 -10.547 67 HG2 GLN 11 1HG GLN 11 117.338 5.974 -9.441 68 HG3 GLN 11 2HG GLN 11 117.046 4.287 -9.855 69 HE21 GLN 11 1HE2 GLN 11 119.413 5.655 -10.715 70 HE22 GLN 11 2HE2 GLN 11 119.354 5.806 -12.405 71 H SER 12 H SER 12 113.583 7.483 -8.209 72 HA SER 12 HA SER 12 110.862 6.466 -8.839 73 HB2 SER 12 1HB SER 12 111.678 8.295 -6.570 74 HB3 SER 12 2HB SER 12 110.054 7.710 -6.908 75 HG SER 12 HG SER 12 110.716 6.193 -5.562 76 H ASP 13 H ASP 13 109.547 7.749 -9.976 77 HA ASP 13 HA ASP 13 110.518 10.425 -10.746 78 HB2 ASP 13 1HB ASP 13 109.978 8.800 -12.575 79 HB3 ASP 13 2HB ASP 13 108.314 8.762 -11.996 80 H ALA 14 H ALA 14 109.500 12.165 -9.922 81 HA ALA 14 HA ALA 14 107.090 11.676 -8.290 82 HB1 ALA 14 1HB ALA 14 109.259 12.523 -7.213 83 HB2 ALA 14 2HB ALA 14 107.788 13.436 -6.875 84 HB3 ALA 14 3HB ALA 14 108.948 14.039 -8.058 85 H GLN 15 H GLN 15 105.402 12.123 -9.505 86 HA GLN 15 HA GLN 15 105.307 14.411 -11.287 87 HB2 GLN 15 1HB GLN 15 103.176 12.446 -10.406 88 HB3 GLN 15 2HB GLN 15 102.927 13.720 -11.600 89 HG2 GLN 15 1HG GLN 15 104.666 12.770 -13.028 90 HG3 GLN 15 2HG GLN 15 105.016 11.535 -11.821 91 HE21 GLN 15 1HE2 GLN 15 104.206 10.846 -14.483 92 HE22 GLN 15 2HE2 GLN 15 102.674 10.119 -14.400 93 H GLY 16 H GLY 16 104.797 16.382 -10.690 94 HA2 GLY 16 1HA GLY 16 103.571 18.048 -9.517 95 HA3 GLY 16 2HA GLY 16 103.217 16.871 -8.262 96 H GLN 17 H GLN 17 106.274 16.151 -8.473 97 HA GLN 17 HA GLN 17 107.300 18.485 -6.971 98 HB2 GLN 17 1HB GLN 17 108.045 15.564 -6.730 99 HB3 GLN 17 2HB GLN 17 108.883 16.880 -5.910 100 HG2 GLN 17 1HG GLN 17 106.818 17.514 -4.758 101 HG3 GLN 17 2HG GLN 17 105.933 16.255 -5.614 102 HE21 GLN 17 1HE2 GLN 17 106.075 16.308 -2.751 103 HE22 GLN 17 2HE2 GLN 17 106.973 14.962 -2.239 104 H MET 18 H MET 18 109.758 18.639 -7.127 105 HA MET 18 HA MET 18 110.492 18.386 -9.971 106 HB2 MET 18 1HB MET 18 110.523 20.635 -8.784 107 HB3 MET 18 2HB MET 18 111.903 20.028 -7.869 108 HG2 MET 18 1HG MET 18 113.040 19.520 -10.054 109 HG3 MET 18 2HG MET 18 111.709 20.332 -10.877 110 HE1 MET 18 3HE MET 18 110.922 22.579 -10.451 111 HE2 MET 18 1HE MET 18 111.826 23.926 -9.749 112 HE3 MET 18 2HE MET 18 111.054 22.739 -8.701 113 H ASN 19 H ASN 19 112.396 17.442 -10.619 114 HA ASN 19 HA ASN 19 114.312 16.200 -10.572 115 HB2 ASN 19 1HB ASN 19 114.961 17.858 -8.756 116 HB3 ASN 19 2HB ASN 19 114.454 16.633 -7.592 117 HD21 ASN 19 1HD2 ASN 19 116.117 15.270 -6.942 118 HD22 ASN 19 2HD2 ASN 19 117.494 14.904 -7.862 119 H LYS 20 H LYS 20 114.883 14.091 -10.358 120 HA LYS 20 HA LYS 20 112.883 12.291 -9.249 121 HB2 LYS 20 1HB LYS 20 115.438 11.778 -10.792 122 HB3 LYS 20 2HB LYS 20 114.295 10.528 -10.298 123 HG2 LYS 20 1HG LYS 20 112.504 11.716 -11.565 124 HG3 LYS 20 2HG LYS 20 113.712 12.872 -12.131 125 HD2 LYS 20 1HD LYS 20 115.005 10.974 -13.115 126 HD3 LYS 20 2HD LYS 20 113.698 9.885 -12.648 127 HE2 LYS 20 1HE LYS 20 112.137 11.004 -14.090 128 HE3 LYS 20 2HE LYS 20 113.269 12.322 -14.392 129 HZ1 LYS 20 3HZ LYS 20 112.995 10.297 -16.045 130 HZ2 LYS 20 1HZ LYS 20 114.164 9.616 -15.021 131 HZ3 LYS 20 2HZ LYS 20 114.485 11.081 -15.820 132 H MET 21 H MET 21 113.639 10.379 -7.941 133 HA MET 21 HA MET 21 115.700 11.251 -5.983 134 HB2 MET 21 1HB MET 21 113.048 9.895 -5.449 135 HB3 MET 21 2HB MET 21 114.298 10.181 -4.238 136 HG2 MET 21 1HG MET 21 114.167 12.634 -4.779 137 HG3 MET 21 2HG MET 21 112.783 12.279 -5.812 138 HE1 MET 21 3HE MET 21 111.403 9.819 -4.010 139 HE2 MET 21 1HE MET 21 110.777 11.042 -5.123 140 HE3 MET 21 2HE MET 21 110.115 10.906 -3.496 141 H GLY 22 H GLY 22 116.640 9.434 -4.731 142 HA2 GLY 22 1HA GLY 22 116.534 6.852 -6.166 143 HA3 GLY 22 2HA GLY 22 118.092 7.634 -5.896 144 H GLY 23 H GLY 23 116.778 5.073 -4.845 145 HA2 GLY 23 1HA GLY 23 117.638 5.474 -2.073 146 HA3 GLY 23 2HA GLY 23 115.989 4.912 -2.326 147 H PHE 24 H PHE 24 117.649 3.385 -0.872 148 HA PHE 24 HA PHE 24 118.178 1.072 -2.648 149 HB2 PHE 24 1HB PHE 24 120.091 0.471 -1.279 150 HB3 PHE 24 2HB PHE 24 120.308 2.078 -1.944 151 HD1 PHE 24 HD1 PHE 24 120.077 4.079 -0.479 152 HD2 PHE 24 HD2 PHE 24 119.914 0.081 1.081 153 HE1 PHE 24 HE1 PHE 24 120.461 4.957 1.808 154 HE2 PHE 24 HE2 PHE 24 120.299 0.958 3.369 155 HZ PHE 24 HZ PHE 24 120.571 3.395 3.732 156 H ASN 25 H ASN 25 117.792 -0.987 -1.689 157 HA ASN 25 HA ASN 25 116.205 -0.920 0.810 158 HB2 ASN 25 1HB ASN 25 115.469 -2.343 -1.758 159 HB3 ASN 25 2HB ASN 25 114.636 -2.542 -0.221 160 HD21 ASN 25 1HD2 ASN 25 112.856 -1.715 -1.917 161 HD22 ASN 25 2HD2 ASN 25 112.601 -0.038 -1.911 162 H LEU 26 H LEU 26 116.428 -2.664 2.137 163 HA LEU 26 HA LEU 26 118.016 -4.968 1.161 164 HB2 LEU 26 1HB LEU 26 118.004 -3.826 3.970 165 HB3 LEU 26 2HB LEU 26 118.939 -5.211 3.411 166 HG LEU 26 HG LEU 26 119.213 -2.397 2.312 167 HD11 LEU 26 1HD1 LEU 26 120.018 -2.504 4.619 168 HD12 LEU 26 2HD1 LEU 26 121.395 -2.426 3.519 169 HD13 LEU 26 3HD1 LEU 26 120.940 -3.964 4.254 170 HD21 LEU 26 3HD2 LEU 26 119.839 -4.057 0.662 171 HD22 LEU 26 1HD2 LEU 26 120.743 -4.978 1.864 172 HD23 LEU 26 2HD2 LEU 26 121.324 -3.397 1.344 173 H LYS 27 H LYS 27 117.132 -6.996 1.618 174 HA LYS 27 HA LYS 27 114.582 -6.982 3.130 175 HB2 LYS 27 1HB LYS 27 115.055 -8.415 0.511 176 HB3 LYS 27 2HB LYS 27 113.576 -8.443 1.466 177 HG2 LYS 27 1HG LYS 27 113.507 -5.918 1.239 178 HG3 LYS 27 2HG LYS 27 114.809 -6.063 0.061 179 HD2 LYS 27 1HD LYS 27 112.124 -7.456 -0.155 180 HD3 LYS 27 2HD LYS 27 112.563 -5.980 -1.015 181 HE2 LYS 27 1HE LYS 27 114.429 -7.176 -2.110 182 HE3 LYS 27 2HE LYS 27 113.967 -8.656 -1.268 183 HZ1 LYS 27 3HZ LYS 27 113.024 -8.668 -3.453 184 HZ2 LYS 27 1HZ LYS 27 112.324 -7.141 -3.221 185 HZ3 LYS 27 2HZ LYS 27 111.768 -8.473 -2.327 186 H TYR 28 H TYR 28 114.102 -8.732 4.315 187 HA TYR 28 HA TYR 28 116.069 -10.951 4.372 188 HB2 TYR 28 1HB TYR 28 116.177 -9.492 6.374 189 HB3 TYR 28 2HB TYR 28 114.482 -9.817 6.680 190 HD1 TYR 28 HD2 TYR 28 117.895 -11.175 6.759 191 HD2 TYR 28 HD1 TYR 28 113.748 -11.997 7.519 192 HE1 TYR 28 HE2 TYR 28 118.532 -13.195 8.051 193 HE2 TYR 28 HE1 TYR 28 114.385 -14.016 8.811 194 HH TYR 28 HH TYR 28 117.740 -15.114 8.966 195 H ARG 29 H ARG 29 115.271 -13.008 4.392 196 HA ARG 29 HA ARG 29 112.334 -13.345 4.369 197 HB2 ARG 29 1HB ARG 29 114.328 -14.572 2.455 198 HB3 ARG 29 2HB ARG 29 112.622 -15.010 2.550 199 HG2 ARG 29 1HG ARG 29 112.015 -12.648 2.072 200 HG3 ARG 29 2HG ARG 29 113.728 -12.266 1.892 201 HD2 ARG 29 1HD ARG 29 112.845 -12.663 -0.318 202 HD3 ARG 29 2HD ARG 29 113.857 -14.040 0.109 203 HE ARG 29 HE ARG 29 111.006 -14.287 0.698 204 HH11 ARG 29 1HH1 ARG 29 113.613 -15.063 -1.525 205 HH12 ARG 29 2HH1 ARG 29 112.737 -16.371 -2.246 206 HH21 ARG 29 1HH2 ARG 29 109.931 -15.980 -0.274 207 HH22 ARG 29 2HH2 ARG 29 110.681 -16.881 -1.548 208 H TYR 30 H TYR 30 111.539 -15.129 5.374 209 HA TYR 30 HA TYR 30 113.472 -17.131 6.387 210 HB2 TYR 30 1HB TYR 30 112.790 -15.560 8.182 211 HB3 TYR 30 2HB TYR 30 111.115 -15.998 7.898 212 HD1 TYR 30 HD1 TYR 30 114.395 -17.206 9.116 213 HD2 TYR 30 HD2 TYR 30 110.202 -18.061 8.740 214 HE1 TYR 30 HE1 TYR 30 114.640 -19.102 10.695 215 HE2 TYR 30 HE2 TYR 30 110.448 -19.957 10.319 216 HH TYR 30 HH TYR 30 112.512 -21.519 11.009 217 H GLU 31 H GLU 31 112.824 -19.241 6.254 218 HA GLU 31 HA GLU 31 110.071 -19.783 5.321 219 HB2 GLU 31 1HB GLU 31 112.619 -20.914 4.143 220 HB3 GLU 31 2HB GLU 31 110.986 -21.427 3.716 221 HG2 GLU 31 1HG GLU 31 110.462 -19.094 3.033 222 HG3 GLU 31 2HG GLU 31 112.124 -18.638 3.383 223 H GLU 32 H GLU 32 109.205 -21.774 5.912 224 HA GLU 32 HA GLU 32 110.602 -23.119 8.119 225 HB2 GLU 32 1HB GLU 32 107.731 -23.304 7.179 226 HB3 GLU 32 2HB GLU 32 108.397 -24.144 8.580 227 HG2 GLU 32 1HG GLU 32 109.034 -21.947 9.558 228 HG3 GLU 32 2HG GLU 32 108.275 -21.141 8.192 229 H ASP 33 H ASP 33 110.904 -25.363 8.165 230 HA ASP 33 HA ASP 33 111.715 -26.437 5.662 231 HB2 ASP 33 1HB ASP 33 111.490 -27.718 8.388 232 HB3 ASP 33 2HB ASP 33 112.269 -28.461 6.993 233 H ASN 34 H ASN 34 108.977 -27.235 7.823 234 HA ASN 34 HA ASN 34 108.116 -29.270 5.862 235 HB2 ASN 34 1HB ASN 34 107.265 -28.843 8.728 236 HB3 ASN 34 2HB ASN 34 106.723 -30.150 7.677 237 HD21 ASN 34 1HD2 ASN 34 108.526 -30.050 10.226 238 HD22 ASN 34 2HD2 ASN 34 109.877 -30.973 9.776 239 H SER 35 H SER 35 107.246 -26.117 6.926 240 HA SER 35 HA SER 35 104.871 -26.254 5.229 241 HB2 SER 35 1HB SER 35 103.618 -24.919 7.051 242 HB3 SER 35 2HB SER 35 103.782 -26.656 7.279 243 HG SER 35 HG SER 35 105.293 -26.318 8.800 244 HA PRO 36 HA PRO 36 107.717 -22.617 4.954 245 HB2 PRO 36 1HB PRO 36 107.858 -22.393 2.237 246 HB3 PRO 36 2HB PRO 36 108.866 -23.511 3.175 247 HG2 PRO 36 1HG PRO 36 106.409 -24.057 1.596 248 HG3 PRO 36 2HG PRO 36 107.884 -25.026 1.767 249 HD2 PRO 36 1HD PRO 36 105.566 -25.577 3.125 250 HD3 PRO 36 2HD PRO 36 107.181 -26.005 3.731 251 H LEU 37 H LEU 37 107.069 -20.607 5.103 252 HA LEU 37 HA LEU 37 104.875 -19.602 3.394 253 HB2 LEU 37 1HB LEU 37 105.524 -18.727 6.226 254 HB3 LEU 37 2HB LEU 37 104.224 -18.100 5.212 255 HG LEU 37 HG LEU 37 104.471 -20.993 6.092 256 HD11 LEU 37 1HD1 LEU 37 102.465 -20.390 7.508 257 HD12 LEU 37 2HD1 LEU 37 102.785 -18.698 7.129 258 HD13 LEU 37 3HD1 LEU 37 103.974 -19.638 8.029 259 HD21 LEU 37 3HD2 LEU 37 102.331 -19.424 4.620 260 HD22 LEU 37 1HD2 LEU 37 102.075 -21.036 5.290 261 HD23 LEU 37 2HD2 LEU 37 103.258 -20.793 4.004 262 H GLY 38 H GLY 38 105.367 -17.641 2.313 263 HA2 GLY 38 1HA GLY 38 108.220 -16.948 2.463 264 HA3 GLY 38 2HA GLY 38 107.115 -16.522 1.157 265 H VAL 39 H VAL 39 108.762 -15.296 3.750 266 HA VAL 39 HA VAL 39 106.863 -13.028 4.008 267 HB VAL 39 HB VAL 39 106.950 -14.362 6.079 268 HG11 VAL 39 1HG1 VAL 39 109.306 -15.202 5.666 269 HG12 VAL 39 2HG1 VAL 39 108.983 -14.670 7.316 270 HG13 VAL 39 3HG1 VAL 39 109.883 -13.628 6.213 271 HG21 VAL 39 3HG2 VAL 39 106.646 -11.922 6.231 272 HG22 VAL 39 1HG2 VAL 39 108.395 -11.701 6.276 273 HG23 VAL 39 2HG2 VAL 39 107.576 -12.519 7.606 274 H ILE 40 H ILE 40 107.655 -11.132 3.428 275 HA ILE 40 HA ILE 40 110.602 -10.782 3.333 276 HB ILE 40 HB ILE 40 108.541 -9.534 1.493 277 HG12 ILE 40 1HG1 ILE 40 110.591 -11.681 0.873 278 HG13 ILE 40 2HG1 ILE 40 108.881 -12.008 1.150 279 HG21 ILE 40 1HG2 ILE 40 111.568 -9.568 1.342 280 HG22 ILE 40 2HG2 ILE 40 110.621 -8.208 1.943 281 HG23 ILE 40 3HG2 ILE 40 110.468 -8.714 0.260 282 HD11 ILE 40 3HD1 ILE 40 110.035 -10.241 -1.025 283 HD12 ILE 40 1HD1 ILE 40 108.314 -10.463 -0.717 284 HD13 ILE 40 2HD1 ILE 40 109.296 -11.826 -1.251 285 H GLY 41 H GLY 41 111.332 -9.211 4.593 286 HA2 GLY 41 1HA GLY 41 109.561 -6.883 5.138 287 HA3 GLY 41 2HA GLY 41 110.736 -7.497 6.306 288 H SER 42 H SER 42 110.363 -4.942 4.470 289 HA SER 42 HA SER 42 113.159 -4.881 3.484 290 HB2 SER 42 1HB SER 42 111.550 -5.202 1.621 291 HB3 SER 42 2HB SER 42 110.735 -3.716 2.098 292 HG SER 42 HG SER 42 112.228 -2.681 1.052 293 H PHE 43 H PHE 43 114.309 -3.117 3.968 294 HA PHE 43 HA PHE 43 112.888 -0.760 5.075 295 HB2 PHE 43 1HB PHE 43 114.467 -1.910 6.628 296 HB3 PHE 43 2HB PHE 43 115.763 -1.601 5.489 297 HD1 PHE 43 HD1 PHE 43 116.660 0.657 5.184 298 HD2 PHE 43 HD2 PHE 43 113.483 -0.129 7.966 299 HE1 PHE 43 HE1 PHE 43 117.030 2.874 6.232 300 HE2 PHE 43 HE2 PHE 43 113.852 2.088 9.015 301 HZ PHE 43 HZ PHE 43 115.626 3.589 8.147 302 H THR 44 H THR 44 112.905 0.999 3.793 303 HA THR 44 HA THR 44 115.007 1.179 1.700 304 HB THR 44 HB THR 44 112.846 0.611 0.713 305 HG1 THR 44 HG1 THR 44 112.682 2.514 -0.610 306 HG21 THR 44 3HG2 THR 44 110.957 2.213 0.907 307 HG22 THR 44 1HG2 THR 44 111.877 3.125 2.104 308 HG23 THR 44 2HG2 THR 44 111.366 1.474 2.454 309 H TYR 45 H TYR 45 116.017 3.064 1.419 310 HA TYR 45 HA TYR 45 114.992 5.458 2.835 311 HB2 TYR 45 1HB TYR 45 116.951 4.497 4.015 312 HB3 TYR 45 2HB TYR 45 117.888 4.639 2.539 313 HD1 TYR 45 HD1 TYR 45 116.188 6.517 5.240 314 HD2 TYR 45 HD2 TYR 45 118.797 6.754 1.836 315 HE1 TYR 45 HE1 TYR 45 116.799 8.836 5.870 316 HE2 TYR 45 HE2 TYR 45 119.408 9.073 2.466 317 HH TYR 45 HH TYR 45 118.404 10.475 5.512 318 H THR 46 H THR 46 114.814 7.228 1.563 319 HA THR 46 HA THR 46 116.148 7.192 -1.078 320 HB THR 46 HB THR 46 113.283 8.003 -0.547 321 HG1 THR 46 HG1 THR 46 114.267 5.778 -1.989 322 HG21 THR 46 3HG2 THR 46 113.897 9.246 -2.405 323 HG22 THR 46 1HG2 THR 46 113.381 7.747 -3.178 324 HG23 THR 46 2HG2 THR 46 115.098 8.067 -2.930 325 H GLU 47 H GLU 47 116.823 9.142 -1.857 326 HA GLU 47 HA GLU 47 116.330 11.544 -0.224 327 HB2 GLU 47 1HB GLU 47 118.505 10.492 0.443 328 HB3 GLU 47 2HB GLU 47 119.061 10.695 -1.218 329 HG2 GLU 47 1HG GLU 47 118.658 13.140 -1.026 330 HG3 GLU 47 2HG GLU 47 118.189 12.914 0.652 331 H LYS 48 H LYS 48 116.392 13.485 -1.388 332 HA LYS 48 HA LYS 48 116.128 13.195 -4.279 333 HB2 LYS 48 1HB LYS 48 114.513 14.572 -2.962 334 HB3 LYS 48 2HB LYS 48 115.833 15.677 -2.577 335 HG2 LYS 48 1HG LYS 48 116.182 16.158 -4.938 336 HG3 LYS 48 2HG LYS 48 114.967 14.965 -5.393 337 HD2 LYS 48 1HD LYS 48 113.920 17.135 -5.489 338 HD3 LYS 48 2HD LYS 48 113.281 16.301 -4.073 339 HE2 LYS 48 1HE LYS 48 113.891 18.659 -3.577 340 HE3 LYS 48 2HE LYS 48 114.826 17.516 -2.617 341 HZ1 LYS 48 3HZ LYS 48 116.039 19.426 -3.806 342 HZ2 LYS 48 1HZ LYS 48 115.851 18.486 -5.205 343 HZ3 LYS 48 2HZ LYS 48 116.711 17.867 -3.877 344 H SER 49 H SER 49 117.550 13.945 -5.768 345 HA SER 49 HA SER 49 120.193 14.701 -4.797 346 HB2 SER 49 1HB SER 49 120.952 14.266 -7.027 347 HB3 SER 49 2HB SER 49 119.817 12.985 -6.614 348 HG SER 49 HG SER 49 119.695 14.838 -8.573 349 H ARG 50 H ARG 50 121.304 16.571 -5.437 350 HA ARG 50 HA ARG 50 119.554 18.860 -5.962 351 HB2 ARG 50 1HB ARG 50 121.195 18.925 -4.082 352 HB3 ARG 50 2HB ARG 50 122.500 18.815 -5.264 353 HG2 ARG 50 1HG ARG 50 121.673 20.889 -6.346 354 HG3 ARG 50 2HG ARG 50 120.419 21.016 -5.112 355 HD2 ARG 50 1HD ARG 50 122.205 21.071 -3.367 356 HD3 ARG 50 2HD ARG 50 123.412 21.078 -4.649 357 HE ARG 50 HE ARG 50 121.777 23.181 -5.269 358 HH11 ARG 50 1HH1 ARG 50 123.589 22.314 -2.390 359 HH12 ARG 50 2HH1 ARG 50 123.809 23.964 -1.911 360 HH21 ARG 50 1HH2 ARG 50 122.093 25.285 -4.601 361 HH22 ARG 50 2HH2 ARG 50 122.972 25.625 -3.148 362 H THR 51 H THR 51 119.847 20.284 -7.673 363 HA THR 51 HA THR 51 121.334 19.168 -9.961 364 HB THR 51 HB THR 51 119.211 21.325 -9.941 365 HG1 THR 51 HG1 THR 51 118.386 19.322 -9.281 366 HG21 THR 51 3HG2 THR 51 119.112 20.791 -12.366 367 HG22 THR 51 1HG2 THR 51 120.467 19.682 -12.157 368 HG23 THR 51 2HG2 THR 51 120.693 21.409 -11.886 369 H ALA 52 H ALA 52 122.932 20.281 -10.966 370 HA ALA 52 HA ALA 52 124.201 22.416 -9.528 371 HB1 ALA 52 1HB ALA 52 125.348 20.595 -10.907 372 HB2 ALA 52 2HB ALA 52 125.940 22.242 -11.132 373 HB3 ALA 52 3HB ALA 52 124.867 21.518 -12.331 374 H SER 53 H SER 53 124.530 24.542 -10.194 375 HA SER 53 HA SER 53 123.845 26.588 -10.962 376 HB2 SER 53 1HB SER 53 123.795 26.830 -13.349 377 HB3 SER 53 2HB SER 53 125.003 25.612 -12.960 378 HG SER 53 HG SER 53 122.314 25.165 -13.775 379 H SER 54 H SER 54 121.987 27.048 -9.871 380 HA SER 54 HA SER 54 119.593 27.286 -11.367 381 HB2 SER 54 1HB SER 54 119.321 24.909 -11.024 382 HB3 SER 54 2HB SER 54 119.680 25.071 -9.308 383 HG SER 54 HG SER 54 117.350 25.437 -10.648 384 H GLY 55 H GLY 55 120.689 26.750 -8.015 385 HA2 GLY 55 1HA GLY 55 120.834 28.445 -6.363 386 HA3 GLY 55 2HA GLY 55 119.734 29.432 -7.310 387 H ASP 56 H ASP 56 118.192 26.570 -7.387 388 HA ASP 56 HA ASP 56 116.538 27.231 -5.063 389 HB2 ASP 56 1HB ASP 56 115.485 26.793 -7.280 390 HB3 ASP 56 2HB ASP 56 116.100 25.142 -7.210 391 H TYR 57 H TYR 57 116.916 26.263 -3.172 392 HA TYR 57 HA TYR 57 118.064 23.529 -3.179 393 HB2 TYR 57 1HB TYR 57 119.339 24.082 -1.227 394 HB3 TYR 57 2HB TYR 57 119.690 25.257 -2.479 395 HD1 TYR 57 HD1 TYR 57 118.784 27.573 -2.307 396 HD2 TYR 57 HD2 TYR 57 118.307 24.695 0.846 397 HE1 TYR 57 HE1 TYR 57 118.210 29.398 -0.729 398 HE2 TYR 57 HE2 TYR 57 117.733 26.521 2.424 399 HH TYR 57 HH TYR 57 116.767 29.457 1.565 400 H ASN 58 H ASN 58 117.170 22.049 -1.879 401 HA ASN 58 HA ASN 58 115.636 22.517 0.429 402 HB2 ASN 58 1HB ASN 58 113.384 21.923 -0.450 403 HB3 ASN 58 2HB ASN 58 113.956 23.477 -1.048 404 HD21 ASN 58 1HD2 ASN 58 114.610 23.610 -3.319 405 HD22 ASN 58 2HD2 ASN 58 114.184 22.394 -4.424 406 H LYS 59 H LYS 59 116.081 20.692 1.497 407 HA LYS 59 HA LYS 59 116.574 18.241 -0.041 408 HB2 LYS 59 1HB LYS 59 117.183 18.965 2.833 409 HB3 LYS 59 2HB LYS 59 117.569 17.414 2.086 410 HG2 LYS 59 1HG LYS 59 118.910 18.616 0.362 411 HG3 LYS 59 2HG LYS 59 118.598 20.129 1.214 412 HD2 LYS 59 1HD LYS 59 119.642 19.144 3.258 413 HD3 LYS 59 2HD LYS 59 120.053 17.709 2.317 414 HE2 LYS 59 1HE LYS 59 121.546 18.908 0.927 415 HE3 LYS 59 2HE LYS 59 120.889 20.467 1.422 416 HZ1 LYS 59 3HZ LYS 59 122.357 18.592 3.197 417 HZ2 LYS 59 1HZ LYS 59 121.775 20.127 3.625 418 HZ3 LYS 59 2HZ LYS 59 123.022 19.982 2.481 419 H ASN 60 H ASN 60 115.215 16.592 -0.064 420 HA ASN 60 HA ASN 60 113.167 16.372 2.068 421 HB2 ASN 60 1HB ASN 60 112.900 15.677 -0.869 422 HB3 ASN 60 2HB ASN 60 111.676 15.380 0.365 423 HD21 ASN 60 1HD2 ASN 60 111.355 17.143 -1.977 424 HD22 ASN 60 2HD2 ASN 60 111.079 18.704 -1.370 425 H GLN 61 H GLN 61 113.173 14.476 3.149 426 HA GLN 61 HA GLN 61 114.516 12.148 1.904 427 HB2 GLN 61 1HB GLN 61 115.062 13.232 4.678 428 HB3 GLN 61 2HB GLN 61 115.649 11.685 4.067 429 HG2 GLN 61 1HG GLN 61 116.877 12.814 2.286 430 HG3 GLN 61 2HG GLN 61 116.234 14.373 2.795 431 HE21 GLN 61 1HE2 GLN 61 119.055 13.862 2.707 432 HE22 GLN 61 2HE2 GLN 61 119.648 13.884 4.298 433 H TYR 62 H TYR 62 113.686 10.136 2.517 434 HA TYR 62 HA TYR 62 111.844 9.987 4.751 435 HB2 TYR 62 1HB TYR 62 109.914 9.288 3.537 436 HB3 TYR 62 2HB TYR 62 110.436 10.833 2.901 437 HD1 TYR 62 HD1 TYR 62 111.399 10.994 0.642 438 HD2 TYR 62 HD2 TYR 62 110.008 7.254 2.233 439 HE1 TYR 62 HE1 TYR 62 111.399 10.024 -1.640 440 HE2 TYR 62 HE2 TYR 62 110.010 6.283 -0.050 441 HH TYR 62 HH TYR 62 110.692 6.595 -2.177 442 H TYR 63 H TYR 63 111.096 7.818 5.190 443 HA TYR 63 HA TYR 63 112.656 5.679 3.899 444 HB2 TYR 63 1HB TYR 63 113.285 4.727 6.011 445 HB3 TYR 63 2HB TYR 63 113.821 6.394 5.973 446 HD1 TYR 63 HD1 TYR 63 112.644 8.115 7.335 447 HD2 TYR 63 HD2 TYR 63 111.652 3.943 7.583 448 HE1 TYR 63 HE1 TYR 63 111.451 8.526 9.470 449 HE2 TYR 63 HE2 TYR 63 110.458 4.354 9.718 450 HH TYR 63 HH TYR 63 109.270 6.655 10.744 451 H GLY 64 H GLY 64 111.703 3.537 4.218 452 HA2 GLY 64 1HA GLY 64 108.821 3.639 4.868 453 HA3 GLY 64 2HA GLY 64 109.341 3.079 3.285 454 H ILE 65 H ILE 65 108.014 1.834 5.788 455 HA ILE 65 HA ILE 65 109.747 -0.574 5.885 456 HB ILE 65 HB ILE 65 109.518 0.505 8.087 457 HG12 ILE 65 1HG1 ILE 65 107.792 -1.977 8.046 458 HG13 ILE 65 2HG1 ILE 65 109.532 -2.037 7.767 459 HG21 ILE 65 1HG2 ILE 65 107.268 1.542 7.562 460 HG22 ILE 65 2HG2 ILE 65 107.385 0.793 9.154 461 HG23 ILE 65 3HG2 ILE 65 106.551 -0.043 7.845 462 HD11 ILE 65 3HD1 ILE 65 108.411 -0.625 10.181 463 HD12 ILE 65 1HD1 ILE 65 110.033 -1.273 9.937 464 HD13 ILE 65 2HD1 ILE 65 108.677 -2.369 10.197 465 H THR 66 H THR 66 108.902 -2.359 4.977 466 HA THR 66 HA THR 66 105.985 -2.450 4.481 467 HB THR 66 HB THR 66 106.437 -3.367 2.243 468 HG1 THR 66 HG1 THR 66 108.536 -3.348 1.470 469 HG21 THR 66 3HG2 THR 66 107.676 -1.182 1.376 470 HG22 THR 66 1HG2 THR 66 107.393 -0.645 3.031 471 HG23 THR 66 2HG2 THR 66 106.033 -1.106 2.009 472 H ALA 67 H ALA 67 105.148 -4.574 4.044 473 HA ALA 67 HA ALA 67 106.882 -6.871 4.569 474 HB1 ALA 67 1HB ALA 67 105.594 -7.755 6.342 475 HB2 ALA 67 2HB ALA 67 104.272 -6.622 6.061 476 HB3 ALA 67 3HB ALA 67 105.788 -6.053 6.759 477 H GLY 68 H GLY 68 106.095 -8.791 3.604 478 HA2 GLY 68 1HA GLY 68 103.488 -8.681 2.288 479 HA3 GLY 68 2HA GLY 68 104.888 -8.759 1.244 480 HA PRO 69 HA PRO 69 104.159 -13.190 2.812 481 HB2 PRO 69 1HB PRO 69 101.596 -13.674 1.510 482 HB3 PRO 69 2HB PRO 69 102.062 -13.954 3.195 483 HG2 PRO 69 1HG PRO 69 100.293 -12.056 2.402 484 HG3 PRO 69 2HG PRO 69 101.260 -11.959 3.884 485 HD2 PRO 69 1HD PRO 69 101.705 -10.581 1.257 486 HD3 PRO 69 2HD PRO 69 101.957 -9.972 2.911 487 H ALA 70 H ALA 70 104.355 -15.075 1.263 488 HA ALA 70 HA ALA 70 104.190 -14.350 -1.570 489 HB1 ALA 70 1HB ALA 70 106.565 -13.908 -0.478 490 HB2 ALA 70 2HB ALA 70 106.414 -14.610 -2.089 491 HB3 ALA 70 3HB ALA 70 106.732 -15.649 -0.705 492 H TYR 71 H TYR 71 104.069 -16.122 -2.969 493 HA TYR 71 HA TYR 71 103.663 -18.747 -1.656 494 HB2 TYR 71 1HB TYR 71 101.550 -17.538 -2.387 495 HB3 TYR 71 2HB TYR 71 102.118 -17.727 -4.036 496 HD1 TYR 71 HD1 TYR 71 101.057 -19.556 -0.985 497 HD2 TYR 71 HD2 TYR 71 101.880 -19.806 -5.194 498 HE1 TYR 71 HE1 TYR 71 100.044 -21.819 -1.048 499 HE2 TYR 71 HE2 TYR 71 100.868 -22.069 -5.256 500 HH TYR 71 HH TYR 71 99.805 -23.690 -2.295 501 H ARG 72 H ARG 72 104.814 -20.387 -2.532 502 HA ARG 72 HA ARG 72 106.317 -19.821 -5.006 503 HB2 ARG 72 1HB ARG 72 107.573 -20.482 -2.949 504 HB3 ARG 72 2HB ARG 72 106.740 -22.037 -2.992 505 HG2 ARG 72 1HG ARG 72 107.669 -22.513 -5.202 506 HG3 ARG 72 2HG ARG 72 108.437 -20.926 -5.246 507 HD2 ARG 72 1HD ARG 72 110.121 -22.507 -4.588 508 HD3 ARG 72 2HD ARG 72 109.700 -21.572 -3.159 509 HE ARG 72 HE ARG 72 109.087 -24.388 -3.656 510 HH11 ARG 72 1HH1 ARG 72 108.562 -21.599 -1.586 511 HH12 ARG 72 2HH1 ARG 72 108.048 -22.569 -0.248 512 HH21 ARG 72 1HH2 ARG 72 108.415 -25.579 -1.898 513 HH22 ARG 72 2HH2 ARG 72 107.965 -24.791 -0.422 514 H ILE 73 H ILE 73 105.265 -20.487 -6.774 515 HA ILE 73 HA ILE 73 104.329 -23.278 -6.849 516 HB ILE 73 HB ILE 73 102.368 -21.837 -6.478 517 HG12 ILE 73 1HG1 ILE 73 102.355 -22.779 -9.349 518 HG13 ILE 73 2HG1 ILE 73 102.350 -23.908 -7.993 519 HG21 ILE 73 1HG2 ILE 73 101.692 -20.224 -8.215 520 HG22 ILE 73 2HG2 ILE 73 103.190 -20.538 -9.091 521 HG23 ILE 73 3HG2 ILE 73 103.242 -19.776 -7.501 522 HD11 ILE 73 3HD1 ILE 73 100.053 -23.562 -8.574 523 HD12 ILE 73 1HD1 ILE 73 100.271 -21.814 -8.661 524 HD13 ILE 73 2HD1 ILE 73 100.332 -22.633 -7.100 525 H ASN 74 H ASN 74 104.593 -24.319 -8.795 526 HA ASN 74 HA ASN 74 105.329 -24.753 -10.916 527 HB2 ASN 74 1HB ASN 74 104.743 -21.809 -11.266 528 HB3 ASN 74 2HB ASN 74 105.136 -22.910 -12.583 529 HD21 ASN 74 1HD2 ASN 74 102.585 -21.516 -12.321 530 HD22 ASN 74 2HD2 ASN 74 101.388 -22.703 -12.116 531 H ASP 75 H ASP 75 107.401 -25.344 -10.860 532 HA ASP 75 HA ASP 75 109.664 -25.239 -11.179 533 HB2 ASP 75 1HB ASP 75 108.890 -22.622 -12.483 534 HB3 ASP 75 2HB ASP 75 110.467 -23.394 -12.635 535 H TRP 76 H TRP 76 108.853 -24.493 -8.633 536 HA TRP 76 HA TRP 76 109.572 -23.415 -6.733 537 HB2 TRP 76 1HB TRP 76 112.102 -23.522 -8.362 538 HB3 TRP 76 2HB TRP 76 112.052 -23.075 -6.668 539 HD1 TRP 76 HD1 TRP 76 111.997 -26.019 -8.997 540 HE1 TRP 76 HE1 TRP 76 111.990 -28.203 -7.629 541 HE3 TRP 76 HE3 TRP 76 111.164 -24.132 -4.326 542 HZ2 TRP 76 HZ2 TRP 76 111.675 -29.041 -4.909 543 HZ3 TRP 76 HZ3 TRP 76 111.017 -25.640 -2.369 544 HH2 TRP 76 HH2 TRP 76 111.271 -28.089 -2.651 545 H ALA 77 H ALA 77 108.648 -21.620 -9.038 546 HA ALA 77 HA ALA 77 110.154 -19.172 -8.469 547 HB1 ALA 77 1HB ALA 77 107.934 -19.862 -10.395 548 HB2 ALA 77 2HB ALA 77 109.588 -19.377 -10.765 549 HB3 ALA 77 3HB ALA 77 108.448 -18.199 -10.116 550 H SER 78 H SER 78 109.300 -17.423 -7.341 551 HA SER 78 HA SER 78 106.748 -17.945 -5.918 552 HB2 SER 78 1HB SER 78 109.268 -16.713 -4.783 553 HB3 SER 78 2HB SER 78 107.742 -16.916 -3.928 554 HG SER 78 HG SER 78 109.127 -18.643 -3.473 555 H ILE 79 H ILE 79 105.432 -16.207 -5.516 556 HA ILE 79 HA ILE 79 106.303 -13.575 -6.576 557 HB ILE 79 HB ILE 79 103.499 -14.723 -6.711 558 HG12 ILE 79 1HG1 ILE 79 104.144 -14.434 -9.283 559 HG13 ILE 79 2HG1 ILE 79 105.779 -14.663 -8.665 560 HG21 ILE 79 1HG2 ILE 79 104.745 -12.169 -7.767 561 HG22 ILE 79 2HG2 ILE 79 103.532 -12.297 -6.493 562 HG23 ILE 79 3HG2 ILE 79 103.115 -12.719 -8.154 563 HD11 ILE 79 3HD1 ILE 79 103.619 -16.549 -7.787 564 HD12 ILE 79 1HD1 ILE 79 105.352 -16.835 -7.956 565 HD13 ILE 79 2HD1 ILE 79 104.329 -16.746 -9.390 566 H TYR 80 H TYR 80 105.460 -11.754 -5.411 567 HA TYR 80 HA TYR 80 104.109 -12.346 -2.878 568 HB2 TYR 80 1HB TYR 80 105.778 -11.272 -1.533 569 HB3 TYR 80 2HB TYR 80 106.539 -12.551 -2.456 570 HD1 TYR 80 HD1 TYR 80 106.248 -8.923 -1.964 571 HD2 TYR 80 HD2 TYR 80 108.135 -12.037 -4.243 572 HE1 TYR 80 HE1 TYR 80 107.909 -7.291 -2.818 573 HE2 TYR 80 HE2 TYR 80 109.795 -10.405 -5.098 574 HH TYR 80 HH TYR 80 110.280 -7.393 -3.735 575 H GLY 81 H GLY 81 103.307 -10.478 -1.792 576 HA2 GLY 81 1HA GLY 81 103.335 -7.969 -3.377 577 HA3 GLY 81 2HA GLY 81 101.818 -8.602 -2.733 578 H VAL 82 H VAL 82 103.263 -6.070 -2.111 579 HA VAL 82 HA VAL 82 103.611 -6.457 0.795 580 HB VAL 82 HB VAL 82 105.580 -4.947 0.734 581 HG11 VAL 82 1HG1 VAL 82 106.228 -7.181 0.905 582 HG12 VAL 82 2HG1 VAL 82 107.093 -6.660 -0.539 583 HG13 VAL 82 3HG1 VAL 82 105.607 -7.593 -0.692 584 HG21 VAL 82 3HG2 VAL 82 106.661 -4.429 -1.371 585 HG22 VAL 82 1HG2 VAL 82 104.983 -3.895 -1.469 586 HG23 VAL 82 2HG2 VAL 82 105.481 -5.389 -2.263 587 H VAL 83 H VAL 83 103.123 -4.733 2.062 588 HA VAL 83 HA VAL 83 102.446 -2.164 0.786 589 HB VAL 83 HB VAL 83 100.795 -3.487 2.961 590 HG11 VAL 83 1HG1 VAL 83 100.504 -0.872 1.452 591 HG12 VAL 83 2HG1 VAL 83 100.837 -1.061 3.174 592 HG13 VAL 83 3HG1 VAL 83 99.274 -1.549 2.520 593 HG21 VAL 83 3HG2 VAL 83 100.297 -4.607 0.902 594 HG22 VAL 83 1HG2 VAL 83 100.335 -3.096 -0.006 595 HG23 VAL 83 2HG2 VAL 83 99.019 -3.414 1.125 596 H GLY 84 H GLY 84 102.808 -0.337 2.238 597 HA2 GLY 84 1HA GLY 84 103.807 -0.801 4.901 598 HA3 GLY 84 2HA GLY 84 105.090 -0.429 3.758 599 H VAL 85 H VAL 85 105.178 1.328 5.505 600 HA VAL 85 HA VAL 85 103.522 3.638 4.657 601 HB VAL 85 HB VAL 85 104.439 3.033 7.483 602 HG11 VAL 85 1HG1 VAL 85 102.846 4.942 7.984 603 HG12 VAL 85 2HG1 VAL 85 102.789 5.255 6.249 604 HG13 VAL 85 3HG1 VAL 85 104.312 5.411 7.125 605 HG21 VAL 85 3HG2 VAL 85 101.643 2.978 6.306 606 HG22 VAL 85 1HG2 VAL 85 102.091 2.599 7.969 607 HG23 VAL 85 2HG2 VAL 85 102.601 1.540 6.654 608 H GLY 86 H GLY 86 104.627 5.496 4.290 609 HA2 GLY 86 1HA GLY 86 107.550 5.458 4.807 610 HA3 GLY 86 2HA GLY 86 106.835 6.138 3.348 611 H TYR 87 H TYR 87 108.393 7.191 5.838 612 HA TYR 87 HA TYR 87 106.617 9.512 6.345 613 HB2 TYR 87 1HB TYR 87 108.721 8.335 8.169 614 HB3 TYR 87 2HB TYR 87 107.755 9.760 8.503 615 HD1 TYR 87 HD1 TYR 87 105.262 9.516 8.815 616 HD2 TYR 87 HD2 TYR 87 107.906 6.141 8.570 617 HE1 TYR 87 HE1 TYR 87 103.516 8.076 9.829 618 HE2 TYR 87 HE2 TYR 87 106.161 4.700 9.585 619 HH TYR 87 HH TYR 87 103.299 6.007 11.006 620 H GLY 88 H GLY 88 107.451 11.486 5.888 621 HA2 GLY 88 1HA GLY 88 110.318 11.697 5.254 622 HA3 GLY 88 2HA GLY 88 109.142 12.113 4.013 623 H LYS 89 H LYS 89 111.060 13.887 4.998 624 HA LYS 89 HA LYS 89 109.323 15.949 6.177 625 HB2 LYS 89 1HB LYS 89 111.074 16.690 7.668 626 HB3 LYS 89 2HB LYS 89 110.767 14.981 7.957 627 HG2 LYS 89 1HG LYS 89 112.714 14.432 6.481 628 HG3 LYS 89 2HG LYS 89 113.053 16.158 6.348 629 HD2 LYS 89 1HD LYS 89 113.140 16.208 8.896 630 HD3 LYS 89 2HD LYS 89 113.138 14.444 8.838 631 HE2 LYS 89 1HE LYS 89 115.235 14.338 7.824 632 HE3 LYS 89 2HE LYS 89 115.110 15.968 7.162 633 HZ1 LYS 89 3HZ LYS 89 115.512 15.232 10.010 634 HZ2 LYS 89 1HZ LYS 89 115.240 16.814 9.460 635 HZ3 LYS 89 2HZ LYS 89 116.639 15.980 8.981 636 H PHE 90 H PHE 90 109.576 17.969 5.374 637 HA PHE 90 HA PHE 90 111.462 18.279 3.117 638 HB2 PHE 90 1HB PHE 90 108.896 19.754 3.735 639 HB3 PHE 90 2HB PHE 90 109.929 20.047 2.348 640 HD1 PHE 90 HD1 PHE 90 107.554 17.701 3.922 641 HD2 PHE 90 HD2 PHE 90 109.927 18.548 0.443 642 HE1 PHE 90 HE1 PHE 90 106.311 15.971 2.652 643 HE2 PHE 90 HE2 PHE 90 108.685 16.816 -0.826 644 HZ PHE 90 HZ PHE 90 106.877 15.527 0.279 645 H GLN 91 H GLN 91 112.829 20.055 3.053 646 HA GLN 91 HA GLN 91 113.081 21.517 5.604 647 HB2 GLN 91 1HB GLN 91 115.080 21.153 3.363 648 HB3 GLN 91 2HB GLN 91 115.382 21.974 4.892 649 HG2 GLN 91 1HG GLN 91 114.630 19.055 4.566 650 HG3 GLN 91 2HG GLN 91 116.232 19.667 4.962 651 HE21 GLN 91 1HE2 GLN 91 113.824 18.124 6.457 652 HE22 GLN 91 2HE2 GLN 91 113.865 18.856 7.988 653 H THR 92 H THR 92 112.311 23.490 5.675 654 HA THR 92 HA THR 92 112.796 25.306 3.404 655 HB THR 92 HB THR 92 110.605 26.340 3.713 656 HG1 THR 92 HG1 THR 92 109.916 26.050 5.686 657 HG21 THR 92 3HG2 THR 92 110.300 23.335 3.476 658 HG22 THR 92 1HG2 THR 92 110.844 24.384 2.167 659 HG23 THR 92 2HG2 THR 92 109.217 24.561 2.820 660 H THR 93 H THR 93 112.578 27.665 4.178 661 HA THR 93 HA THR 93 113.821 27.856 6.844 662 HB THR 93 HB THR 93 113.577 29.978 4.699 663 HG1 THR 93 HG1 THR 93 115.768 28.315 5.382 664 HG21 THR 93 3HG2 THR 93 115.400 29.786 7.111 665 HG22 THR 93 1HG2 THR 93 113.922 30.749 7.059 666 HG23 THR 93 2HG2 THR 93 115.268 31.142 5.991 667 H GLU 94 H GLU 94 112.751 28.576 8.505 668 HA GLU 94 HA GLU 94 110.871 30.612 8.708 669 HB2 GLU 94 1HB GLU 94 109.451 29.058 7.279 670 HB3 GLU 94 2HB GLU 94 109.524 27.896 8.598 671 HG2 GLU 94 1HG GLU 94 108.521 29.585 10.112 672 HG3 GLU 94 2HG GLU 94 108.403 30.705 8.762 673 H TYR 95 H TYR 95 110.291 30.877 10.938 674 HA TYR 95 HA TYR 95 111.635 29.135 12.810 675 HB2 TYR 95 1HB TYR 95 109.867 31.545 13.055 676 HB3 TYR 95 2HB TYR 95 110.273 30.591 14.468 677 HD1 TYR 95 HD1 TYR 95 112.916 30.038 14.641 678 HD2 TYR 95 HD2 TYR 95 111.179 33.388 12.589 679 HE1 TYR 95 HE1 TYR 95 115.059 31.270 14.841 680 HE2 TYR 95 HE2 TYR 95 113.322 34.620 12.788 681 HH TYR 95 HH TYR 95 115.566 34.345 13.219 682 HA PRO 96 HA PRO 96 107.860 26.604 12.576 683 HB2 PRO 96 1HB PRO 96 108.615 24.466 14.061 684 HB3 PRO 96 2HB PRO 96 109.206 24.739 12.409 685 HG2 PRO 96 1HG PRO 96 110.555 25.254 15.008 686 HG3 PRO 96 2HG PRO 96 111.223 24.624 13.491 687 HD2 PRO 96 1HD PRO 96 111.501 27.238 14.304 688 HD3 PRO 96 2HD PRO 96 111.558 26.716 12.608 689 H THR 97 H THR 97 106.017 26.864 13.731 690 HA THR 97 HA THR 97 106.195 26.584 16.683 691 HB THR 97 HB THR 97 103.989 27.909 15.079 692 HG1 THR 97 HG1 THR 97 105.773 29.218 16.806 693 HG21 THR 97 3HG2 THR 97 103.143 28.601 17.237 694 HG22 THR 97 1HG2 THR 97 104.548 27.918 18.056 695 HG23 THR 97 2HG2 THR 97 103.377 26.853 17.279 696 H TYR 98 H TYR 98 105.493 24.634 17.358 697 HA TYR 98 HA TYR 98 103.073 23.490 16.284 698 HB2 TYR 98 1HB TYR 98 105.003 22.855 14.693 699 HB3 TYR 98 2HB TYR 98 105.539 21.804 15.991 700 HD1 TYR 98 HD1 TYR 98 102.891 22.457 13.514 701 HD2 TYR 98 HD2 TYR 98 104.310 19.784 16.561 702 HE1 TYR 98 HE1 TYR 98 101.284 20.731 12.746 703 HE2 TYR 98 HE2 TYR 98 102.703 18.058 15.794 704 HH TYR 98 HH TYR 98 101.392 17.856 13.055 705 H LYS 99 H LYS 99 102.396 21.561 17.447 706 HA LYS 99 HA LYS 99 103.759 21.219 20.056 707 HB2 LYS 99 1HB LYS 99 100.928 20.463 19.283 708 HB3 LYS 99 2HB LYS 99 101.642 20.347 20.890 709 HG2 LYS 99 1HG LYS 99 101.299 22.929 19.336 710 HG3 LYS 99 2HG LYS 99 100.229 22.381 20.626 711 HD2 LYS 99 1HD LYS 99 102.226 22.314 22.157 712 HD3 LYS 99 2HD LYS 99 103.172 23.062 20.869 713 HE2 LYS 99 1HE LYS 99 100.600 24.295 21.858 714 HE3 LYS 99 2HE LYS 99 102.149 24.643 22.625 715 HZ1 LYS 99 3HZ LYS 99 101.894 24.869 19.705 716 HZ2 LYS 99 1HZ LYS 99 102.946 25.683 20.758 717 HZ3 LYS 99 2HZ LYS 99 101.305 26.120 20.692 718 H HIS 100 H HIS 100 104.892 19.404 20.294 719 HA HIS 100 HA HIS 100 105.718 17.291 19.972 720 HB2 HIS 100 1HB HIS 100 102.992 16.623 18.866 721 HB3 HIS 100 2HB HIS 100 104.176 15.512 19.525 722 HD1 HIS 100 HD1 HIS 100 104.739 16.002 22.196 723 HD2 HIS 100 HD2 HIS 100 101.118 17.436 20.706 724 HE1 HIS 100 HE1 HIS 100 103.265 16.444 24.205 725 H ASP 101 H ASP 101 107.167 16.831 18.444 726 HA ASP 101 HA ASP 101 107.129 17.919 15.872 727 HB2 ASP 101 1HB ASP 101 108.633 15.504 16.901 728 HB3 ASP 101 2HB ASP 101 108.974 16.329 15.383 729 H THR 102 H THR 102 106.343 17.284 13.948 730 HA THR 102 HA THR 102 105.116 14.604 13.732 731 HB THR 102 HB THR 102 103.853 17.177 12.760 732 HG1 THR 102 HG1 THR 102 103.465 15.562 15.039 733 HG21 THR 102 3HG2 THR 102 102.950 14.287 12.792 734 HG22 THR 102 1HG2 THR 102 103.233 15.297 11.374 735 HG23 THR 102 2HG2 THR 102 101.880 15.645 12.451 736 H SER 103 H SER 103 104.979 13.759 11.632 737 HA SER 103 HA SER 103 106.515 15.178 9.543 738 HB2 SER 103 1HB SER 103 107.594 13.101 8.912 739 HB3 SER 103 2HB SER 103 107.891 13.395 10.622 740 HG SER 103 HG SER 103 106.419 11.856 11.139 741 H ASP 104 H ASP 104 106.120 14.058 7.331 742 HA ASP 104 HA ASP 104 103.200 13.750 7.099 743 HB2 ASP 104 1HB ASP 104 103.575 14.170 4.693 744 HB3 ASP 104 2HB ASP 104 104.223 15.471 5.689 745 H TYR 105 H TYR 105 102.269 11.932 6.123 746 HA TYR 105 HA TYR 105 104.112 9.657 5.675 747 HB2 TYR 105 1HB TYR 105 102.655 8.201 6.872 748 HB3 TYR 105 2HB TYR 105 103.027 9.568 7.901 749 HD1 TYR 105 HD1 TYR 105 100.422 7.839 5.969 750 HD2 TYR 105 HD2 TYR 105 101.301 11.201 8.494 751 HE1 TYR 105 HE1 TYR 105 97.995 8.223 6.302 752 HE2 TYR 105 HE2 TYR 105 98.874 11.585 8.827 753 HH TYR 105 HH TYR 105 96.457 9.369 7.447 754 H GLY 106 H GLY 106 103.495 8.094 4.217 755 HA2 GLY 106 1HA GLY 106 101.008 8.485 2.695 756 HA3 GLY 106 2HA GLY 106 102.537 8.463 1.819 757 H PHE 107 H PHE 107 100.792 6.588 1.067 758 HA PHE 107 HA PHE 107 101.541 4.104 2.515 759 HB2 PHE 107 1HB PHE 107 99.089 4.685 0.851 760 HB3 PHE 107 2HB PHE 107 99.475 3.135 1.574 761 HD1 PHE 107 HD2 PHE 107 99.268 2.788 3.988 762 HD2 PHE 107 HD1 PHE 107 98.327 6.572 2.189 763 HE1 PHE 107 HE2 PHE 107 98.119 3.492 6.070 764 HE2 PHE 107 HE1 PHE 107 97.178 7.277 4.270 765 HZ PHE 107 HZ PHE 107 97.072 5.735 6.211 766 H SER 108 H SER 108 102.379 2.385 1.342 767 HA SER 108 HA SER 108 102.652 2.772 -1.584 768 HB2 SER 108 1HB SER 108 104.841 1.877 0.308 769 HB3 SER 108 2HB SER 108 104.963 1.954 -1.447 770 HG SER 108 HG SER 108 105.509 3.958 -1.130 771 H TYR 109 H TYR 109 102.597 0.918 -2.815 772 HA TYR 109 HA TYR 109 102.682 -1.690 -1.534 773 HB2 TYR 109 1HB TYR 109 100.511 -2.408 -2.239 774 HB3 TYR 109 2HB TYR 109 100.326 -0.951 -1.284 775 HD1 TYR 109 HD1 TYR 109 99.743 1.203 -2.393 776 HD2 TYR 109 HD2 TYR 109 99.894 -2.507 -4.554 777 HE1 TYR 109 HE1 TYR 109 98.452 2.229 -4.246 778 HE2 TYR 109 HE2 TYR 109 98.604 -1.479 -6.406 779 HH TYR 109 HH TYR 109 97.507 1.911 -6.224 780 H GLY 110 H GLY 110 102.723 -3.461 -3.104 781 HA2 GLY 110 1HA GLY 110 102.632 -3.121 -5.894 782 HA3 GLY 110 2HA GLY 110 104.303 -2.911 -5.384 783 H ALA 111 H ALA 111 104.248 -4.894 -6.956 784 HA ALA 111 HA ALA 111 104.347 -7.286 -5.251 785 HB1 ALA 111 1HB ALA 111 102.897 -7.126 -7.905 786 HB2 ALA 111 2HB ALA 111 102.173 -7.438 -6.327 787 HB3 ALA 111 3HB ALA 111 103.259 -8.625 -7.050 788 H GLY 112 H GLY 112 105.683 -9.001 -6.164 789 HA2 GLY 112 1HA GLY 112 107.394 -8.256 -8.418 790 HA3 GLY 112 2HA GLY 112 108.183 -8.410 -6.853 791 H LEU 113 H LEU 113 108.926 -9.999 -8.980 792 HA LEU 113 HA LEU 113 108.019 -12.673 -8.097 793 HB2 LEU 113 1HB LEU 113 108.690 -11.876 -10.942 794 HB3 LEU 113 2HB LEU 113 108.219 -13.482 -10.390 795 HG LEU 113 HG LEU 113 106.110 -12.162 -9.434 796 HD11 LEU 113 1HD1 LEU 113 106.551 -9.934 -9.989 797 HD12 LEU 113 2HD1 LEU 113 105.552 -10.446 -11.347 798 HD13 LEU 113 3HD1 LEU 113 107.305 -10.363 -11.523 799 HD21 LEU 113 3HD2 LEU 113 106.157 -13.990 -11.175 800 HD22 LEU 113 1HD2 LEU 113 106.363 -12.738 -12.400 801 HD23 LEU 113 2HD2 LEU 113 104.892 -12.788 -11.430 802 H GLN 114 H GLN 114 109.637 -14.287 -8.077 803 HA GLN 114 HA GLN 114 112.405 -13.240 -8.282 804 HB2 GLN 114 1HB GLN 114 111.269 -15.447 -6.549 805 HB3 GLN 114 2HB GLN 114 112.981 -15.029 -6.655 806 HG2 GLN 114 1HG GLN 114 112.510 -12.762 -5.869 807 HG3 GLN 114 2HG GLN 114 110.783 -13.108 -5.835 808 HE21 GLN 114 1HE2 GLN 114 112.171 -12.276 -3.484 809 HE22 GLN 114 2HE2 GLN 114 112.195 -13.571 -2.388 810 H PHE 115 H PHE 115 113.873 -14.306 -9.497 811 HA PHE 115 HA PHE 115 112.971 -16.742 -10.927 812 HB2 PHE 115 1HB PHE 115 114.589 -14.432 -12.010 813 HB3 PHE 115 2HB PHE 115 114.246 -15.918 -12.874 814 HD1 PHE 115 HD1 PHE 115 111.921 -16.435 -13.602 815 HD2 PHE 115 HD2 PHE 115 112.965 -12.682 -11.793 816 HE1 PHE 115 HE1 PHE 115 109.804 -15.444 -14.435 817 HE2 PHE 115 HE2 PHE 115 110.849 -11.692 -12.625 818 HZ PHE 115 HZ PHE 115 109.269 -13.072 -13.946 819 H ASN 116 H ASN 116 114.661 -18.155 -11.625 820 HA ASN 116 HA ASN 116 116.552 -19.395 -11.341 821 HB2 ASN 116 1HB ASN 116 117.848 -16.883 -10.260 822 HB3 ASN 116 2HB ASN 116 118.653 -18.308 -10.906 823 HD21 ASN 116 1HD2 ASN 116 117.821 -18.849 -13.296 824 HD22 ASN 116 2HD2 ASN 116 117.710 -17.507 -14.329 825 HA PRO 117 HA PRO 117 115.794 -19.734 -6.805 826 HB2 PRO 117 1HB PRO 117 114.222 -21.924 -6.731 827 HB3 PRO 117 2HB PRO 117 113.565 -20.314 -7.084 828 HG2 PRO 117 1HG PRO 117 114.074 -22.580 -8.904 829 HG3 PRO 117 2HG PRO 117 112.846 -21.307 -8.991 830 HD2 PRO 117 1HD PRO 117 115.280 -21.395 -10.438 831 HD3 PRO 117 2HD PRO 117 114.159 -20.022 -10.327 832 H MET 118 H MET 118 116.095 -22.615 -8.915 833 HA MET 118 HA MET 118 117.431 -24.273 -7.107 834 HB2 MET 118 1HB MET 118 116.451 -24.905 -9.361 835 HB3 MET 118 2HB MET 118 117.919 -24.249 -10.088 836 HG2 MET 118 1HG MET 118 119.252 -25.784 -8.603 837 HG3 MET 118 2HG MET 118 117.733 -26.525 -8.096 838 HE1 MET 118 3HE MET 118 116.049 -27.510 -9.556 839 HE2 MET 118 1HE MET 118 116.250 -28.053 -11.227 840 HE3 MET 118 2HE MET 118 116.015 -26.343 -10.877 841 H GLU 119 H GLU 119 118.715 -21.871 -9.371 842 HA GLU 119 HA GLU 119 121.455 -22.388 -9.004 843 HB2 GLU 119 1HB GLU 119 120.055 -19.770 -9.602 844 HB3 GLU 119 2HB GLU 119 121.784 -20.064 -9.789 845 HG2 GLU 119 1HG GLU 119 121.270 -21.906 -11.381 846 HG3 GLU 119 2HG GLU 119 119.560 -21.521 -11.242 847 H ASN 120 H ASN 120 123.004 -20.987 -7.819 848 HA ASN 120 HA ASN 120 122.146 -20.691 -5.073 849 HB2 ASN 120 1HB ASN 120 124.480 -20.246 -4.596 850 HB3 ASN 120 2HB ASN 120 124.343 -21.641 -5.661 851 HD21 ASN 120 1HD2 ASN 120 126.747 -20.060 -5.493 852 HD22 ASN 120 2HD2 ASN 120 126.971 -19.292 -6.990 853 H VAL 121 H VAL 121 121.791 -18.613 -7.626 854 HA VAL 121 HA VAL 121 121.695 -16.321 -5.769 855 HB VAL 121 HB VAL 121 122.395 -14.839 -7.625 856 HG11 VAL 121 1HG1 VAL 121 124.450 -17.026 -7.282 857 HG12 VAL 121 2HG1 VAL 121 124.008 -15.955 -5.954 858 HG13 VAL 121 3HG1 VAL 121 124.718 -15.289 -7.424 859 HG21 VAL 121 3HG2 VAL 121 121.692 -16.266 -9.504 860 HG22 VAL 121 1HG2 VAL 121 122.908 -17.464 -9.063 861 HG23 VAL 121 2HG2 VAL 121 123.406 -15.875 -9.644 862 H ALA 122 H ALA 122 119.996 -14.831 -6.198 863 HA ALA 122 HA ALA 122 118.023 -15.673 -8.233 864 HB1 ALA 122 1HB ALA 122 116.227 -15.203 -6.528 865 HB2 ALA 122 2HB ALA 122 117.495 -15.147 -5.303 866 HB3 ALA 122 3HB ALA 122 117.197 -16.638 -6.197 867 H LEU 123 H LEU 123 116.660 -14.032 -8.987 868 HA LEU 123 HA LEU 123 117.531 -11.272 -8.320 869 HB2 LEU 123 1HB LEU 123 116.515 -12.302 -10.983 870 HB3 LEU 123 2HB LEU 123 117.046 -10.658 -10.632 871 HG LEU 123 HG LEU 123 118.801 -13.122 -10.407 872 HD11 LEU 123 1HD1 LEU 123 118.419 -12.788 -12.730 873 HD12 LEU 123 2HD1 LEU 123 119.946 -11.968 -12.404 874 HD13 LEU 123 3HD1 LEU 123 118.459 -11.034 -12.564 875 HD21 LEU 123 3HD2 LEU 123 120.573 -11.217 -10.421 876 HD22 LEU 123 1HD2 LEU 123 119.676 -11.499 -8.929 877 HD23 LEU 123 2HD2 LEU 123 119.226 -10.163 -9.988 878 H ASP 124 H ASP 124 115.906 -9.707 -8.087 879 HA ASP 124 HA ASP 124 113.120 -10.724 -8.160 880 HB2 ASP 124 1HB ASP 124 112.646 -9.516 -6.101 881 HB3 ASP 124 2HB ASP 124 113.946 -10.671 -5.834 882 H PHE 125 H PHE 125 111.750 -9.487 -9.252 883 HA PHE 125 HA PHE 125 112.444 -6.639 -9.706 884 HB2 PHE 125 1HB PHE 125 111.200 -8.571 -11.671 885 HB3 PHE 125 2HB PHE 125 111.398 -6.849 -11.935 886 HD1 PHE 125 HD2 PHE 125 113.607 -5.891 -12.388 887 HD2 PHE 125 HD1 PHE 125 113.090 -10.105 -11.737 888 HE1 PHE 125 HE2 PHE 125 115.876 -6.309 -13.297 889 HE2 PHE 125 HE1 PHE 125 115.359 -10.524 -12.646 890 HZ PHE 125 HZ PHE 125 116.752 -8.626 -13.426 891 H SER 126 H SER 126 110.849 -5.246 -9.156 892 HA SER 126 HA SER 126 108.085 -6.229 -9.010 893 HB2 SER 126 1HB SER 126 107.770 -5.442 -6.751 894 HB3 SER 126 2HB SER 126 109.143 -6.544 -6.764 895 HG SER 126 HG SER 126 109.269 -4.313 -5.706 896 H TYR 127 H TYR 127 106.500 -4.566 -8.939 897 HA TYR 127 HA TYR 127 107.480 -1.901 -9.789 898 HB2 TYR 127 1HB TYR 127 104.808 -3.218 -10.305 899 HB3 TYR 127 2HB TYR 127 105.285 -1.622 -10.852 900 HD1 TYR 127 HD1 TYR 127 105.681 -5.243 -11.338 901 HD2 TYR 127 HD2 TYR 127 106.866 -1.345 -12.699 902 HE1 TYR 127 HE1 TYR 127 106.615 -6.248 -13.405 903 HE2 TYR 127 HE2 TYR 127 107.801 -2.350 -14.764 904 HH TYR 127 HH TYR 127 107.267 -4.609 -16.111 905 H GLU 128 H GLU 128 107.101 -0.249 -8.433 906 HA GLU 128 HA GLU 128 105.164 -0.673 -6.224 907 HB2 GLU 128 1HB GLU 128 107.822 0.767 -6.163 908 HB3 GLU 128 2HB GLU 128 106.677 0.688 -4.825 909 HG2 GLU 128 1HG GLU 128 107.972 -1.706 -6.157 910 HG3 GLU 128 2HG GLU 128 108.469 -1.017 -4.618 911 H GLN 129 H GLN 129 103.729 0.878 -5.826 912 HA GLN 129 HA GLN 129 104.110 3.546 -7.047 913 HB2 GLN 129 1HB GLN 129 101.536 1.958 -6.835 914 HB3 GLN 129 2HB GLN 129 101.640 3.642 -7.349 915 HG2 GLN 129 1HG GLN 129 103.056 3.015 -9.239 916 HG3 GLN 129 2HG GLN 129 103.058 1.335 -8.709 917 HE21 GLN 129 1HE2 GLN 129 102.090 2.096 -11.299 918 HE22 GLN 129 2HE2 GLN 129 100.419 1.803 -11.348 919 H SER 130 H SER 130 103.557 5.279 -5.726 920 HA SER 130 HA SER 130 102.489 4.644 -3.046 921 HB2 SER 130 1HB SER 130 104.968 4.704 -2.919 922 HB3 SER 130 2HB SER 130 104.938 6.346 -3.555 923 HG SER 130 HG SER 130 104.881 5.824 -1.109 924 H ARG 131 H ARG 131 101.291 6.218 -2.100 925 HA ARG 131 HA ARG 131 100.857 8.714 -3.639 926 HB2 ARG 131 1HB ARG 131 98.888 7.182 -3.612 927 HB3 ARG 131 2HB ARG 131 98.892 7.253 -1.851 928 HG2 ARG 131 1HG ARG 131 97.292 8.870 -2.510 929 HG3 ARG 131 2HG ARG 131 98.733 9.811 -2.126 930 HD2 ARG 131 1HD ARG 131 99.335 9.835 -4.536 931 HD3 ARG 131 2HD ARG 131 97.857 8.947 -4.896 932 HE ARG 131 HE ARG 131 98.082 11.750 -4.396 933 HH11 ARG 131 1HH1 ARG 131 95.910 9.034 -3.906 934 HH12 ARG 131 2HH1 ARG 131 94.502 10.041 -3.856 935 HH21 ARG 131 1HH2 ARG 131 96.233 12.994 -4.321 936 HH22 ARG 131 2HH2 ARG 131 94.684 12.256 -4.088 937 H ILE 132 H ILE 132 101.540 10.477 -2.612 938 HA ILE 132 HA ILE 132 101.722 10.453 0.339 939 HB ILE 132 HB ILE 132 103.834 11.540 -1.553 940 HG12 ILE 132 1HG1 ILE 132 103.986 9.183 0.352 941 HG13 ILE 132 2HG1 ILE 132 103.758 9.032 -1.391 942 HG21 ILE 132 1HG2 ILE 132 105.092 12.018 0.474 943 HG22 ILE 132 2HG2 ILE 132 103.830 11.292 1.469 944 HG23 ILE 132 3HG2 ILE 132 103.511 12.789 0.593 945 HD11 ILE 132 3HD1 ILE 132 106.131 8.774 -0.846 946 HD12 ILE 132 1HD1 ILE 132 106.126 10.326 -0.006 947 HD13 ILE 132 2HD1 ILE 132 105.886 10.267 -1.753 948 H ARG 133 H ARG 133 100.031 11.809 0.663 949 HA ARG 133 HA ARG 133 98.307 13.196 -0.196 950 HB2 ARG 133 1HB ARG 133 99.411 14.066 1.848 951 HB3 ARG 133 2HB ARG 133 100.452 15.055 0.828 952 HG2 ARG 133 1HG ARG 133 98.441 16.158 -0.125 953 HG3 ARG 133 2HG ARG 133 97.425 15.205 0.958 954 HD2 ARG 133 1HD ARG 133 98.663 16.175 2.899 955 HD3 ARG 133 2HD ARG 133 99.551 17.201 1.778 956 HE ARG 133 HE ARG 133 96.644 17.377 1.640 957 HH11 ARG 133 1HH1 ARG 133 99.594 18.773 2.931 958 HH12 ARG 133 2HH1 ARG 133 98.852 20.308 3.236 959 HH21 ARG 133 1HH2 ARG 133 95.743 19.377 2.057 960 HH22 ARG 133 2HH2 ARG 133 96.702 20.644 2.747 961 H SER 134 H SER 134 98.250 13.046 -2.482 962 HA SER 134 HA SER 134 97.737 14.242 -4.377 963 HB2 SER 134 1HB SER 134 97.537 16.267 -2.920 964 HB3 SER 134 2HB SER 134 99.242 16.586 -3.221 965 HG SER 134 HG SER 134 97.208 17.273 -4.713 966 H VAL 135 H VAL 135 100.913 13.570 -3.316 967 HA VAL 135 HA VAL 135 102.017 14.205 -5.974 968 HB VAL 135 HB VAL 135 103.444 13.290 -3.460 969 HG11 VAL 135 1HG1 VAL 135 104.577 14.542 -5.975 970 HG12 VAL 135 2HG1 VAL 135 104.525 12.800 -5.708 971 HG13 VAL 135 3HG1 VAL 135 105.471 13.828 -4.634 972 HG21 VAL 135 3HG2 VAL 135 103.268 16.054 -4.702 973 HG22 VAL 135 1HG2 VAL 135 104.164 15.619 -3.248 974 HG23 VAL 135 2HG2 VAL 135 102.402 15.549 -3.251 975 H ASP 136 H ASP 136 102.520 12.623 -7.384 976 HA ASP 136 HA ASP 136 101.882 9.849 -6.570 977 HB2 ASP 136 1HB ASP 136 100.556 10.823 -8.437 978 HB3 ASP 136 2HB ASP 136 102.048 11.021 -9.355 979 H VAL 137 H VAL 137 103.548 8.470 -6.315 980 HA VAL 137 HA VAL 137 106.115 9.122 -7.661 981 HB VAL 137 HB VAL 137 105.679 7.591 -5.081 982 HG11 VAL 137 1HG1 VAL 137 108.100 7.693 -4.870 983 HG12 VAL 137 2HG1 VAL 137 108.224 8.644 -6.351 984 HG13 VAL 137 3HG1 VAL 137 107.698 6.962 -6.423 985 HG21 VAL 137 3HG2 VAL 137 106.851 9.645 -4.113 986 HG22 VAL 137 1HG2 VAL 137 105.183 9.891 -4.633 987 HG23 VAL 137 2HG2 VAL 137 106.516 10.445 -5.648 988 H GLY 138 H GLY 138 106.781 7.720 -9.146 989 HA2 GLY 138 1HA GLY 138 105.790 4.922 -9.027 990 HA3 GLY 138 2HA GLY 138 106.024 5.794 -10.542 991 H THR 139 H THR 139 107.419 3.507 -8.636 992 HA THR 139 HA THR 139 110.125 4.177 -9.623 993 HB THR 139 HB THR 139 109.984 4.813 -7.256 994 HG1 THR 139 HG1 THR 139 111.788 3.671 -6.650 995 HG21 THR 139 3HG2 THR 139 109.615 1.925 -6.524 996 HG22 THR 139 1HG2 THR 139 108.204 2.934 -6.839 997 HG23 THR 139 2HG2 THR 139 109.328 3.367 -5.550 998 H TRP 140 H TRP 140 111.352 2.518 -10.314 999 HA TRP 140 HA TRP 140 110.220 -0.214 -10.131 1000 HB2 TRP 140 1HB TRP 140 112.094 0.997 -12.171 1001 HB3 TRP 140 2HB TRP 140 111.639 -0.696 -12.118 1002 HD1 TRP 140 HD1 TRP 140 108.931 -1.180 -12.458 1003 HE1 TRP 140 HE1 TRP 140 107.273 0.027 -14.019 1004 HE3 TRP 140 HE3 TRP 140 111.495 3.158 -13.284 1005 HZ2 TRP 140 HZ2 TRP 140 107.061 2.509 -15.433 1006 HZ3 TRP 140 HZ3 TRP 140 110.546 4.921 -14.738 1007 HH2 TRP 140 HH2 TRP 140 108.336 4.606 -15.813 1008 H ILE 141 H ILE 141 111.427 -1.755 -9.131 1009 HA ILE 141 HA ILE 141 114.174 -1.014 -8.295 1010 HB ILE 141 HB ILE 141 112.588 -0.740 -6.432 1011 HG12 ILE 141 1HG1 ILE 141 114.267 -3.228 -6.023 1012 HG13 ILE 141 2HG1 ILE 141 114.948 -1.602 -6.092 1013 HG21 ILE 141 1HG2 ILE 141 111.384 -2.663 -5.532 1014 HG22 ILE 141 2HG2 ILE 141 112.050 -3.701 -6.793 1015 HG23 ILE 141 3HG2 ILE 141 110.922 -2.412 -7.216 1016 HD11 ILE 141 3HD1 ILE 141 114.614 -1.959 -3.786 1017 HD12 ILE 141 1HD1 ILE 141 113.065 -2.760 -4.044 1018 HD13 ILE 141 2HD1 ILE 141 113.205 -1.016 -4.267 1019 H ALA 142 H ALA 142 115.700 -2.522 -8.492 1020 HA ALA 142 HA ALA 142 114.895 -5.334 -8.923 1021 HB1 ALA 142 1HB ALA 142 116.770 -3.677 -10.611 1022 HB2 ALA 142 2HB ALA 142 115.396 -4.649 -11.136 1023 HB3 ALA 142 3HB ALA 142 116.867 -5.438 -10.568 1024 H GLY 143 H GLY 143 116.256 -6.844 -7.958 1025 HA2 GLY 143 1HA GLY 143 118.761 -5.905 -6.762 1026 HA3 GLY 143 2HA GLY 143 117.504 -6.425 -5.649 1027 H VAL 144 H VAL 144 119.700 -7.757 -5.367 1028 HA VAL 144 HA VAL 144 119.186 -10.378 -6.606 1029 HB VAL 144 HB VAL 144 121.081 -9.351 -7.802 1030 HG11 VAL 144 1HG1 VAL 144 121.736 -7.996 -5.670 1031 HG12 VAL 144 2HG1 VAL 144 123.016 -8.564 -6.741 1032 HG13 VAL 144 3HG1 VAL 144 122.667 -9.433 -5.246 1033 HG21 VAL 144 3HG2 VAL 144 122.651 -11.184 -7.517 1034 HG22 VAL 144 1HG2 VAL 144 121.013 -11.814 -7.341 1035 HG23 VAL 144 2HG2 VAL 144 122.008 -11.534 -5.913 1036 H GLY 145 H GLY 145 119.735 -12.163 -5.272 1037 HA2 GLY 145 1HA GLY 145 120.525 -11.530 -2.503 1038 HA3 GLY 145 2HA GLY 145 119.016 -12.389 -2.792 1039 H TYR 146 H TYR 146 121.147 -13.407 -1.263 1040 HA TYR 146 HA TYR 146 121.891 -15.766 -2.882 1041 HB2 TYR 146 1HB TYR 146 123.831 -14.230 -2.597 1042 HB3 TYR 146 2HB TYR 146 123.661 -14.387 -0.860 1043 HD1 TYR 146 HD1 TYR 146 124.473 -16.202 -3.991 1044 HD2 TYR 146 HD2 TYR 146 124.505 -16.304 0.304 1045 HE1 TYR 146 HE1 TYR 146 125.916 -18.218 -4.049 1046 HE2 TYR 146 HE2 TYR 146 125.947 -18.322 0.244 1047 HH TYR 146 HH TYR 146 127.075 -19.737 -1.037 1048 H ARG 147 H ARG 147 121.799 -17.716 -1.824 1049 HA ARG 147 HA ARG 147 120.369 -17.707 0.739 1050 HB2 ARG 147 1HB ARG 147 120.985 -19.995 -1.147 1051 HB3 ARG 147 2HB ARG 147 119.916 -20.059 0.252 1052 HG2 ARG 147 1HG ARG 147 119.495 -18.193 -2.097 1053 HG3 ARG 147 2HG ARG 147 118.718 -19.769 -1.947 1054 HD2 ARG 147 1HD ARG 147 117.763 -19.034 0.241 1055 HD3 ARG 147 2HD ARG 147 118.439 -17.432 -0.039 1056 HE ARG 147 HE ARG 147 117.029 -17.713 -2.262 1057 HH11 ARG 147 1HH1 ARG 147 116.059 -18.538 1.016 1058 HH12 ARG 147 2HH1 ARG 147 114.377 -18.326 0.670 1059 HH21 ARG 147 1HH2 ARG 147 114.852 -17.455 -2.636 1060 HH22 ARG 147 2HH2 ARG 147 113.703 -17.718 -1.367 1061 H PHE 148 H PHE 148 121.192 -18.579 2.603 1062 HA PHE 148 HA PHE 148 123.686 -20.097 2.512 1063 HB2 PHE 148 1HB PHE 148 124.349 -17.708 2.674 1064 HB3 PHE 148 2HB PHE 148 123.414 -17.575 4.151 1065 HD1 PHE 148 HD1 PHE 148 126.384 -19.139 2.581 1066 HD2 PHE 148 HD2 PHE 148 124.263 -18.399 6.243 1067 HE1 PHE 148 HE1 PHE 148 128.352 -19.910 3.878 1068 HE2 PHE 148 HE2 PHE 148 126.231 -19.170 7.540 1069 HZ PHE 148 HZ PHE 148 128.276 -19.926 6.357 Start of MODEL 4 1 H1 ALA 1 3H ALA 1 116.275 -25.623 7.210 2 H2 ALA 1 2H ALA 1 115.353 -25.540 8.633 3 H3 ALA 1 HT3 ALA 1 116.858 -24.758 8.547 4 HA ALA 1 HA ALA 1 114.402 -24.057 7.036 5 HB1 ALA 1 2HB ALA 1 114.604 -23.395 9.486 6 HB2 ALA 1 3HB ALA 1 114.396 -22.056 8.357 7 HB3 ALA 1 1HB ALA 1 115.991 -22.413 9.018 8 H THR 2 H THR 2 114.644 -22.401 5.504 9 HA THR 2 HA THR 2 117.430 -21.805 4.683 10 HB THR 2 HB THR 2 116.687 -21.878 2.355 11 HG1 THR 2 HG1 THR 2 114.650 -21.872 1.907 12 HG21 THR 2 3HG2 THR 2 115.728 -24.396 3.724 13 HG22 THR 2 1HG2 THR 2 117.436 -23.973 3.605 14 HG23 THR 2 2HG2 THR 2 116.491 -24.246 2.141 15 H SER 3 H SER 3 117.873 -19.726 4.074 16 HA SER 3 HA SER 3 115.645 -17.785 4.069 17 HB2 SER 3 1HB SER 3 116.922 -16.253 5.453 18 HB3 SER 3 2HB SER 3 116.753 -17.787 6.302 19 HG SER 3 HG SER 3 118.982 -16.898 4.773 20 H THR 4 H THR 4 116.061 -15.866 2.886 21 HA THR 4 HA THR 4 118.445 -15.928 1.145 22 HB THR 4 HB THR 4 116.641 -16.806 -0.201 23 HG1 THR 4 HG1 THR 4 118.059 -15.244 -1.123 24 HG21 THR 4 3HG2 THR 4 114.597 -15.436 -0.606 25 HG22 THR 4 1HG2 THR 4 115.117 -14.336 0.670 26 HG23 THR 4 2HG2 THR 4 114.724 -16.012 1.056 27 H VAL 5 H VAL 5 119.448 -14.019 0.897 28 HA VAL 5 HA VAL 5 118.083 -11.602 1.953 29 HB VAL 5 HB VAL 5 119.804 -12.414 3.522 30 HG11 VAL 5 1HG1 VAL 5 122.152 -12.471 2.877 31 HG12 VAL 5 2HG1 VAL 5 121.747 -11.953 1.242 32 HG13 VAL 5 3HG1 VAL 5 121.234 -13.539 1.816 33 HG21 VAL 5 3HG2 VAL 5 121.058 -10.317 3.702 34 HG22 VAL 5 1HG2 VAL 5 119.386 -9.979 3.258 35 HG23 VAL 5 2HG2 VAL 5 120.654 -9.911 2.035 36 H THR 6 H THR 6 118.167 -9.815 0.691 37 HA THR 6 HA THR 6 119.967 -9.804 -1.629 38 HB THR 6 HB THR 6 117.849 -10.846 -2.362 39 HG1 THR 6 HG1 THR 6 117.928 -8.262 -3.445 40 HG21 THR 6 3HG2 THR 6 115.823 -9.386 -2.505 41 HG22 THR 6 1HG2 THR 6 116.650 -8.211 -1.482 42 HG23 THR 6 2HG2 THR 6 116.265 -9.813 -0.853 43 H GLY 7 H GLY 7 120.137 -7.735 -2.678 44 HA2 GLY 7 1HA GLY 7 118.996 -5.444 -1.212 45 HA3 GLY 7 2HA GLY 7 120.734 -5.482 -1.529 46 H GLY 8 H GLY 8 118.725 -3.563 -2.561 47 HA2 GLY 8 1HA GLY 8 119.393 -3.829 -5.392 48 HA3 GLY 8 2HA GLY 8 117.680 -3.865 -4.999 49 H TYR 9 H TYR 9 118.499 -1.984 -6.654 50 HA TYR 9 HA TYR 9 118.474 0.510 -5.063 51 HB2 TYR 9 1HB TYR 9 119.773 1.593 -6.766 52 HB3 TYR 9 2HB TYR 9 120.623 0.149 -6.254 53 HD1 TYR 9 HD2 TYR 9 120.871 -1.765 -7.763 54 HD2 TYR 9 HD1 TYR 9 118.794 1.789 -8.987 55 HE1 TYR 9 HE2 TYR 9 120.990 -2.510 -10.125 56 HE2 TYR 9 HE1 TYR 9 118.912 1.045 -11.349 57 HH TYR 9 HH TYR 9 120.361 -2.094 -12.215 58 H ALA 10 H ALA 10 117.050 2.100 -5.720 59 HA ALA 10 HA ALA 10 115.376 1.558 -8.079 60 HB1 ALA 10 1HB ALA 10 114.221 2.318 -5.391 61 HB2 ALA 10 2HB ALA 10 114.253 0.667 -6.012 62 HB3 ALA 10 3HB ALA 10 113.336 1.911 -6.861 63 H GLN 11 H GLN 11 114.457 3.369 -9.026 64 HA GLN 11 HA GLN 11 115.311 5.997 -7.958 65 HB2 GLN 11 1HB GLN 11 114.706 5.152 -10.806 66 HB3 GLN 11 2HB GLN 11 115.071 6.803 -10.302 67 HG2 GLN 11 1HG GLN 11 117.269 6.105 -9.491 68 HG3 GLN 11 2HG GLN 11 116.909 4.428 -9.893 69 HE21 GLN 11 1HE2 GLN 11 119.153 5.797 -11.036 70 HE22 GLN 11 2HE2 GLN 11 118.872 5.981 -12.700 71 H SER 12 H SER 12 113.738 7.600 -7.722 72 HA SER 12 HA SER 12 110.949 6.610 -7.940 73 HB2 SER 12 1HB SER 12 111.756 6.978 -5.624 74 HB3 SER 12 2HB SER 12 112.108 8.654 -6.031 75 HG SER 12 HG SER 12 109.800 8.689 -6.710 76 H ASP 13 H ASP 13 109.675 7.628 -9.305 77 HA ASP 13 HA ASP 13 110.463 10.271 -10.342 78 HB2 ASP 13 1HB ASP 13 110.065 8.445 -11.994 79 HB3 ASP 13 2HB ASP 13 108.409 8.315 -11.409 80 H ALA 14 H ALA 14 109.312 12.024 -9.743 81 HA ALA 14 HA ALA 14 106.868 11.565 -8.142 82 HB1 ALA 14 1HB ALA 14 107.530 13.213 -6.683 83 HB2 ALA 14 2HB ALA 14 108.460 14.077 -7.907 84 HB3 ALA 14 3HB ALA 14 109.112 12.610 -7.177 85 H GLN 15 H GLN 15 105.225 11.912 -9.457 86 HA GLN 15 HA GLN 15 105.196 14.117 -11.356 87 HB2 GLN 15 1HB GLN 15 103.082 12.090 -10.581 88 HB3 GLN 15 2HB GLN 15 102.886 13.308 -11.843 89 HG2 GLN 15 1HG GLN 15 104.920 12.384 -12.971 90 HG3 GLN 15 2HG GLN 15 104.965 11.106 -11.770 91 HE21 GLN 15 1HE2 GLN 15 101.660 11.557 -12.317 92 HE22 GLN 15 2HE2 GLN 15 101.467 10.439 -13.575 93 H GLY 16 H GLY 16 104.565 16.081 -10.868 94 HA2 GLY 16 1HA GLY 16 103.257 17.770 -9.877 95 HA3 GLY 16 2HA GLY 16 102.677 16.605 -8.697 96 H GLN 17 H GLN 17 105.705 15.832 -8.379 97 HA GLN 17 HA GLN 17 106.522 18.169 -6.755 98 HB2 GLN 17 1HB GLN 17 106.060 16.091 -5.448 99 HB3 GLN 17 2HB GLN 17 107.326 15.278 -6.363 100 HG2 GLN 17 1HG GLN 17 108.987 16.882 -5.557 101 HG3 GLN 17 2HG GLN 17 107.736 17.777 -4.700 102 HE21 GLN 17 1HE2 GLN 17 109.812 16.893 -3.144 103 HE22 GLN 17 2HE2 GLN 17 109.343 15.561 -2.202 104 H MET 18 H MET 18 108.789 18.707 -6.797 105 HA MET 18 HA MET 18 109.955 18.190 -9.426 106 HB2 MET 18 1HB MET 18 110.843 20.043 -7.200 107 HB3 MET 18 2HB MET 18 111.526 19.989 -8.823 108 HG2 MET 18 1HG MET 18 108.660 20.691 -8.123 109 HG3 MET 18 2HG MET 18 109.906 21.828 -8.626 110 HE1 MET 18 3HE MET 18 110.643 21.153 -12.202 111 HE2 MET 18 1HE MET 18 111.395 20.006 -11.088 112 HE3 MET 18 2HE MET 18 111.204 21.695 -10.622 113 H ASN 19 H ASN 19 112.162 17.610 -9.698 114 HA ASN 19 HA ASN 19 114.109 16.494 -9.308 115 HB2 ASN 19 1HB ASN 19 113.483 17.074 -6.407 116 HB3 ASN 19 2HB ASN 19 115.016 16.460 -7.016 117 HD21 ASN 19 1HD2 ASN 19 114.663 19.036 -5.659 118 HD22 ASN 19 2HD2 ASN 19 115.092 20.239 -6.777 119 H LYS 20 H LYS 20 114.387 14.424 -9.613 120 HA LYS 20 HA LYS 20 112.657 12.430 -8.399 121 HB2 LYS 20 1HB LYS 20 115.020 12.183 -10.281 122 HB3 LYS 20 2HB LYS 20 114.007 10.837 -9.757 123 HG2 LYS 20 1HG LYS 20 112.018 12.013 -10.696 124 HG3 LYS 20 2HG LYS 20 113.089 13.275 -11.309 125 HD2 LYS 20 1HD LYS 20 114.337 11.532 -12.594 126 HD3 LYS 20 2HD LYS 20 113.151 10.339 -12.063 127 HE2 LYS 20 1HE LYS 20 111.433 11.282 -13.328 128 HE3 LYS 20 2HE LYS 20 112.210 12.865 -13.388 129 HZ1 LYS 20 3HZ LYS 20 113.809 12.068 -14.917 130 HZ2 LYS 20 1HZ LYS 20 112.297 11.560 -15.498 131 HZ3 LYS 20 2HZ LYS 20 113.319 10.454 -14.710 132 H MET 21 H MET 21 113.696 10.471 -7.340 133 HA MET 21 HA MET 21 115.949 11.359 -5.612 134 HB2 MET 21 1HB MET 21 113.427 9.900 -4.793 135 HB3 MET 21 2HB MET 21 114.823 10.157 -3.746 136 HG2 MET 21 1HG MET 21 114.580 12.614 -4.077 137 HG3 MET 21 2HG MET 21 113.125 12.316 -5.030 138 HE1 MET 21 3HE MET 21 111.799 13.816 -1.715 139 HE2 MET 21 1HE MET 21 111.483 13.739 -3.453 140 HE3 MET 21 2HE MET 21 113.069 14.232 -2.863 141 H GLY 22 H GLY 22 117.195 9.619 -4.647 142 HA2 GLY 22 1HA GLY 22 116.955 7.030 -6.085 143 HA3 GLY 22 2HA GLY 22 118.515 7.801 -5.793 144 H GLY 23 H GLY 23 117.150 5.203 -4.806 145 HA2 GLY 23 1HA GLY 23 118.042 5.481 -2.037 146 HA3 GLY 23 2HA GLY 23 116.349 5.068 -2.270 147 H PHE 24 H PHE 24 117.884 3.377 -0.866 148 HA PHE 24 HA PHE 24 118.129 1.047 -2.672 149 HB2 PHE 24 1HB PHE 24 120.088 0.279 -1.464 150 HB3 PHE 24 2HB PHE 24 120.386 1.867 -2.143 151 HD1 PHE 24 HD1 PHE 24 120.447 3.869 -0.663 152 HD2 PHE 24 HD2 PHE 24 120.069 -0.114 0.902 153 HE1 PHE 24 HE1 PHE 24 121.090 4.691 1.587 154 HE2 PHE 24 HE2 PHE 24 120.710 0.709 3.151 155 HZ PHE 24 HZ PHE 24 121.221 3.111 3.494 156 H ASN 25 H ASN 25 117.812 -1.021 -1.576 157 HA ASN 25 HA ASN 25 116.541 -0.854 1.063 158 HB2 ASN 25 1HB ASN 25 114.535 -2.012 0.320 159 HB3 ASN 25 2HB ASN 25 114.729 -0.511 -0.579 160 HD21 ASN 25 1HD2 ASN 25 113.183 -2.737 -1.579 161 HD22 ASN 25 2HD2 ASN 25 113.968 -3.334 -2.961 162 H LEU 26 H LEU 26 116.455 -2.815 2.198 163 HA LEU 26 HA LEU 26 117.862 -5.101 0.941 164 HB2 LEU 26 1HB LEU 26 119.246 -3.800 2.621 165 HB3 LEU 26 2HB LEU 26 118.094 -4.309 3.850 166 HG LEU 26 HG LEU 26 119.257 -6.425 2.075 167 HD11 LEU 26 1HD1 LEU 26 121.305 -6.571 3.245 168 HD12 LEU 26 2HD1 LEU 26 120.756 -5.480 4.517 169 HD13 LEU 26 3HD1 LEU 26 121.127 -4.847 2.913 170 HD21 LEU 26 3HD2 LEU 26 117.761 -7.340 3.614 171 HD22 LEU 26 1HD2 LEU 26 118.171 -6.166 4.862 172 HD23 LEU 26 2HD2 LEU 26 119.273 -7.495 4.503 173 H LYS 27 H LYS 27 116.904 -7.069 1.225 174 HA LYS 27 HA LYS 27 114.426 -7.120 2.859 175 HB2 LYS 27 1HB LYS 27 115.005 -8.505 0.232 176 HB3 LYS 27 2HB LYS 27 113.539 -8.711 1.187 177 HG2 LYS 27 1HG LYS 27 113.124 -6.257 1.009 178 HG3 LYS 27 2HG LYS 27 114.526 -6.127 -0.052 179 HD2 LYS 27 1HD LYS 27 113.456 -7.778 -1.595 180 HD3 LYS 27 2HD LYS 27 112.021 -7.756 -0.569 181 HE2 LYS 27 1HE LYS 27 112.117 -5.170 -0.901 182 HE3 LYS 27 2HE LYS 27 113.146 -5.551 -2.283 183 HZ1 LYS 27 3HZ LYS 27 110.505 -6.822 -1.861 184 HZ2 LYS 27 1HZ LYS 27 111.445 -6.812 -3.273 185 HZ3 LYS 27 2HZ LYS 27 110.696 -5.382 -2.743 186 H TYR 28 H TYR 28 114.156 -8.750 4.244 187 HA TYR 28 HA TYR 28 116.018 -11.061 4.115 188 HB2 TYR 28 1HB TYR 28 116.418 -9.578 6.064 189 HB3 TYR 28 2HB TYR 28 114.758 -9.825 6.569 190 HD1 TYR 28 HD1 TYR 28 118.059 -11.437 6.122 191 HD2 TYR 28 HD2 TYR 28 114.078 -11.850 7.681 192 HE1 TYR 28 HE1 TYR 28 118.757 -13.466 7.366 193 HE2 TYR 28 HE2 TYR 28 114.776 -13.879 8.926 194 HH TYR 28 HH TYR 28 118.058 -15.204 8.584 195 H ARG 29 H ARG 29 115.119 -13.087 4.236 196 HA ARG 29 HA ARG 29 112.171 -13.236 4.483 197 HB2 ARG 29 1HB ARG 29 112.930 -13.375 2.111 198 HB3 ARG 29 2HB ARG 29 113.881 -14.796 2.538 199 HG2 ARG 29 1HG ARG 29 111.779 -15.894 3.351 200 HG3 ARG 29 2HG ARG 29 110.871 -14.508 2.746 201 HD2 ARG 29 1HD ARG 29 112.645 -16.302 1.069 202 HD3 ARG 29 2HD ARG 29 110.889 -16.366 1.111 203 HE ARG 29 HE ARG 29 112.541 -14.299 -0.139 204 HH11 ARG 29 1HH1 ARG 29 109.300 -15.308 0.780 205 HH12 ARG 29 2HH1 ARG 29 108.545 -14.237 -0.351 206 HH21 ARG 29 1HH2 ARG 29 111.502 -12.941 -1.567 207 HH22 ARG 29 2HH2 ARG 29 109.773 -12.915 -1.658 208 H TYR 30 H TYR 30 111.353 -14.917 5.626 209 HA TYR 30 HA TYR 30 113.252 -16.952 6.653 210 HB2 TYR 30 1HB TYR 30 112.494 -15.360 8.392 211 HB3 TYR 30 2HB TYR 30 110.832 -15.796 8.044 212 HD1 TYR 30 HD1 TYR 30 109.927 -17.962 8.735 213 HD2 TYR 30 HD2 TYR 30 113.997 -16.873 9.571 214 HE1 TYR 30 HE1 TYR 30 110.094 -19.831 10.356 215 HE2 TYR 30 HE2 TYR 30 114.164 -18.742 11.192 216 HH TYR 30 HH TYR 30 113.128 -20.791 11.746 217 H GLU 31 H GLU 31 112.650 -19.062 6.471 218 HA GLU 31 HA GLU 31 109.954 -19.636 5.384 219 HB2 GLU 31 1HB GLU 31 111.724 -19.648 3.614 220 HB3 GLU 31 2HB GLU 31 112.528 -20.950 4.491 221 HG2 GLU 31 1HG GLU 31 110.452 -22.308 4.322 222 HG3 GLU 31 2HG GLU 31 109.712 -21.026 3.373 223 H GLU 32 H GLU 32 109.004 -21.554 6.018 224 HA GLU 32 HA GLU 32 110.244 -22.900 8.314 225 HB2 GLU 32 1HB GLU 32 107.881 -22.073 8.453 226 HB3 GLU 32 2HB GLU 32 107.451 -23.240 7.201 227 HG2 GLU 32 1HG GLU 32 108.331 -25.068 8.643 228 HG3 GLU 32 2HG GLU 32 108.655 -23.888 9.905 229 H ASP 33 H ASP 33 110.714 -25.083 8.344 230 HA ASP 33 HA ASP 33 111.602 -26.126 5.865 231 HB2 ASP 33 1HB ASP 33 112.687 -26.545 8.063 232 HB3 ASP 33 2HB ASP 33 111.329 -27.583 8.496 233 H ASN 34 H ASN 34 108.851 -27.075 7.957 234 HA ASN 34 HA ASN 34 108.139 -29.121 5.946 235 HB2 ASN 34 1HB ASN 34 107.267 -28.787 8.816 236 HB3 ASN 34 2HB ASN 34 106.716 -30.065 7.735 237 HD21 ASN 34 1HD2 ASN 34 108.243 -30.511 10.193 238 HD22 ASN 34 2HD2 ASN 34 109.717 -31.218 9.737 239 H SER 35 H SER 35 107.080 -26.040 7.059 240 HA SER 35 HA SER 35 104.769 -26.260 5.284 241 HB2 SER 35 1HB SER 35 104.526 -25.346 8.164 242 HB3 SER 35 2HB SER 35 103.254 -25.248 6.952 243 HG SER 35 HG SER 35 104.251 -27.418 8.349 244 HA PRO 36 HA PRO 36 107.415 -22.469 5.248 245 HB2 PRO 36 1HB PRO 36 107.847 -22.224 2.580 246 HB3 PRO 36 2HB PRO 36 108.772 -23.341 3.603 247 HG2 PRO 36 1HG PRO 36 106.509 -23.904 1.761 248 HG3 PRO 36 2HG PRO 36 107.977 -24.848 2.072 249 HD2 PRO 36 1HD PRO 36 105.525 -25.441 3.176 250 HD3 PRO 36 2HD PRO 36 107.079 -25.898 3.908 251 H LEU 37 H LEU 37 106.624 -20.510 5.358 252 HA LEU 37 HA LEU 37 104.694 -19.559 3.329 253 HB2 LEU 37 1HB LEU 37 104.882 -18.671 6.226 254 HB3 LEU 37 2HB LEU 37 103.744 -18.068 5.023 255 HG LEU 37 HG LEU 37 103.906 -20.958 5.926 256 HD11 LEU 37 1HD1 LEU 37 101.715 -20.411 7.042 257 HD12 LEU 37 2HD1 LEU 37 102.021 -18.710 6.692 258 HD13 LEU 37 3HD1 LEU 37 103.103 -19.597 7.766 259 HD21 LEU 37 3HD2 LEU 37 101.656 -21.032 4.773 260 HD22 LEU 37 1HD2 LEU 37 103.015 -20.769 3.682 261 HD23 LEU 37 2HD2 LEU 37 101.988 -19.415 4.152 262 H GLY 38 H GLY 38 105.307 -17.572 2.341 263 HA2 GLY 38 1HA GLY 38 108.117 -16.899 2.886 264 HA3 GLY 38 2HA GLY 38 107.213 -16.476 1.433 265 H VAL 39 H VAL 39 108.468 -15.264 4.256 266 HA VAL 39 HA VAL 39 106.699 -12.886 4.079 267 HB VAL 39 HB VAL 39 108.057 -13.948 6.574 268 HG11 VAL 39 1HG1 VAL 39 106.469 -12.214 7.612 269 HG12 VAL 39 2HG1 VAL 39 106.287 -11.572 5.981 270 HG13 VAL 39 3HG1 VAL 39 107.872 -11.583 6.751 271 HG21 VAL 39 3HG2 VAL 39 105.125 -13.935 5.785 272 HG22 VAL 39 1HG2 VAL 39 105.772 -14.476 7.334 273 HG23 VAL 39 2HG2 VAL 39 106.153 -15.365 5.859 274 H ILE 40 H ILE 40 107.741 -11.073 3.602 275 HA ILE 40 HA ILE 40 110.670 -10.956 4.056 276 HB ILE 40 HB ILE 40 110.855 -9.644 1.989 277 HG12 ILE 40 1HG1 ILE 40 107.939 -10.365 1.554 278 HG13 ILE 40 2HG1 ILE 40 108.499 -8.764 2.041 279 HG21 ILE 40 1HG2 ILE 40 111.137 -12.107 1.947 280 HG22 ILE 40 2HG2 ILE 40 110.483 -11.498 0.428 281 HG23 ILE 40 3HG2 ILE 40 109.418 -12.285 1.593 282 HD11 ILE 40 3HD1 ILE 40 108.390 -8.524 -0.273 283 HD12 ILE 40 1HD1 ILE 40 108.891 -10.187 -0.572 284 HD13 ILE 40 2HD1 ILE 40 110.075 -8.989 -0.051 285 H GLY 41 H GLY 41 111.467 -9.176 4.945 286 HA2 GLY 41 1HA GLY 41 109.675 -6.836 5.315 287 HA3 GLY 41 2HA GLY 41 110.915 -7.312 6.479 288 H SER 42 H SER 42 110.350 -4.979 4.407 289 HA SER 42 HA SER 42 113.152 -4.788 3.466 290 HB2 SER 42 1HB SER 42 111.377 -5.310 1.673 291 HB3 SER 42 2HB SER 42 110.801 -3.671 1.950 292 HG SER 42 HG SER 42 112.313 -3.314 0.480 293 H PHE 43 H PHE 43 114.163 -2.883 3.899 294 HA PHE 43 HA PHE 43 112.471 -0.561 4.647 295 HB2 PHE 43 1HB PHE 43 114.255 0.199 6.110 296 HB3 PHE 43 2HB PHE 43 113.687 -1.384 6.601 297 HD1 PHE 43 HD1 PHE 43 115.112 -3.361 6.359 298 HD2 PHE 43 HD2 PHE 43 116.479 0.538 5.190 299 HE1 PHE 43 HE1 PHE 43 117.444 -4.201 6.283 300 HE2 PHE 43 HE2 PHE 43 118.811 -0.301 5.110 301 HZ PHE 43 HZ PHE 43 119.294 -2.671 5.659 302 H THR 44 H THR 44 112.767 1.232 3.455 303 HA THR 44 HA THR 44 115.055 1.248 1.559 304 HB THR 44 HB THR 44 112.251 2.254 1.019 305 HG1 THR 44 HG1 THR 44 112.095 0.090 0.997 306 HG21 THR 44 3HG2 THR 44 114.825 2.135 -0.525 307 HG22 THR 44 1HG2 THR 44 113.668 3.460 -0.391 308 HG23 THR 44 2HG2 THR 44 113.285 2.052 -1.381 309 H TYR 45 H TYR 45 116.173 3.078 1.384 310 HA TYR 45 HA TYR 45 115.131 5.524 2.699 311 HB2 TYR 45 1HB TYR 45 116.940 4.518 4.024 312 HB3 TYR 45 2HB TYR 45 117.979 4.512 2.612 313 HD1 TYR 45 HD1 TYR 45 116.333 6.622 5.157 314 HD2 TYR 45 HD2 TYR 45 119.058 6.534 1.837 315 HE1 TYR 45 HE1 TYR 45 117.109 8.906 5.731 316 HE2 TYR 45 HE2 TYR 45 119.833 8.819 2.412 317 HH TYR 45 HH TYR 45 118.228 10.890 4.266 318 H THR 46 H THR 46 114.984 7.218 1.355 319 HA THR 46 HA THR 46 116.670 7.251 -1.082 320 HB THR 46 HB THR 46 114.836 8.137 -2.361 321 HG1 THR 46 HG1 THR 46 113.446 9.234 -1.278 322 HG21 THR 46 3HG2 THR 46 114.628 5.530 -1.074 323 HG22 THR 46 1HG2 THR 46 114.223 6.008 -2.722 324 HG23 THR 46 2HG2 THR 46 113.037 6.193 -1.433 325 H GLU 47 H GLU 47 117.291 9.286 -1.825 326 HA GLU 47 HA GLU 47 116.626 11.676 -0.317 327 HB2 GLU 47 1HB GLU 47 118.407 10.498 1.025 328 HB3 GLU 47 2HB GLU 47 119.488 10.688 -0.353 329 HG2 GLU 47 1HG GLU 47 119.158 13.150 -0.242 330 HG3 GLU 47 2HG GLU 47 118.137 12.933 1.172 331 H LYS 48 H LYS 48 117.250 13.579 -1.409 332 HA LYS 48 HA LYS 48 118.899 13.300 -3.813 333 HB2 LYS 48 1HB LYS 48 116.551 13.140 -4.582 334 HB3 LYS 48 2HB LYS 48 116.211 14.695 -3.822 335 HG2 LYS 48 1HG LYS 48 116.632 15.159 -6.129 336 HG3 LYS 48 2HG LYS 48 118.079 15.668 -5.263 337 HD2 LYS 48 1HD LYS 48 119.219 13.599 -5.859 338 HD3 LYS 48 2HD LYS 48 117.757 12.976 -6.623 339 HE2 LYS 48 1HE LYS 48 117.825 14.745 -8.294 340 HE3 LYS 48 2HE LYS 48 119.201 15.498 -7.487 341 HZ1 LYS 48 3HZ LYS 48 120.197 13.104 -7.818 342 HZ2 LYS 48 1HZ LYS 48 120.286 14.274 -9.043 343 HZ3 LYS 48 2HZ LYS 48 119.092 13.066 -9.107 344 H SER 49 H SER 49 120.323 14.932 -4.015 345 HA SER 49 HA SER 49 120.032 17.227 -2.162 346 HB2 SER 49 1HB SER 49 121.934 15.721 -1.665 347 HB3 SER 49 2HB SER 49 122.559 16.001 -3.287 348 HG SER 49 HG SER 49 123.194 17.385 -1.287 349 H ARG 50 H ARG 50 120.131 19.244 -2.937 350 HA ARG 50 HA ARG 50 121.071 19.690 -5.692 351 HB2 ARG 50 1HB ARG 50 118.588 19.513 -5.720 352 HB3 ARG 50 2HB ARG 50 118.503 20.823 -4.547 353 HG2 ARG 50 1HG ARG 50 118.180 21.873 -6.648 354 HG3 ARG 50 2HG ARG 50 119.862 22.206 -6.243 355 HD2 ARG 50 1HD ARG 50 120.555 20.265 -7.635 356 HD3 ARG 50 2HD ARG 50 118.870 20.003 -8.075 357 HE ARG 50 HE ARG 50 119.872 22.672 -8.621 358 HH11 ARG 50 1HH1 ARG 50 119.400 19.449 -9.928 359 HH12 ARG 50 2HH1 ARG 50 119.470 19.995 -11.569 360 HH21 ARG 50 1HH2 ARG 50 119.954 23.317 -10.753 361 HH22 ARG 50 2HH2 ARG 50 119.780 22.159 -12.030 362 H THR 51 H THR 51 122.133 21.629 -5.987 363 HA THR 51 HA THR 51 122.259 23.471 -3.677 364 HB THR 51 HB THR 51 124.230 21.998 -3.630 365 HG1 THR 51 HG1 THR 51 125.376 23.660 -3.094 366 HG21 THR 51 3HG2 THR 51 124.862 23.167 -6.353 367 HG22 THR 51 1HG2 THR 51 124.298 21.519 -6.076 368 HG23 THR 51 2HG2 THR 51 125.861 22.037 -5.440 369 H ALA 52 H ALA 52 122.621 25.625 -4.153 370 HA ALA 52 HA ALA 52 122.612 26.381 -7.013 371 HB1 ALA 52 1HB ALA 52 120.852 27.861 -6.740 372 HB2 ALA 52 2HB ALA 52 121.113 28.017 -5.003 373 HB3 ALA 52 3HB ALA 52 120.359 26.562 -5.654 374 H SER 53 H SER 53 123.450 28.527 -7.433 375 HA SER 53 HA SER 53 125.839 29.111 -6.090 376 HB2 SER 53 1HB SER 53 125.904 31.137 -7.413 377 HB3 SER 53 2HB SER 53 125.266 29.833 -8.407 378 HG SER 53 HG SER 53 124.085 32.142 -7.536 379 H SER 54 H SER 54 122.566 30.324 -5.562 380 HA SER 54 HA SER 54 123.124 32.509 -3.911 381 HB2 SER 54 1HB SER 54 120.871 31.905 -4.798 382 HB3 SER 54 2HB SER 54 120.808 30.583 -3.637 383 HG SER 54 HG SER 54 120.994 32.126 -1.979 384 H GLY 55 H GLY 55 123.090 29.058 -3.177 385 HA2 GLY 55 1HA GLY 55 124.410 28.153 -1.401 386 HA3 GLY 55 2HA GLY 55 124.239 29.670 -0.538 387 H ASP 56 H ASP 56 121.211 28.845 -1.756 388 HA ASP 56 HA ASP 56 120.300 27.977 0.862 389 HB2 ASP 56 1HB ASP 56 119.005 29.604 -0.508 390 HB3 ASP 56 2HB ASP 56 118.733 28.336 -1.702 391 H TYR 57 H TYR 57 120.288 25.907 1.443 392 HA TYR 57 HA TYR 57 120.167 23.828 -0.665 393 HB2 TYR 57 1HB TYR 57 122.242 23.898 0.687 394 HB3 TYR 57 2HB TYR 57 121.286 23.651 2.135 395 HD1 TYR 57 HD1 TYR 57 122.454 22.112 -1.021 396 HD2 TYR 57 HD2 TYR 57 120.449 21.469 2.724 397 HE1 TYR 57 HE1 TYR 57 122.614 19.661 -1.356 398 HE2 TYR 57 HE2 TYR 57 120.610 19.018 2.389 399 HH TYR 57 HH TYR 57 122.007 17.423 1.133 400 H ASN 58 H ASN 58 118.516 22.437 -0.670 401 HA ASN 58 HA ASN 58 116.615 22.509 1.597 402 HB2 ASN 58 1HB ASN 58 116.163 21.661 -1.275 403 HB3 ASN 58 2HB ASN 58 114.938 21.727 -0.010 404 HD21 ASN 58 1HD2 ASN 58 115.573 24.189 1.229 405 HD22 ASN 58 2HD2 ASN 58 115.348 25.446 0.111 406 H LYS 59 H LYS 59 116.176 20.679 2.707 407 HA LYS 59 HA LYS 59 117.678 18.261 1.946 408 HB2 LYS 59 1HB LYS 59 116.394 19.090 4.559 409 HB3 LYS 59 2HB LYS 59 117.215 17.552 4.291 410 HG2 LYS 59 1HG LYS 59 119.303 18.690 3.795 411 HG3 LYS 59 2HG LYS 59 118.509 20.262 3.882 412 HD2 LYS 59 1HD LYS 59 119.634 19.917 5.984 413 HD3 LYS 59 2HD LYS 59 117.906 19.727 6.278 414 HE2 LYS 59 1HE LYS 59 119.235 17.935 7.370 415 HE3 LYS 59 2HE LYS 59 118.125 17.289 6.162 416 HZ1 LYS 59 3HZ LYS 59 119.864 17.014 4.629 417 HZ2 LYS 59 1HZ LYS 59 120.472 16.421 6.098 418 HZ3 LYS 59 2HZ LYS 59 120.942 17.956 5.542 419 H ASN 60 H ASN 60 116.658 16.569 1.116 420 HA ASN 60 HA ASN 60 113.757 16.232 1.636 421 HB2 ASN 60 1HB ASN 60 115.277 15.399 -0.848 422 HB3 ASN 60 2HB ASN 60 113.543 15.248 -0.574 423 HD21 ASN 60 1HD2 ASN 60 112.967 17.786 0.548 424 HD22 ASN 60 2HD2 ASN 60 113.282 18.986 -0.610 425 H GLN 61 H GLN 61 113.304 14.422 2.762 426 HA GLN 61 HA GLN 61 115.080 12.076 2.426 427 HB2 GLN 61 1HB GLN 61 115.745 13.317 4.476 428 HB3 GLN 61 2HB GLN 61 114.103 13.136 5.090 429 HG2 GLN 61 1HG GLN 61 114.327 10.691 5.020 430 HG3 GLN 61 2HG GLN 61 115.954 10.847 4.363 431 HE21 GLN 61 1HE2 GLN 61 115.720 9.440 6.732 432 HE22 GLN 61 2HE2 GLN 61 116.313 10.358 8.030 433 H TYR 62 H TYR 62 114.040 10.117 2.438 434 HA TYR 62 HA TYR 62 111.332 9.964 3.561 435 HB2 TYR 62 1HB TYR 62 111.086 10.506 1.154 436 HB3 TYR 62 2HB TYR 62 112.003 9.066 0.760 437 HD1 TYR 62 HD1 TYR 62 111.024 6.838 1.015 438 HD2 TYR 62 HD2 TYR 62 108.797 10.385 1.970 439 HE1 TYR 62 HE1 TYR 62 108.925 5.516 1.032 440 HE2 TYR 62 HE2 TYR 62 106.699 9.063 1.989 441 HH TYR 62 HH TYR 62 106.738 5.551 1.685 442 H TYR 63 H TYR 63 111.005 8.104 4.631 443 HA TYR 63 HA TYR 63 112.722 5.774 4.011 444 HB2 TYR 63 1HB TYR 63 113.568 6.937 6.024 445 HB3 TYR 63 2HB TYR 63 111.988 6.777 6.767 446 HD1 TYR 63 HD1 TYR 63 111.201 4.613 7.595 447 HD2 TYR 63 HD2 TYR 63 115.069 5.037 5.777 448 HE1 TYR 63 HE1 TYR 63 111.869 2.402 8.501 449 HE2 TYR 63 HE2 TYR 63 115.736 2.826 6.682 450 HH TYR 63 HH TYR 63 113.419 0.735 8.320 451 H GLY 64 H GLY 64 111.629 3.819 3.982 452 HA2 GLY 64 1HA GLY 64 108.782 3.862 4.796 453 HA3 GLY 64 2HA GLY 64 109.228 3.380 3.164 454 H ILE 65 H ILE 65 108.016 1.983 5.646 455 HA ILE 65 HA ILE 65 109.844 -0.355 5.646 456 HB ILE 65 HB ILE 65 107.846 0.447 7.782 457 HG12 ILE 65 1HG1 ILE 65 110.878 0.517 7.860 458 HG13 ILE 65 2HG1 ILE 65 109.864 1.940 7.617 459 HG21 ILE 65 1HG2 ILE 65 109.999 -1.690 7.798 460 HG22 ILE 65 2HG2 ILE 65 108.291 -2.012 7.498 461 HG23 ILE 65 3HG2 ILE 65 108.807 -1.379 9.061 462 HD11 ILE 65 3HD1 ILE 65 109.814 0.110 10.034 463 HD12 ILE 65 1HD1 ILE 65 108.737 1.485 9.783 464 HD13 ILE 65 2HD1 ILE 65 110.470 1.746 9.984 465 H THR 66 H THR 66 109.025 -2.208 4.840 466 HA THR 66 HA THR 66 106.108 -2.378 4.380 467 HB THR 66 HB THR 66 106.545 -3.315 2.150 468 HG1 THR 66 HG1 THR 66 109.188 -2.879 2.982 469 HG21 THR 66 3HG2 THR 66 107.526 -0.564 2.848 470 HG22 THR 66 1HG2 THR 66 106.079 -1.042 1.963 471 HG23 THR 66 2HG2 THR 66 107.659 -1.138 1.188 472 H ALA 67 H ALA 67 105.305 -4.512 4.055 473 HA ALA 67 HA ALA 67 107.094 -6.777 4.506 474 HB1 ALA 67 1HB ALA 67 106.458 -6.393 6.771 475 HB2 ALA 67 2HB ALA 67 105.412 -7.694 6.203 476 HB3 ALA 67 3HB ALA 67 104.788 -6.049 6.319 477 H GLY 68 H GLY 68 106.234 -8.731 3.634 478 HA2 GLY 68 1HA GLY 68 103.582 -8.578 2.407 479 HA3 GLY 68 2HA GLY 68 104.945 -8.713 1.321 480 HA PRO 69 HA PRO 69 104.087 -13.112 2.938 481 HB2 PRO 69 1HB PRO 69 101.733 -13.929 1.860 482 HB3 PRO 69 2HB PRO 69 101.851 -13.267 3.503 483 HG2 PRO 69 1HG PRO 69 100.946 -11.951 0.997 484 HG3 PRO 69 2HG PRO 69 100.305 -11.811 2.645 485 HD2 PRO 69 1HD PRO 69 101.956 -9.937 1.507 486 HD3 PRO 69 2HD PRO 69 101.840 -10.214 3.256 487 H ALA 70 H ALA 70 104.225 -15.013 1.407 488 HA ALA 70 HA ALA 70 104.340 -14.228 -1.435 489 HB1 ALA 70 1HB ALA 70 106.631 -14.353 -0.014 490 HB2 ALA 70 2HB ALA 70 106.531 -14.786 -1.720 491 HB3 ALA 70 3HB ALA 70 106.490 -16.045 -0.487 492 H TYR 71 H TYR 71 104.162 -16.034 -2.912 493 HA TYR 71 HA TYR 71 102.888 -18.402 -1.664 494 HB2 TYR 71 1HB TYR 71 102.076 -16.973 -4.197 495 HB3 TYR 71 2HB TYR 71 101.364 -18.456 -3.592 496 HD1 TYR 71 HD1 TYR 71 100.102 -18.413 -1.402 497 HD2 TYR 71 HD2 TYR 71 101.407 -14.841 -3.398 498 HE1 TYR 71 HE1 TYR 71 98.499 -17.078 -0.062 499 HE2 TYR 71 HE2 TYR 71 99.804 -13.506 -2.058 500 HH TYR 71 HH TYR 71 97.926 -14.973 0.554 501 H ARG 72 H ARG 72 103.791 -20.260 -2.195 502 HA ARG 72 HA ARG 72 105.304 -20.465 -4.733 503 HB2 ARG 72 1HB ARG 72 106.635 -20.835 -2.650 504 HB3 ARG 72 2HB ARG 72 105.575 -22.189 -2.258 505 HG2 ARG 72 1HG ARG 72 106.175 -23.262 -4.415 506 HG3 ARG 72 2HG ARG 72 107.285 -21.932 -4.749 507 HD2 ARG 72 1HD ARG 72 108.500 -22.472 -2.634 508 HD3 ARG 72 2HD ARG 72 107.446 -23.867 -2.423 509 HE ARG 72 HE ARG 72 108.818 -23.763 -4.977 510 HH11 ARG 72 1HH1 ARG 72 108.978 -24.935 -1.672 511 HH12 ARG 72 2HH1 ARG 72 110.116 -26.180 -2.063 512 HH21 ARG 72 1HH2 ARG 72 110.283 -25.385 -5.420 513 HH22 ARG 72 2HH2 ARG 72 110.845 -26.431 -4.160 514 H ILE 73 H ILE 73 104.412 -21.712 -6.260 515 HA ILE 73 HA ILE 73 102.904 -24.088 -5.499 516 HB ILE 73 HB ILE 73 101.224 -22.274 -5.546 517 HG12 ILE 73 1HG1 ILE 73 100.718 -23.941 -7.993 518 HG13 ILE 73 2HG1 ILE 73 100.897 -24.736 -6.428 519 HG21 ILE 73 1HG2 ILE 73 101.570 -22.051 -8.516 520 HG22 ILE 73 2HG2 ILE 73 102.588 -21.076 -7.457 521 HG23 ILE 73 3HG2 ILE 73 100.834 -20.913 -7.387 522 HD11 ILE 73 3HD1 ILE 73 99.186 -22.932 -5.610 523 HD12 ILE 73 1HD1 ILE 73 98.596 -24.329 -6.510 524 HD13 ILE 73 2HD1 ILE 73 98.800 -22.778 -7.324 525 H ASN 74 H ASN 74 105.312 -24.228 -6.544 526 HA ASN 74 HA ASN 74 105.110 -25.681 -8.907 527 HB2 ASN 74 1HB ASN 74 106.320 -24.024 -10.450 528 HB3 ASN 74 2HB ASN 74 104.595 -23.800 -10.217 529 HD21 ASN 74 1HD2 ASN 74 106.718 -22.807 -7.564 530 HD22 ASN 74 2HD2 ASN 74 106.572 -21.142 -7.846 531 H ASP 75 H ASP 75 107.351 -25.912 -9.993 532 HA ASP 75 HA ASP 75 109.237 -26.621 -8.023 533 HB2 ASP 75 1HB ASP 75 109.571 -26.187 -10.997 534 HB3 ASP 75 2HB ASP 75 110.792 -26.912 -9.955 535 H TRP 76 H TRP 76 108.927 -23.735 -10.053 536 HA TRP 76 HA TRP 76 110.838 -22.359 -8.311 537 HB2 TRP 76 1HB TRP 76 112.055 -21.449 -10.259 538 HB3 TRP 76 2HB TRP 76 112.253 -23.181 -10.073 539 HD1 TRP 76 HD1 TRP 76 110.601 -24.703 -11.724 540 HE1 TRP 76 HE1 TRP 76 109.975 -24.260 -14.183 541 HE3 TRP 76 HE3 TRP 76 111.675 -19.719 -12.024 542 HZ2 TRP 76 HZ2 TRP 76 109.936 -22.079 -16.037 543 HZ3 TRP 76 HZ3 TRP 76 111.336 -18.488 -14.143 544 HH2 TRP 76 HH2 TRP 76 110.469 -19.656 -16.149 545 H ALA 77 H ALA 77 111.016 -19.973 -9.115 546 HA ALA 77 HA ALA 77 110.025 -17.950 -9.497 547 HB1 ALA 77 1HB ALA 77 109.195 -19.336 -11.612 548 HB2 ALA 77 2HB ALA 77 108.578 -17.721 -11.262 549 HB3 ALA 77 3HB ALA 77 107.633 -19.142 -10.817 550 H SER 78 H SER 78 109.468 -17.244 -7.533 551 HA SER 78 HA SER 78 106.823 -18.036 -6.454 552 HB2 SER 78 1HB SER 78 108.757 -18.685 -5.018 553 HB3 SER 78 2HB SER 78 109.228 -16.990 -4.935 554 HG SER 78 HG SER 78 107.217 -16.555 -3.968 555 H ILE 79 H ILE 79 105.547 -16.316 -5.478 556 HA ILE 79 HA ILE 79 106.301 -13.626 -6.502 557 HB ILE 79 HB ILE 79 104.617 -14.657 -7.974 558 HG12 ILE 79 1HG1 ILE 79 103.234 -12.566 -6.291 559 HG13 ILE 79 2HG1 ILE 79 104.615 -12.165 -7.311 560 HG21 ILE 79 1HG2 ILE 79 103.019 -14.878 -5.410 561 HG22 ILE 79 2HG2 ILE 79 103.542 -16.197 -6.457 562 HG23 ILE 79 3HG2 ILE 79 102.322 -15.055 -7.021 563 HD11 ILE 79 3HD1 ILE 79 103.259 -13.427 -9.171 564 HD12 ILE 79 1HD1 ILE 79 102.831 -11.766 -8.762 565 HD13 ILE 79 2HD1 ILE 79 101.880 -13.105 -8.120 566 H TYR 80 H TYR 80 105.565 -11.853 -5.262 567 HA TYR 80 HA TYR 80 104.142 -12.455 -2.774 568 HB2 TYR 80 1HB TYR 80 105.791 -11.426 -1.366 569 HB3 TYR 80 2HB TYR 80 106.549 -12.716 -2.276 570 HD1 TYR 80 HD1 TYR 80 106.330 -9.084 -1.763 571 HD2 TYR 80 HD2 TYR 80 108.206 -12.227 -4.012 572 HE1 TYR 80 HE1 TYR 80 108.051 -7.486 -2.560 573 HE2 TYR 80 HE2 TYR 80 109.927 -10.629 -4.810 574 HH TYR 80 HH TYR 80 110.432 -8.413 -4.993 575 H GLY 81 H GLY 81 103.362 -10.562 -1.679 576 HA2 GLY 81 1HA GLY 81 103.426 -8.066 -3.278 577 HA3 GLY 81 2HA GLY 81 101.895 -8.693 -2.662 578 H VAL 82 H VAL 82 103.310 -6.156 -2.023 579 HA VAL 82 HA VAL 82 103.674 -6.538 0.884 580 HB VAL 82 HB VAL 82 105.602 -4.983 0.808 581 HG11 VAL 82 1HG1 VAL 82 107.127 -6.652 -0.539 582 HG12 VAL 82 2HG1 VAL 82 105.657 -7.618 -0.633 583 HG13 VAL 82 3HG1 VAL 82 106.333 -7.189 0.938 584 HG21 VAL 82 3HG2 VAL 82 106.646 -4.442 -1.329 585 HG22 VAL 82 1HG2 VAL 82 104.970 -3.894 -1.351 586 HG23 VAL 82 2HG2 VAL 82 105.425 -5.375 -2.195 587 H VAL 83 H VAL 83 103.212 -4.796 2.160 588 HA VAL 83 HA VAL 83 102.339 -2.288 0.884 589 HB VAL 83 HB VAL 83 100.303 -3.555 1.466 590 HG11 VAL 83 1HG1 VAL 83 101.482 -3.566 4.260 591 HG12 VAL 83 2HG1 VAL 83 101.223 -4.975 3.232 592 HG13 VAL 83 3HG1 VAL 83 99.842 -4.071 3.853 593 HG21 VAL 83 3HG2 VAL 83 100.405 -1.061 1.760 594 HG22 VAL 83 1HG2 VAL 83 100.790 -1.324 3.460 595 HG23 VAL 83 2HG2 VAL 83 99.234 -1.848 2.817 596 H GLY 84 H GLY 84 102.699 -0.408 2.282 597 HA2 GLY 84 1HA GLY 84 103.863 -0.789 4.892 598 HA3 GLY 84 2HA GLY 84 105.063 -0.378 3.676 599 H VAL 85 H VAL 85 105.172 1.388 5.404 600 HA VAL 85 HA VAL 85 103.554 3.673 4.499 601 HB VAL 85 HB VAL 85 102.475 2.825 6.550 602 HG11 VAL 85 1HG1 VAL 85 105.074 3.444 7.969 603 HG12 VAL 85 2HG1 VAL 85 104.621 1.815 7.470 604 HG13 VAL 85 3HG1 VAL 85 103.631 2.686 8.641 605 HG21 VAL 85 3HG2 VAL 85 104.030 5.408 6.878 606 HG22 VAL 85 1HG2 VAL 85 102.661 4.935 7.885 607 HG23 VAL 85 2HG2 VAL 85 102.429 5.227 6.161 608 H GLY 86 H GLY 86 104.684 5.603 4.490 609 HA2 GLY 86 1HA GLY 86 107.498 5.492 5.409 610 HA3 GLY 86 2HA GLY 86 107.101 6.030 3.782 611 H TYR 87 H TYR 87 108.483 7.496 5.802 612 HA TYR 87 HA TYR 87 106.606 9.748 6.248 613 HB2 TYR 87 1HB TYR 87 109.156 9.235 7.778 614 HB3 TYR 87 2HB TYR 87 107.887 10.383 8.160 615 HD1 TYR 87 HD1 TYR 87 105.561 9.412 8.788 616 HD2 TYR 87 HD2 TYR 87 109.179 7.097 8.709 617 HE1 TYR 87 HE1 TYR 87 104.504 7.705 10.245 618 HE2 TYR 87 HE2 TYR 87 108.122 5.394 10.167 619 HH TYR 87 HH TYR 87 104.759 5.348 10.799 620 H GLY 88 H GLY 88 107.185 11.681 5.342 621 HA2 GLY 88 1HA GLY 88 109.896 11.900 4.168 622 HA3 GLY 88 2HA GLY 88 108.468 12.236 3.199 623 H LYS 89 H LYS 89 110.726 13.951 3.955 624 HA LYS 89 HA LYS 89 109.116 16.215 4.936 625 HB2 LYS 89 1HB LYS 89 110.512 15.363 6.818 626 HB3 LYS 89 2HB LYS 89 111.951 15.634 5.835 627 HG2 LYS 89 1HG LYS 89 111.454 18.021 5.695 628 HG3 LYS 89 2HG LYS 89 109.949 17.784 6.585 629 HD2 LYS 89 1HD LYS 89 111.610 18.579 8.150 630 HD3 LYS 89 2HD LYS 89 111.312 16.875 8.500 631 HE2 LYS 89 1HE LYS 89 113.345 16.190 7.542 632 HE3 LYS 89 2HE LYS 89 113.515 17.679 6.612 633 HZ1 LYS 89 3HZ LYS 89 113.526 18.712 9.012 634 HZ2 LYS 89 1HZ LYS 89 114.946 18.109 8.304 635 HZ3 LYS 89 2HZ LYS 89 114.095 17.167 9.433 636 H PHE 90 H PHE 90 109.356 17.995 3.705 637 HA PHE 90 HA PHE 90 111.718 18.233 1.968 638 HB2 PHE 90 1HB PHE 90 110.311 18.796 0.053 639 HB3 PHE 90 2HB PHE 90 109.994 17.167 0.618 640 HD1 PHE 90 HD2 PHE 90 107.867 16.597 1.687 641 HD2 PHE 90 HD1 PHE 90 108.668 20.578 0.289 642 HE1 PHE 90 HE2 PHE 90 105.456 17.149 1.880 643 HE2 PHE 90 HE1 PHE 90 106.258 21.130 0.481 644 HZ PHE 90 HZ PHE 90 104.653 19.416 1.276 645 H GLN 91 H GLN 91 112.061 20.395 1.148 646 HA GLN 91 HA GLN 91 111.089 22.399 3.075 647 HB2 GLN 91 1HB GLN 91 113.550 22.028 2.823 648 HB3 GLN 91 2HB GLN 91 113.420 22.591 1.157 649 HG2 GLN 91 1HG GLN 91 114.059 24.507 2.413 650 HG3 GLN 91 2HG GLN 91 112.333 24.707 2.112 651 HE21 GLN 91 1HE2 GLN 91 111.151 25.242 3.946 652 HE22 GLN 91 2HE2 GLN 91 111.599 24.862 5.538 653 H THR 92 H THR 92 109.626 23.823 2.472 654 HA THR 92 HA THR 92 109.552 24.750 -0.327 655 HB THR 92 HB THR 92 107.067 24.166 1.296 656 HG1 THR 92 HG1 THR 92 108.306 22.272 0.751 657 HG21 THR 92 3HG2 THR 92 106.503 25.711 -0.370 658 HG22 THR 92 1HG2 THR 92 106.184 24.170 -1.166 659 HG23 THR 92 2HG2 THR 92 107.671 25.051 -1.513 660 H THR 93 H THR 93 108.339 26.854 -0.518 661 HA THR 93 HA THR 93 108.824 28.505 1.875 662 HB THR 93 HB THR 93 108.168 29.374 -0.952 663 HG1 THR 93 HG1 THR 93 110.250 29.344 -1.317 664 HG21 THR 93 3HG2 THR 93 107.645 30.978 0.907 665 HG22 THR 93 1HG2 THR 93 108.882 31.564 -0.204 666 HG23 THR 93 2HG2 THR 93 109.345 30.920 1.371 667 H GLU 94 H GLU 94 107.201 29.213 3.073 668 HA GLU 94 HA GLU 94 104.502 29.531 2.094 669 HB2 GLU 94 1HB GLU 94 105.134 27.301 4.045 670 HB3 GLU 94 2HB GLU 94 103.517 27.902 3.701 671 HG2 GLU 94 1HG GLU 94 103.869 27.294 1.290 672 HG3 GLU 94 2HG GLU 94 105.405 26.568 1.741 673 H TYR 95 H TYR 95 103.217 30.726 3.537 674 HA TYR 95 HA TYR 95 104.572 31.966 5.773 675 HB2 TYR 95 1HB TYR 95 102.755 32.995 4.229 676 HB3 TYR 95 2HB TYR 95 101.616 32.107 5.222 677 HD1 TYR 95 HD2 TYR 95 104.005 34.895 5.098 678 HD2 TYR 95 HD1 TYR 95 101.216 32.740 7.553 679 HE1 TYR 95 HE2 TYR 95 104.037 36.740 6.754 680 HE2 TYR 95 HE1 TYR 95 101.248 34.585 9.210 681 HH TYR 95 HH TYR 95 103.304 37.460 8.718 682 HA PRO 96 HA PRO 96 104.108 28.462 8.146 683 HB2 PRO 96 1HB PRO 96 103.839 29.408 10.753 684 HB3 PRO 96 2HB PRO 96 105.366 29.250 9.867 685 HG2 PRO 96 1HG PRO 96 103.685 31.654 10.317 686 HG3 PRO 96 2HG PRO 96 105.451 31.495 10.276 687 HD2 PRO 96 1HD PRO 96 104.076 32.531 8.190 688 HD3 PRO 96 2HD PRO 96 105.548 31.561 7.954 689 H THR 97 H THR 97 102.557 27.057 8.433 690 HA THR 97 HA THR 97 99.991 27.888 9.646 691 HB THR 97 HB THR 97 100.484 25.564 7.763 692 HG1 THR 97 HG1 THR 97 99.256 26.908 6.328 693 HG21 THR 97 3HG2 THR 97 98.018 26.731 9.069 694 HG22 THR 97 1HG2 THR 97 98.634 25.083 9.202 695 HG23 THR 97 2HG2 THR 97 97.942 25.645 7.680 696 H TYR 98 H TYR 98 99.060 26.354 11.172 697 HA TYR 98 HA TYR 98 101.091 24.628 12.427 698 HB2 TYR 98 1HB TYR 98 99.789 26.219 13.829 699 HB3 TYR 98 2HB TYR 98 98.321 25.370 13.383 700 HD1 TYR 98 HD1 TYR 98 101.512 25.131 15.241 701 HD2 TYR 98 HD2 TYR 98 97.736 23.264 14.400 702 HE1 TYR 98 HE1 TYR 98 101.872 23.557 17.122 703 HE2 TYR 98 HE2 TYR 98 98.096 21.689 16.281 704 HH TYR 98 HH TYR 98 101.148 21.458 17.924 705 H LYS 99 H LYS 99 101.129 22.538 11.958 706 HA LYS 99 HA LYS 99 98.669 21.244 10.930 707 HB2 LYS 99 1HB LYS 99 100.621 21.424 9.340 708 HB3 LYS 99 2HB LYS 99 101.519 20.370 10.432 709 HG2 LYS 99 1HG LYS 99 99.742 18.653 10.210 710 HG3 LYS 99 2HG LYS 99 98.897 19.696 9.066 711 HD2 LYS 99 1HD LYS 99 100.975 19.688 7.640 712 HD3 LYS 99 2HD LYS 99 101.644 18.468 8.722 713 HE2 LYS 99 1HE LYS 99 98.995 18.153 7.288 714 HE3 LYS 99 2HE LYS 99 100.521 17.524 6.667 715 HZ1 LYS 99 3HZ LYS 99 99.621 16.883 9.402 716 HZ2 LYS 99 1HZ LYS 99 100.720 16.045 8.420 717 HZ3 LYS 99 2HZ LYS 99 99.057 15.991 8.071 718 H HIS 100 H HIS 100 98.024 19.307 11.813 719 HA HIS 100 HA HIS 100 98.648 18.771 14.491 720 HB2 HIS 100 1HB HIS 100 96.583 18.035 13.338 721 HB3 HIS 100 2HB HIS 100 97.525 16.859 12.442 722 HD1 HIS 100 HD1 HIS 100 96.916 17.733 16.112 723 HD2 HIS 100 HD2 HIS 100 97.491 14.400 13.675 724 HE1 HIS 100 HE1 HIS 100 96.695 15.705 17.609 725 H ASP 101 H ASP 101 99.813 17.205 11.513 726 HA ASP 101 HA ASP 101 101.754 15.670 13.122 727 HB2 ASP 101 1HB ASP 101 100.856 15.330 10.254 728 HB3 ASP 101 2HB ASP 101 102.049 14.322 11.066 729 H THR 102 H THR 102 103.885 16.040 12.993 730 HA THR 102 HA THR 102 104.872 18.409 11.778 731 HB THR 102 HB THR 102 106.451 16.042 12.807 732 HG1 THR 102 HG1 THR 102 106.483 17.407 14.722 733 HG21 THR 102 3HG2 THR 102 108.108 17.912 13.293 734 HG22 THR 102 1HG2 THR 102 107.103 18.947 12.279 735 HG23 THR 102 2HG2 THR 102 107.881 17.523 11.589 736 H SER 103 H SER 103 104.910 15.009 10.819 737 HA SER 103 HA SER 103 106.353 15.754 8.336 738 HB2 SER 103 1HB SER 103 107.221 13.488 8.285 739 HB3 SER 103 2HB SER 103 107.586 14.212 9.848 740 HG SER 103 HG SER 103 106.355 12.764 10.756 741 H ASP 104 H ASP 104 105.829 14.384 6.440 742 HA ASP 104 HA ASP 104 102.914 14.036 6.279 743 HB2 ASP 104 1HB ASP 104 104.082 15.482 4.612 744 HB3 ASP 104 2HB ASP 104 104.968 14.065 4.056 745 H TYR 105 H TYR 105 101.965 12.088 5.865 746 HA TYR 105 HA TYR 105 103.757 9.732 5.845 747 HB2 TYR 105 1HB TYR 105 100.833 9.834 6.579 748 HB3 TYR 105 2HB TYR 105 101.939 8.496 6.813 749 HD1 TYR 105 HD1 TYR 105 100.854 11.786 8.028 750 HD2 TYR 105 HD2 TYR 105 103.579 8.522 8.635 751 HE1 TYR 105 HE1 TYR 105 101.385 12.650 10.290 752 HE2 TYR 105 HE2 TYR 105 104.111 9.389 10.898 753 HH TYR 105 HH TYR 105 102.275 11.930 12.370 754 H GLY 106 H GLY 106 103.535 8.161 4.312 755 HA2 GLY 106 1HA GLY 106 101.433 8.512 2.256 756 HA3 GLY 106 2HA GLY 106 103.114 8.263 1.801 757 H PHE 107 H PHE 107 100.904 6.624 1.075 758 HA PHE 107 HA PHE 107 101.437 4.106 2.548 759 HB2 PHE 107 1HB PHE 107 99.113 4.900 2.670 760 HB3 PHE 107 2HB PHE 107 99.033 4.950 0.922 761 HD1 PHE 107 HD1 PHE 107 99.231 2.738 3.883 762 HD2 PHE 107 HD2 PHE 107 98.662 2.958 -0.369 763 HE1 PHE 107 HE1 PHE 107 98.430 0.391 3.868 764 HE2 PHE 107 HE2 PHE 107 97.865 0.610 -0.385 765 HZ PHE 107 HZ PHE 107 97.748 -0.673 1.734 766 H SER 108 H SER 108 102.174 2.316 1.363 767 HA SER 108 HA SER 108 102.352 2.664 -1.576 768 HB2 SER 108 1HB SER 108 104.656 1.907 -1.557 769 HB3 SER 108 2HB SER 108 104.499 3.318 -0.517 770 HG SER 108 HG SER 108 104.852 2.095 1.194 771 H TYR 109 H TYR 109 102.315 0.811 -2.792 772 HA TYR 109 HA TYR 109 102.315 -1.804 -1.485 773 HB2 TYR 109 1HB TYR 109 99.958 -1.061 -1.421 774 HB3 TYR 109 2HB TYR 109 99.994 -0.833 -3.159 775 HD1 TYR 109 HD2 TYR 109 99.908 -3.281 -0.419 776 HD2 TYR 109 HD1 TYR 109 99.993 -2.750 -4.680 777 HE1 TYR 109 HE2 TYR 109 99.254 -5.652 -0.727 778 HE2 TYR 109 HE1 TYR 109 99.337 -5.122 -4.988 779 HH TYR 109 HH TYR 109 97.929 -6.908 -3.032 780 H GLY 110 H GLY 110 102.717 -3.536 -2.963 781 HA2 GLY 110 1HA GLY 110 102.764 -3.199 -5.788 782 HA3 GLY 110 2HA GLY 110 104.384 -2.982 -5.135 783 H ALA 111 H ALA 111 104.476 -4.947 -6.723 784 HA ALA 111 HA ALA 111 104.446 -7.358 -5.041 785 HB1 ALA 111 1HB ALA 111 103.716 -8.553 -7.276 786 HB2 ALA 111 2HB ALA 111 103.013 -6.978 -7.642 787 HB3 ALA 111 3HB ALA 111 102.503 -7.857 -6.201 788 H GLY 112 H GLY 112 105.871 -9.069 -5.894 789 HA2 GLY 112 1HA GLY 112 107.853 -8.156 -7.856 790 HA3 GLY 112 2HA GLY 112 108.423 -8.496 -6.227 791 H LEU 113 H LEU 113 109.305 -9.815 -8.554 792 HA LEU 113 HA LEU 113 108.447 -12.580 -7.962 793 HB2 LEU 113 1HB LEU 113 109.129 -11.477 -10.702 794 HB3 LEU 113 2HB LEU 113 108.697 -13.146 -10.331 795 HG LEU 113 HG LEU 113 106.890 -10.767 -9.810 796 HD11 LEU 113 1HD1 LEU 113 107.024 -12.745 -12.100 797 HD12 LEU 113 2HD1 LEU 113 107.094 -10.986 -12.192 798 HD13 LEU 113 3HD1 LEU 113 105.587 -11.786 -11.748 799 HD21 LEU 113 3HD2 LEU 113 105.180 -12.628 -9.632 800 HD22 LEU 113 1HD2 LEU 113 106.384 -12.623 -8.345 801 HD23 LEU 113 2HD2 LEU 113 106.519 -13.774 -9.673 802 H GLN 114 H GLN 114 110.102 -14.113 -7.959 803 HA GLN 114 HA GLN 114 112.856 -13.065 -8.316 804 HB2 GLN 114 1HB GLN 114 111.834 -15.099 -6.319 805 HB3 GLN 114 2HB GLN 114 113.535 -14.709 -6.576 806 HG2 GLN 114 1HG GLN 114 113.129 -12.381 -5.948 807 HG3 GLN 114 2HG GLN 114 111.407 -12.710 -5.764 808 HE21 GLN 114 1HE2 GLN 114 113.005 -11.717 -3.593 809 HE22 GLN 114 2HE2 GLN 114 113.090 -12.925 -2.404 810 H PHE 115 H PHE 115 114.257 -14.276 -9.502 811 HA PHE 115 HA PHE 115 113.331 -16.925 -10.459 812 HB2 PHE 115 1HB PHE 115 114.664 -14.728 -12.038 813 HB3 PHE 115 2HB PHE 115 114.519 -16.382 -12.604 814 HD1 PHE 115 HD1 PHE 115 112.327 -17.316 -13.209 815 HD2 PHE 115 HD2 PHE 115 112.756 -13.230 -11.959 816 HE1 PHE 115 HE1 PHE 115 110.069 -16.809 -14.099 817 HE2 PHE 115 HE2 PHE 115 110.496 -12.723 -12.849 818 HZ PHE 115 HZ PHE 115 109.154 -14.511 -13.918 819 H ASN 116 H ASN 116 114.887 -18.505 -10.662 820 HA ASN 116 HA ASN 116 117.607 -17.823 -9.714 821 HB2 ASN 116 1HB ASN 116 117.610 -19.999 -8.501 822 HB3 ASN 116 2HB ASN 116 116.438 -18.851 -7.860 823 HD21 ASN 116 1HD2 ASN 116 116.798 -22.039 -9.048 824 HD22 ASN 116 2HD2 ASN 116 115.150 -22.398 -9.241 825 HA PRO 117 HA PRO 117 117.891 -20.220 -13.650 826 HB2 PRO 117 1HB PRO 117 119.931 -18.814 -14.780 827 HB3 PRO 117 2HB PRO 117 118.238 -18.296 -14.887 828 HG2 PRO 117 1HG PRO 117 120.402 -17.316 -13.101 829 HG3 PRO 117 2HG PRO 117 119.129 -16.410 -13.940 830 HD2 PRO 117 1HD PRO 117 119.002 -17.077 -11.278 831 HD3 PRO 117 2HD PRO 117 117.571 -16.807 -12.294 832 H MET 118 H MET 118 120.359 -20.741 -14.729 833 HA MET 118 HA MET 118 121.451 -22.686 -13.061 834 HB2 MET 118 1HB MET 118 122.745 -21.195 -15.354 835 HB3 MET 118 2HB MET 118 123.381 -22.671 -14.627 836 HG2 MET 118 1HG MET 118 121.191 -23.792 -15.155 837 HG3 MET 118 2HG MET 118 120.722 -22.342 -16.043 838 HE1 MET 118 3HE MET 118 124.305 -24.275 -15.815 839 HE2 MET 118 1HE MET 118 123.860 -25.485 -17.025 840 HE3 MET 118 2HE MET 118 122.879 -25.283 -15.575 841 H GLU 119 H GLU 119 122.325 -19.281 -13.415 842 HA GLU 119 HA GLU 119 124.762 -19.248 -12.061 843 HB2 GLU 119 1HB GLU 119 122.565 -17.164 -12.065 844 HB3 GLU 119 2HB GLU 119 124.227 -16.885 -11.542 845 HG2 GLU 119 1HG GLU 119 125.022 -17.576 -13.797 846 HG3 GLU 119 2HG GLU 119 123.349 -17.751 -14.310 847 H ASN 120 H ASN 120 125.307 -18.755 -9.887 848 HA ASN 120 HA ASN 120 123.607 -20.105 -7.978 849 HB2 ASN 120 1HB ASN 120 126.276 -18.731 -7.648 850 HB3 ASN 120 2HB ASN 120 125.471 -19.686 -6.407 851 HD21 ASN 120 1HD2 ASN 120 128.063 -20.348 -7.607 852 HD22 ASN 120 2HD2 ASN 120 127.869 -21.838 -8.399 853 H VAL 121 H VAL 121 123.127 -17.154 -9.125 854 HA VAL 121 HA VAL 121 122.372 -16.049 -6.482 855 HB VAL 121 HB VAL 121 122.755 -13.795 -7.424 856 HG11 VAL 121 1HG1 VAL 121 125.067 -15.750 -7.493 857 HG12 VAL 121 2HG1 VAL 121 124.560 -14.737 -6.143 858 HG13 VAL 121 3HG1 VAL 121 125.281 -14.002 -7.575 859 HG21 VAL 121 3HG2 VAL 121 123.906 -15.333 -9.776 860 HG22 VAL 121 1HG2 VAL 121 123.979 -13.584 -9.560 861 HG23 VAL 121 2HG2 VAL 121 122.423 -14.377 -9.806 862 H ALA 122 H ALA 122 120.472 -14.675 -6.515 863 HA ALA 122 HA ALA 122 118.585 -15.442 -8.672 864 HB1 ALA 122 1HB ALA 122 117.862 -14.710 -5.831 865 HB2 ALA 122 2HB ALA 122 118.153 -16.371 -6.350 866 HB3 ALA 122 3HB ALA 122 116.828 -15.446 -7.056 867 H LEU 123 H LEU 123 117.094 -13.884 -9.381 868 HA LEU 123 HA LEU 123 117.929 -11.086 -8.848 869 HB2 LEU 123 1HB LEU 123 116.598 -12.216 -11.324 870 HB3 LEU 123 2HB LEU 123 117.142 -10.555 -11.095 871 HG LEU 123 HG LEU 123 118.951 -12.991 -11.035 872 HD11 LEU 123 1HD1 LEU 123 118.491 -10.880 -13.166 873 HD12 LEU 123 2HD1 LEU 123 118.095 -12.594 -13.291 874 HD13 LEU 123 3HD1 LEU 123 119.781 -12.083 -13.206 875 HD21 LEU 123 3HD2 LEU 123 120.701 -11.122 -11.283 876 HD22 LEU 123 1HD2 LEU 123 119.935 -11.277 -9.702 877 HD23 LEU 123 2HD2 LEU 123 119.417 -10.010 -10.813 878 H ASP 124 H ASP 124 116.354 -9.574 -8.354 879 HA ASP 124 HA ASP 124 113.561 -10.554 -8.196 880 HB2 ASP 124 1HB ASP 124 114.629 -10.674 -5.961 881 HB3 ASP 124 2HB ASP 124 115.003 -8.954 -6.068 882 H PHE 125 H PHE 125 112.071 -9.155 -8.932 883 HA PHE 125 HA PHE 125 112.752 -6.294 -9.062 884 HB2 PHE 125 1HB PHE 125 111.915 -6.107 -11.340 885 HB3 PHE 125 2HB PHE 125 113.284 -7.199 -11.272 886 HD1 PHE 125 HD1 PHE 125 109.661 -6.901 -11.816 887 HD2 PHE 125 HD2 PHE 125 113.001 -9.596 -11.661 888 HE1 PHE 125 HE1 PHE 125 108.301 -8.649 -12.932 889 HE2 PHE 125 HE2 PHE 125 111.643 -11.344 -12.777 890 HZ PHE 125 HZ PHE 125 109.292 -10.871 -13.412 891 H SER 126 H SER 126 110.974 -4.919 -8.883 892 HA SER 126 HA SER 126 108.327 -6.159 -8.592 893 HB2 SER 126 1HB SER 126 109.596 -4.444 -6.446 894 HB3 SER 126 2HB SER 126 107.968 -5.115 -6.417 895 HG SER 126 HG SER 126 110.385 -6.285 -5.879 896 H TYR 127 H TYR 127 106.583 -4.690 -8.722 897 HA TYR 127 HA TYR 127 107.279 -1.989 -9.723 898 HB2 TYR 127 1HB TYR 127 104.729 -3.564 -10.123 899 HB3 TYR 127 2HB TYR 127 105.109 -2.004 -10.825 900 HD1 TYR 127 HD1 TYR 127 105.736 -5.621 -10.947 901 HD2 TYR 127 HD2 TYR 127 106.679 -1.813 -12.695 902 HE1 TYR 127 HE1 TYR 127 106.740 -6.768 -12.902 903 HE2 TYR 127 HE2 TYR 127 107.684 -2.961 -14.651 904 HH TYR 127 HH TYR 127 108.757 -5.312 -15.048 905 H GLU 128 H GLU 128 106.879 -0.383 -8.324 906 HA GLU 128 HA GLU 128 104.860 -0.834 -6.195 907 HB2 GLU 128 1HB GLU 128 107.226 -0.948 -5.394 908 HB3 GLU 128 2HB GLU 128 107.439 0.719 -5.929 909 HG2 GLU 128 1HG GLU 128 105.543 1.398 -4.465 910 HG3 GLU 128 2HG GLU 128 105.429 -0.256 -3.884 911 H GLN 129 H GLN 129 103.424 0.725 -5.824 912 HA GLN 129 HA GLN 129 103.857 3.394 -7.028 913 HB2 GLN 129 1HB GLN 129 101.266 1.828 -6.876 914 HB3 GLN 129 2HB GLN 129 101.400 3.510 -7.392 915 HG2 GLN 129 1HG GLN 129 102.854 2.862 -9.245 916 HG3 GLN 129 2HG GLN 129 102.829 1.185 -8.710 917 HE21 GLN 129 1HE2 GLN 129 101.933 1.934 -11.324 918 HE22 GLN 129 2HE2 GLN 129 100.261 1.658 -11.413 919 H SER 130 H SER 130 103.339 5.123 -5.701 920 HA SER 130 HA SER 130 102.180 4.498 -3.055 921 HB2 SER 130 1HB SER 130 104.684 6.132 -3.532 922 HB3 SER 130 2HB SER 130 103.881 5.912 -1.982 923 HG SER 130 HG SER 130 105.660 4.445 -2.416 924 H ARG 131 H ARG 131 101.040 6.140 -2.096 925 HA ARG 131 HA ARG 131 100.616 8.591 -3.714 926 HB2 ARG 131 1HB ARG 131 98.676 7.116 -1.913 927 HB3 ARG 131 2HB ARG 131 98.349 8.660 -2.701 928 HG2 ARG 131 1HG ARG 131 98.723 7.602 -4.909 929 HG3 ARG 131 2HG ARG 131 99.001 6.053 -4.109 930 HD2 ARG 131 1HD ARG 131 96.705 6.079 -4.832 931 HD3 ARG 131 2HD ARG 131 96.709 6.266 -3.081 932 HE ARG 131 HE ARG 131 95.805 8.372 -3.361 933 HH11 ARG 131 1HH1 ARG 131 97.195 7.382 -6.430 934 HH12 ARG 131 2HH1 ARG 131 96.569 8.761 -7.271 935 HH21 ARG 131 1HH2 ARG 131 95.026 10.126 -4.498 936 HH22 ARG 131 2HH2 ARG 131 95.357 10.294 -6.190 937 H ILE 132 H ILE 132 101.199 10.423 -2.767 938 HA ILE 132 HA ILE 132 101.426 10.529 0.179 939 HB ILE 132 HB ILE 132 103.419 11.703 -1.790 940 HG12 ILE 132 1HG1 ILE 132 103.782 9.436 0.193 941 HG13 ILE 132 2HG1 ILE 132 103.541 9.205 -1.539 942 HG21 ILE 132 1HG2 ILE 132 104.679 12.293 0.239 943 HG22 ILE 132 2HG2 ILE 132 103.410 11.592 1.242 944 HG23 ILE 132 3HG2 ILE 132 103.077 13.030 0.278 945 HD11 ILE 132 3HD1 ILE 132 105.918 9.152 -1.130 946 HD12 ILE 132 1HD1 ILE 132 105.841 10.641 -0.190 947 HD13 ILE 132 2HD1 ILE 132 105.551 10.681 -1.929 948 H ARG 133 H ARG 133 99.652 11.778 0.494 949 HA ARG 133 HA ARG 133 97.800 12.947 -0.440 950 HB2 ARG 133 1HB ARG 133 99.821 14.890 0.664 951 HB3 ARG 133 2HB ARG 133 98.118 15.269 0.398 952 HG2 ARG 133 1HG ARG 133 97.511 13.337 1.868 953 HG3 ARG 133 2HG ARG 133 99.224 13.110 2.217 954 HD2 ARG 133 1HD ARG 133 97.585 15.587 2.823 955 HD3 ARG 133 2HD ARG 133 98.190 14.425 3.993 956 HE ARG 133 HE ARG 133 100.356 15.289 3.712 957 HH11 ARG 133 1HH1 ARG 133 98.138 16.878 1.493 958 HH12 ARG 133 2HH1 ARG 133 99.238 18.175 1.179 959 HH21 ARG 133 1HH2 ARG 133 101.721 16.985 3.257 960 HH22 ARG 133 2HH2 ARG 133 101.238 18.235 2.160 961 H SER 134 H SER 134 97.741 12.735 -2.705 962 HA SER 134 HA SER 134 97.133 13.818 -4.639 963 HB2 SER 134 1HB SER 134 98.496 16.310 -3.621 964 HB3 SER 134 2HB SER 134 97.328 16.180 -4.931 965 HG SER 134 HG SER 134 95.750 15.725 -3.472 966 H VAL 135 H VAL 135 100.366 13.449 -3.560 967 HA VAL 135 HA VAL 135 101.414 14.030 -6.250 968 HB VAL 135 HB VAL 135 102.906 13.343 -3.702 969 HG11 VAL 135 1HG1 VAL 135 104.292 12.778 -5.545 970 HG12 VAL 135 2HG1 VAL 135 104.803 14.402 -5.085 971 HG13 VAL 135 3HG1 VAL 135 103.750 14.171 -6.482 972 HG21 VAL 135 3HG2 VAL 135 102.319 15.994 -5.053 973 HG22 VAL 135 1HG2 VAL 135 103.526 15.786 -3.784 974 HG23 VAL 135 2HG2 VAL 135 101.822 15.495 -3.437 975 H ASP 136 H ASP 136 102.133 12.434 -7.572 976 HA ASP 136 HA ASP 136 101.562 9.669 -6.694 977 HB2 ASP 136 1HB ASP 136 100.332 10.525 -8.679 978 HB3 ASP 136 2HB ASP 136 101.874 10.751 -9.503 979 H VAL 137 H VAL 137 103.232 8.311 -6.342 980 HA VAL 137 HA VAL 137 105.870 9.030 -7.504 981 HB VAL 137 HB VAL 137 105.321 7.612 -4.883 982 HG11 VAL 137 1HG1 VAL 137 107.899 8.742 -6.007 983 HG12 VAL 137 2HG1 VAL 137 107.458 7.036 -6.083 984 HG13 VAL 137 3HG1 VAL 137 107.708 7.813 -4.520 985 HG21 VAL 137 3HG2 VAL 137 104.686 10.005 -4.805 986 HG22 VAL 137 1HG2 VAL 137 106.277 10.443 -5.428 987 HG23 VAL 137 2HG2 VAL 137 106.127 9.696 -3.836 988 H GLY 138 H GLY 138 106.861 7.524 -8.703 989 HA2 GLY 138 1HA GLY 138 105.803 4.748 -8.641 990 HA3 GLY 138 2HA GLY 138 106.325 5.548 -10.123 991 H THR 139 H THR 139 107.287 3.206 -8.180 992 HA THR 139 HA THR 139 110.156 3.956 -8.305 993 HB THR 139 HB THR 139 108.835 2.272 -6.166 994 HG1 THR 139 HG1 THR 139 108.983 4.067 -4.904 995 HG21 THR 139 3HG2 THR 139 111.230 1.787 -6.665 996 HG22 THR 139 1HG2 THR 139 110.996 2.458 -5.051 997 HG23 THR 139 2HG2 THR 139 111.609 3.481 -6.350 998 H TRP 140 H TRP 140 111.452 2.569 -9.301 999 HA TRP 140 HA TRP 140 110.447 -0.149 -9.917 1000 HB2 TRP 140 1HB TRP 140 112.584 1.506 -11.274 1001 HB3 TRP 140 2HB TRP 140 112.150 -0.135 -11.714 1002 HD1 TRP 140 HD1 TRP 140 110.558 3.374 -11.522 1003 HE1 TRP 140 HE1 TRP 140 108.778 3.551 -13.376 1004 HE3 TRP 140 HE3 TRP 140 110.737 -1.382 -13.372 1005 HZ2 TRP 140 HZ2 TRP 140 107.586 1.893 -15.384 1006 HZ3 TRP 140 HZ3 TRP 140 109.274 -2.055 -15.250 1007 HH2 TRP 140 HH2 TRP 140 107.700 -0.428 -16.259 1008 H ILE 141 H ILE 141 111.482 -1.840 -8.992 1009 HA ILE 141 HA ILE 141 114.019 -1.276 -7.553 1010 HB ILE 141 HB ILE 141 111.816 -3.185 -6.729 1011 HG12 ILE 141 1HG1 ILE 141 112.624 -0.543 -5.477 1012 HG13 ILE 141 2HG1 ILE 141 111.225 -0.742 -6.531 1013 HG21 ILE 141 1HG2 ILE 141 113.092 -3.460 -4.694 1014 HG22 ILE 141 2HG2 ILE 141 114.249 -2.227 -5.196 1015 HG23 ILE 141 3HG2 ILE 141 114.176 -3.768 -6.051 1016 HD11 ILE 141 3HD1 ILE 141 111.699 -1.963 -3.811 1017 HD12 ILE 141 1HD1 ILE 141 110.491 -2.609 -4.920 1018 HD13 ILE 141 2HD1 ILE 141 110.352 -0.951 -4.335 1019 H ALA 142 H ALA 142 115.707 -2.479 -8.146 1020 HA ALA 142 HA ALA 142 115.220 -5.279 -8.934 1021 HB1 ALA 142 1HB ALA 142 115.577 -3.792 -10.974 1022 HB2 ALA 142 2HB ALA 142 116.683 -5.156 -10.813 1023 HB3 ALA 142 3HB ALA 142 117.217 -3.532 -10.380 1024 H GLY 143 H GLY 143 116.702 -6.713 -8.081 1025 HA2 GLY 143 1HA GLY 143 119.250 -5.757 -7.059 1026 HA3 GLY 143 2HA GLY 143 118.092 -6.211 -5.817 1027 H VAL 144 H VAL 144 120.148 -7.627 -5.537 1028 HA VAL 144 HA VAL 144 119.670 -10.218 -6.871 1029 HB VAL 144 HB VAL 144 122.405 -9.035 -6.308 1030 HG11 VAL 144 1HG1 VAL 144 122.260 -11.507 -6.116 1031 HG12 VAL 144 2HG1 VAL 144 123.224 -11.014 -7.508 1032 HG13 VAL 144 3HG1 VAL 144 121.568 -11.578 -7.738 1033 HG21 VAL 144 3HG2 VAL 144 121.077 -9.580 -8.979 1034 HG22 VAL 144 1HG2 VAL 144 122.636 -8.801 -8.705 1035 HG23 VAL 144 2HG2 VAL 144 121.146 -7.985 -8.232 1036 H GLY 145 H GLY 145 120.036 -12.034 -5.546 1037 HA2 GLY 145 1HA GLY 145 120.764 -11.498 -2.738 1038 HA3 GLY 145 2HA GLY 145 119.215 -12.254 -3.090 1039 H TYR 146 H TYR 146 120.958 -13.529 -1.479 1040 HA TYR 146 HA TYR 146 121.869 -15.808 -3.123 1041 HB2 TYR 146 1HB TYR 146 123.803 -14.454 -2.364 1042 HB3 TYR 146 2HB TYR 146 123.281 -14.672 -0.705 1043 HD1 TYR 146 HD1 TYR 146 124.658 -16.361 -3.694 1044 HD2 TYR 146 HD2 TYR 146 123.686 -16.735 0.473 1045 HE1 TYR 146 HE1 TYR 146 125.953 -18.473 -3.582 1046 HE2 TYR 146 HE2 TYR 146 124.981 -18.848 0.585 1047 HH TYR 146 HH TYR 146 127.046 -19.875 -1.986 1048 H ARG 147 H ARG 147 121.479 -17.826 -2.252 1049 HA ARG 147 HA ARG 147 119.683 -17.858 0.094 1050 HB2 ARG 147 1HB ARG 147 120.069 -19.887 -2.122 1051 HB3 ARG 147 2HB ARG 147 118.929 -20.039 -0.784 1052 HG2 ARG 147 1HG ARG 147 117.842 -17.918 -1.513 1053 HG3 ARG 147 2HG ARG 147 118.929 -17.868 -2.901 1054 HD2 ARG 147 1HD ARG 147 118.074 -20.151 -3.547 1055 HD3 ARG 147 2HD ARG 147 116.869 -19.996 -2.273 1056 HE ARG 147 HE ARG 147 116.922 -18.569 -4.811 1057 HH11 ARG 147 1HH1 ARG 147 115.519 -18.731 -1.596 1058 HH12 ARG 147 2HH1 ARG 147 114.134 -17.793 -2.045 1059 HH21 ARG 147 1HH2 ARG 147 115.117 -17.368 -5.330 1060 HH22 ARG 147 2HH2 ARG 147 113.911 -17.031 -4.133 1061 H PHE 148 H PHE 148 120.128 -19.111 1.855 1062 HA PHE 148 HA PHE 148 122.312 -21.043 1.769 1063 HB2 PHE 148 1HB PHE 148 123.394 -18.866 2.268 1064 HB3 PHE 148 2HB PHE 148 122.359 -18.700 3.674 1065 HD1 PHE 148 HD1 PHE 148 122.716 -20.073 5.667 1066 HD2 PHE 148 HD2 PHE 148 125.233 -20.463 2.210 1067 HE1 PHE 148 HE1 PHE 148 124.365 -21.347 7.013 1068 HE2 PHE 148 HE2 PHE 148 126.883 -21.737 3.554 1069 HZ PHE 148 HZ PHE 148 126.448 -22.179 5.956 Start of MODEL 5 1 H1 ALA 1 3H ALA 1 115.371 -25.829 8.125 2 H2 ALA 1 2H ALA 1 116.531 -25.564 6.913 3 H3 ALA 1 HT3 ALA 1 114.878 -25.584 6.519 4 HA ALA 1 HA ALA 1 114.488 -23.511 7.330 5 HB1 ALA 1 2HB ALA 1 116.659 -24.270 9.250 6 HB2 ALA 1 3HB ALA 1 115.044 -23.642 9.579 7 HB3 ALA 1 1HB ALA 1 116.310 -22.558 9.003 8 H THR 2 H THR 2 114.878 -22.293 5.591 9 HA THR 2 HA THR 2 117.692 -21.766 4.818 10 HB THR 2 HB THR 2 116.935 -21.594 2.499 11 HG1 THR 2 HG1 THR 2 114.762 -22.261 2.064 12 HG21 THR 2 3HG2 THR 2 115.889 -24.167 3.700 13 HG22 THR 2 1HG2 THR 2 117.607 -23.816 3.514 14 HG23 THR 2 2HG2 THR 2 116.573 -23.933 2.091 15 H SER 3 H SER 3 118.254 -19.679 4.388 16 HA SER 3 HA SER 3 116.158 -17.610 4.737 17 HB2 SER 3 1HB SER 3 119.033 -17.506 5.688 18 HB3 SER 3 2HB SER 3 117.844 -16.218 5.848 19 HG SER 3 HG SER 3 117.518 -17.232 7.693 20 H THR 4 H THR 4 116.353 -15.754 3.463 21 HA THR 4 HA THR 4 118.374 -15.873 1.298 22 HB THR 4 HB THR 4 115.482 -15.043 0.969 23 HG1 THR 4 HG1 THR 4 116.840 -17.471 0.598 24 HG21 THR 4 3HG2 THR 4 116.281 -15.496 -1.497 25 HG22 THR 4 1HG2 THR 4 117.886 -15.225 -0.818 26 HG23 THR 4 2HG2 THR 4 116.662 -13.959 -0.720 27 H VAL 5 H VAL 5 119.424 -14.004 0.906 28 HA VAL 5 HA VAL 5 118.344 -11.517 2.120 29 HB VAL 5 HB VAL 5 121.261 -12.325 1.969 30 HG11 VAL 5 1HG1 VAL 5 121.495 -10.321 3.495 31 HG12 VAL 5 2HG1 VAL 5 119.816 -9.928 3.128 32 HG13 VAL 5 3HG1 VAL 5 121.022 -9.929 1.842 33 HG21 VAL 5 3HG2 VAL 5 120.041 -13.655 3.646 34 HG22 VAL 5 1HG2 VAL 5 119.363 -12.178 4.335 35 HG23 VAL 5 2HG2 VAL 5 121.097 -12.486 4.438 36 H THR 6 H THR 6 118.158 -9.859 0.729 37 HA THR 6 HA THR 6 119.848 -9.812 -1.670 38 HB THR 6 HB THR 6 117.746 -10.949 -2.299 39 HG1 THR 6 HG1 THR 6 117.877 -9.948 -4.124 40 HG21 THR 6 3HG2 THR 6 116.474 -8.342 -1.436 41 HG22 THR 6 1HG2 THR 6 116.197 -9.934 -0.729 42 HG23 THR 6 2HG2 THR 6 115.655 -9.593 -2.372 43 H GLY 7 H GLY 7 119.973 -7.763 -2.705 44 HA2 GLY 7 1HA GLY 7 118.806 -5.472 -1.273 45 HA3 GLY 7 2HA GLY 7 120.557 -5.517 -1.496 46 H GLY 8 H GLY 8 118.642 -3.571 -2.622 47 HA2 GLY 8 1HA GLY 8 119.400 -3.860 -5.429 48 HA3 GLY 8 2HA GLY 8 117.673 -3.864 -5.096 49 H TYR 9 H TYR 9 118.595 -2.001 -6.731 50 HA TYR 9 HA TYR 9 118.559 0.499 -5.142 51 HB2 TYR 9 1HB TYR 9 120.708 0.155 -6.307 52 HB3 TYR 9 2HB TYR 9 119.853 -0.002 -7.829 53 HD1 TYR 9 HD2 TYR 9 120.979 2.306 -5.205 54 HD2 TYR 9 HD1 TYR 9 118.884 1.957 -8.936 55 HE1 TYR 9 HE2 TYR 9 121.123 4.763 -5.514 56 HE2 TYR 9 HE1 TYR 9 119.029 4.413 -9.247 57 HH TYR 9 HH TYR 9 120.965 6.303 -8.072 58 H ALA 10 H ALA 10 117.093 2.060 -5.773 59 HA ALA 10 HA ALA 10 115.485 1.539 -8.188 60 HB1 ALA 10 1HB ALA 10 113.461 1.493 -7.094 61 HB2 ALA 10 2HB ALA 10 114.059 2.424 -5.721 62 HB3 ALA 10 3HB ALA 10 114.479 0.719 -5.879 63 H GLN 11 H GLN 11 114.619 3.317 -9.169 64 HA GLN 11 HA GLN 11 115.269 5.968 -8.019 65 HB2 GLN 11 1HB GLN 11 115.043 5.126 -10.923 66 HB3 GLN 11 2HB GLN 11 115.277 6.786 -10.370 67 HG2 GLN 11 1HG GLN 11 117.390 6.172 -9.310 68 HG3 GLN 11 2HG GLN 11 117.151 4.485 -9.756 69 HE21 GLN 11 1HE2 GLN 11 119.455 5.950 -10.621 70 HE22 GLN 11 2HE2 GLN 11 119.366 6.136 -12.306 71 H SER 12 H SER 12 113.600 7.517 -7.994 72 HA SER 12 HA SER 12 110.911 6.412 -8.615 73 HB2 SER 12 1HB SER 12 111.669 8.262 -6.342 74 HB3 SER 12 2HB SER 12 110.071 7.600 -6.668 75 HG SER 12 HG SER 12 112.432 6.112 -6.111 76 H ASP 13 H ASP 13 109.532 7.659 -9.707 77 HA ASP 13 HA ASP 13 110.327 10.451 -10.319 78 HB2 ASP 13 1HB ASP 13 108.754 8.493 -12.021 79 HB3 ASP 13 2HB ASP 13 109.065 10.176 -12.435 80 H ALA 14 H ALA 14 108.694 12.019 -10.076 81 HA ALA 14 HA ALA 14 106.197 11.050 -8.822 82 HB1 ALA 14 1HB ALA 14 108.016 13.234 -7.786 83 HB2 ALA 14 2HB ALA 14 107.732 11.666 -7.032 84 HB3 ALA 14 3HB ALA 14 106.423 12.844 -7.138 85 H GLN 15 H GLN 15 104.628 11.706 -10.053 86 HA GLN 15 HA GLN 15 104.718 14.087 -11.671 87 HB2 GLN 15 1HB GLN 15 102.443 12.213 -10.966 88 HB3 GLN 15 2HB GLN 15 102.326 13.535 -12.129 89 HG2 GLN 15 1HG GLN 15 104.087 12.535 -13.496 90 HG3 GLN 15 2HG GLN 15 104.308 11.249 -12.313 91 HE21 GLN 15 1HE2 GLN 15 103.614 10.671 -15.027 92 HE22 GLN 15 2HE2 GLN 15 102.044 10.028 -15.052 93 H GLY 16 H GLY 16 104.307 16.055 -11.018 94 HA2 GLY 16 1HA GLY 16 103.125 17.771 -9.900 95 HA3 GLY 16 2HA GLY 16 102.540 16.588 -8.742 96 H GLN 17 H GLN 17 105.528 15.621 -8.631 97 HA GLN 17 HA GLN 17 106.575 17.834 -6.965 98 HB2 GLN 17 1HB GLN 17 106.053 15.688 -5.750 99 HB3 GLN 17 2HB GLN 17 107.279 14.902 -6.742 100 HG2 GLN 17 1HG GLN 17 108.952 16.566 -5.920 101 HG3 GLN 17 2HG GLN 17 107.719 17.220 -4.843 102 HE21 GLN 17 1HE2 GLN 17 107.901 16.387 -2.769 103 HE22 GLN 17 2HE2 GLN 17 108.437 14.822 -2.388 104 H MET 18 H MET 18 108.793 18.363 -7.209 105 HA MET 18 HA MET 18 109.877 17.599 -9.833 106 HB2 MET 18 1HB MET 18 110.625 19.835 -7.937 107 HB3 MET 18 2HB MET 18 111.389 19.540 -9.498 108 HG2 MET 18 1HG MET 18 109.118 19.739 -10.566 109 HG3 MET 18 2HG MET 18 108.483 20.234 -8.997 110 HE1 MET 18 3HE MET 18 111.984 21.139 -10.856 111 HE2 MET 18 1HE MET 18 111.282 22.432 -11.836 112 HE3 MET 18 2HE MET 18 110.635 20.796 -11.935 113 H ASN 19 H ASN 19 112.268 17.372 -9.978 114 HA ASN 19 HA ASN 19 114.289 16.480 -9.399 115 HB2 ASN 19 1HB ASN 19 114.033 17.991 -7.375 116 HB3 ASN 19 2HB ASN 19 113.434 16.578 -6.509 117 HD21 ASN 19 1HD2 ASN 19 115.411 16.791 -5.119 118 HD22 ASN 19 2HD2 ASN 19 116.891 16.186 -5.687 119 H LYS 20 H LYS 20 114.683 14.471 -9.899 120 HA LYS 20 HA LYS 20 113.041 12.251 -9.157 121 HB2 LYS 20 1HB LYS 20 114.408 12.373 -11.248 122 HB3 LYS 20 2HB LYS 20 115.863 12.248 -10.261 123 HG2 LYS 20 1HG LYS 20 115.152 10.067 -9.422 124 HG3 LYS 20 2HG LYS 20 113.631 10.197 -10.306 125 HD2 LYS 20 1HD LYS 20 115.128 8.816 -11.610 126 HD3 LYS 20 2HD LYS 20 114.966 10.369 -12.433 127 HE2 LYS 20 1HE LYS 20 117.090 11.120 -11.647 128 HE3 LYS 20 2HE LYS 20 117.207 9.800 -10.484 129 HZ1 LYS 20 3HZ LYS 20 118.560 9.405 -12.462 130 HZ2 LYS 20 1HZ LYS 20 117.173 9.483 -13.438 131 HZ3 LYS 20 2HZ LYS 20 117.339 8.234 -12.299 132 H MET 21 H MET 21 113.704 10.420 -7.812 133 HA MET 21 HA MET 21 115.585 11.234 -5.655 134 HB2 MET 21 1HB MET 21 112.947 9.771 -5.404 135 HB3 MET 21 2HB MET 21 114.083 10.048 -4.084 136 HG2 MET 21 1HG MET 21 113.906 12.515 -4.538 137 HG3 MET 21 2HG MET 21 112.621 12.158 -5.692 138 HE1 MET 21 3HE MET 21 110.658 10.793 -5.229 139 HE2 MET 21 1HE MET 21 109.817 10.632 -3.682 140 HE3 MET 21 2HE MET 21 111.172 9.574 -4.065 141 H GLY 22 H GLY 22 116.633 9.461 -4.528 142 HA2 GLY 22 1HA GLY 22 116.596 6.889 -5.991 143 HA3 GLY 22 2HA GLY 22 118.128 7.712 -5.706 144 H GLY 23 H GLY 23 116.925 5.089 -4.695 145 HA2 GLY 23 1HA GLY 23 117.759 5.468 -1.922 146 HA3 GLY 23 2HA GLY 23 116.105 4.922 -2.165 147 H PHE 24 H PHE 24 117.754 3.396 -0.716 148 HA PHE 24 HA PHE 24 118.414 1.105 -2.483 149 HB2 PHE 24 1HB PHE 24 119.680 1.864 0.157 150 HB3 PHE 24 2HB PHE 24 120.070 0.443 -0.791 151 HD1 PHE 24 HD1 PHE 24 121.390 0.626 -2.848 152 HD2 PHE 24 HD2 PHE 24 120.418 4.086 -0.495 153 HE1 PHE 24 HE1 PHE 24 123.110 1.936 -4.063 154 HE2 PHE 24 HE2 PHE 24 122.137 5.396 -1.711 155 HZ PHE 24 HZ PHE 24 123.484 4.321 -3.494 156 H ASN 25 H ASN 25 117.807 -0.970 -1.720 157 HA ASN 25 HA ASN 25 116.012 -0.989 0.641 158 HB2 ASN 25 1HB ASN 25 115.570 -2.394 -2.005 159 HB3 ASN 25 2HB ASN 25 114.555 -2.563 -0.576 160 HD21 ASN 25 1HD2 ASN 25 113.433 -1.605 -2.990 161 HD22 ASN 25 2HD2 ASN 25 113.040 0.036 -2.804 162 H LEU 26 H LEU 26 116.254 -2.693 2.013 163 HA LEU 26 HA LEU 26 117.947 -4.959 1.123 164 HB2 LEU 26 1HB LEU 26 119.179 -3.441 2.686 165 HB3 LEU 26 2HB LEU 26 117.932 -3.746 3.895 166 HG LEU 26 HG LEU 26 118.428 -6.239 3.557 167 HD11 LEU 26 1HD1 LEU 26 120.769 -4.973 2.116 168 HD12 LEU 26 2HD1 LEU 26 119.656 -6.193 1.500 169 HD13 LEU 26 3HD1 LEU 26 120.819 -6.616 2.756 170 HD21 LEU 26 3HD2 LEU 26 120.728 -4.586 4.631 171 HD22 LEU 26 1HD2 LEU 26 120.215 -6.185 5.166 172 HD23 LEU 26 2HD2 LEU 26 119.200 -4.780 5.491 173 H LYS 27 H LYS 27 117.157 -6.974 1.643 174 HA LYS 27 HA LYS 27 114.556 -7.016 3.070 175 HB2 LYS 27 1HB LYS 27 115.327 -8.493 0.551 176 HB3 LYS 27 2HB LYS 27 113.818 -8.716 1.436 177 HG2 LYS 27 1HG LYS 27 113.321 -6.292 1.130 178 HG3 LYS 27 2HG LYS 27 114.777 -6.146 0.147 179 HD2 LYS 27 1HD LYS 27 113.866 -7.889 -1.392 180 HD3 LYS 27 2HD LYS 27 112.375 -7.894 -0.450 181 HE2 LYS 27 1HE LYS 27 111.913 -6.402 -2.219 182 HE3 LYS 27 2HE LYS 27 112.332 -5.343 -0.872 183 HZ1 LYS 27 3HZ LYS 27 113.445 -5.099 -3.233 184 HZ2 LYS 27 1HZ LYS 27 114.503 -6.263 -2.597 185 HZ3 LYS 27 2HZ LYS 27 114.302 -4.774 -1.802 186 H TYR 28 H TYR 28 114.157 -8.661 4.414 187 HA TYR 28 HA TYR 28 116.131 -10.871 4.579 188 HB2 TYR 28 1HB TYR 28 116.206 -9.347 6.533 189 HB3 TYR 28 2HB TYR 28 114.504 -9.655 6.818 190 HD1 TYR 28 HD2 TYR 28 117.911 -11.021 7.012 191 HD2 TYR 28 HD1 TYR 28 113.747 -11.800 7.721 192 HE1 TYR 28 HE2 TYR 28 118.514 -12.994 8.388 193 HE2 TYR 28 HE1 TYR 28 114.351 -13.772 9.099 194 HH TYR 28 HH TYR 28 117.747 -14.560 9.788 195 H ARG 29 H ARG 29 115.317 -12.934 4.604 196 HA ARG 29 HA ARG 29 112.380 -13.243 4.573 197 HB2 ARG 29 1HB ARG 29 113.273 -13.166 2.249 198 HB3 ARG 29 2HB ARG 29 114.279 -14.564 2.625 199 HG2 ARG 29 1HG ARG 29 112.218 -15.839 3.222 200 HG3 ARG 29 2HG ARG 29 111.250 -14.457 2.709 201 HD2 ARG 29 1HD ARG 29 113.190 -15.985 0.951 202 HD3 ARG 29 2HD ARG 29 111.436 -16.142 0.911 203 HE ARG 29 HE ARG 29 112.361 -13.430 0.547 204 HH11 ARG 29 1HH1 ARG 29 111.647 -16.434 -1.123 205 HH12 ARG 29 2HH1 ARG 29 111.393 -15.644 -2.643 206 HH21 ARG 29 1HH2 ARG 29 112.021 -12.469 -1.436 207 HH22 ARG 29 2HH2 ARG 29 111.602 -13.427 -2.816 208 H TYR 30 H TYR 30 111.588 -15.056 5.523 209 HA TYR 30 HA TYR 30 113.527 -17.073 6.496 210 HB2 TYR 30 1HB TYR 30 112.844 -15.550 8.321 211 HB3 TYR 30 2HB TYR 30 111.166 -15.956 8.015 212 HD1 TYR 30 HD1 TYR 30 114.413 -17.226 9.250 213 HD2 TYR 30 HD2 TYR 30 110.219 -18.034 8.790 214 HE1 TYR 30 HE1 TYR 30 114.616 -19.156 10.794 215 HE2 TYR 30 HE2 TYR 30 110.422 -19.964 10.334 216 HH TYR 30 HH TYR 30 112.081 -20.592 12.282 217 H GLU 31 H GLU 31 112.901 -19.176 6.297 218 HA GLU 31 HA GLU 31 110.141 -19.730 5.395 219 HB2 GLU 31 1HB GLU 31 112.679 -20.791 4.133 220 HB3 GLU 31 2HB GLU 31 111.044 -21.313 3.724 221 HG2 GLU 31 1HG GLU 31 110.478 -18.966 3.120 222 HG3 GLU 31 2HG GLU 31 112.142 -18.502 3.446 223 H GLU 32 H GLU 32 109.315 -21.743 5.951 224 HA GLU 32 HA GLU 32 110.772 -23.140 8.083 225 HB2 GLU 32 1HB GLU 32 108.400 -22.403 8.437 226 HB3 GLU 32 2HB GLU 32 107.915 -23.537 7.175 227 HG2 GLU 32 1HG GLU 32 108.968 -25.382 8.471 228 HG3 GLU 32 2HG GLU 32 109.348 -24.238 9.750 229 H ASP 33 H ASP 33 111.277 -25.312 7.996 230 HA ASP 33 HA ASP 33 112.033 -26.261 5.444 231 HB2 ASP 33 1HB ASP 33 113.219 -26.773 7.565 232 HB3 ASP 33 2HB ASP 33 111.878 -27.820 8.026 233 H ASN 34 H ASN 34 109.378 -27.281 7.617 234 HA ASN 34 HA ASN 34 108.581 -29.271 5.584 235 HB2 ASN 34 1HB ASN 34 109.013 -29.919 8.007 236 HB3 ASN 34 2HB ASN 34 107.516 -29.069 8.390 237 HD21 ASN 34 1HD2 ASN 34 105.731 -30.430 8.403 238 HD22 ASN 34 2HD2 ASN 34 105.561 -31.825 7.450 239 H SER 35 H SER 35 107.574 -26.218 6.806 240 HA SER 35 HA SER 35 105.181 -26.398 5.136 241 HB2 SER 35 1HB SER 35 104.293 -26.993 7.314 242 HB3 SER 35 2HB SER 35 105.118 -25.631 8.066 243 HG SER 35 HG SER 35 103.175 -25.435 5.998 244 HA PRO 36 HA PRO 36 107.848 -22.623 5.022 245 HB2 PRO 36 1HB PRO 36 108.027 -22.289 2.323 246 HB3 PRO 36 2HB PRO 36 109.059 -23.410 3.232 247 HG2 PRO 36 1HG PRO 36 106.650 -23.973 1.587 248 HG3 PRO 36 2HG PRO 36 108.153 -24.898 1.746 249 HD2 PRO 36 1HD PRO 36 105.826 -25.570 3.041 250 HD3 PRO 36 2HD PRO 36 107.444 -25.990 3.643 251 H LEU 37 H LEU 37 107.100 -20.654 5.251 252 HA LEU 37 HA LEU 37 104.939 -19.664 3.490 253 HB2 LEU 37 1HB LEU 37 104.170 -19.943 5.856 254 HB3 LEU 37 2HB LEU 37 105.455 -18.847 6.367 255 HG LEU 37 HG LEU 37 104.471 -17.164 4.700 256 HD11 LEU 37 1HD1 LEU 37 103.027 -18.390 3.334 257 HD12 LEU 37 2HD1 LEU 37 101.899 -17.668 4.482 258 HD13 LEU 37 3HD1 LEU 37 102.404 -19.346 4.679 259 HD21 LEU 37 3HD2 LEU 37 104.147 -16.727 7.012 260 HD22 LEU 37 1HD2 LEU 37 103.048 -18.093 7.199 261 HD23 LEU 37 2HD2 LEU 37 102.528 -16.655 6.320 262 H GLY 38 H GLY 38 105.407 -17.652 2.493 263 HA2 GLY 38 1HA GLY 38 108.242 -16.920 2.738 264 HA3 GLY 38 2HA GLY 38 107.166 -16.485 1.411 265 H VAL 39 H VAL 39 108.703 -15.305 4.114 266 HA VAL 39 HA VAL 39 106.861 -12.978 4.183 267 HB VAL 39 HB VAL 39 106.754 -14.242 6.297 268 HG11 VAL 39 1HG1 VAL 39 109.710 -13.636 6.560 269 HG12 VAL 39 2HG1 VAL 39 109.065 -15.213 6.110 270 HG13 VAL 39 3HG1 VAL 39 108.706 -14.534 7.697 271 HG21 VAL 39 3HG2 VAL 39 106.743 -11.666 6.154 272 HG22 VAL 39 1HG2 VAL 39 108.387 -11.751 6.786 273 HG23 VAL 39 2HG2 VAL 39 107.043 -12.383 7.737 274 H ILE 40 H ILE 40 107.770 -11.122 3.616 275 HA ILE 40 HA ILE 40 110.726 -10.888 3.726 276 HB ILE 40 HB ILE 40 108.906 -9.826 1.546 277 HG12 ILE 40 1HG1 ILE 40 110.972 -12.044 1.416 278 HG13 ILE 40 2HG1 ILE 40 109.234 -12.323 1.533 279 HG21 ILE 40 1HG2 ILE 40 110.951 -8.466 2.063 280 HG22 ILE 40 2HG2 ILE 40 110.966 -9.165 0.445 281 HG23 ILE 40 3HG2 ILE 40 111.932 -9.893 1.728 282 HD11 ILE 40 3HD1 ILE 40 109.065 -10.771 -0.542 283 HD12 ILE 40 1HD1 ILE 40 109.638 -12.422 -0.784 284 HD13 ILE 40 2HD1 ILE 40 110.790 -11.087 -0.731 285 H GLY 41 H GLY 41 111.412 -9.185 4.838 286 HA2 GLY 41 1HA GLY 41 109.594 -6.845 5.122 287 HA3 GLY 41 2HA GLY 41 110.764 -7.333 6.350 288 H SER 42 H SER 42 110.311 -4.983 4.276 289 HA SER 42 HA SER 42 113.159 -4.769 3.497 290 HB2 SER 42 1HB SER 42 111.531 -5.301 1.588 291 HB3 SER 42 2HB SER 42 110.880 -3.688 1.846 292 HG SER 42 HG SER 42 112.571 -3.747 0.277 293 H PHE 43 H PHE 43 114.131 -2.832 3.959 294 HA PHE 43 HA PHE 43 112.352 -0.577 4.720 295 HB2 PHE 43 1HB PHE 43 114.070 0.206 6.249 296 HB3 PHE 43 2HB PHE 43 113.511 -1.391 6.694 297 HD1 PHE 43 HD1 PHE 43 114.983 -3.339 6.496 298 HD2 PHE 43 HD2 PHE 43 116.324 0.601 5.435 299 HE1 PHE 43 HE1 PHE 43 117.334 -4.129 6.533 300 HE2 PHE 43 HE2 PHE 43 118.675 -0.188 5.470 301 HZ PHE 43 HZ PHE 43 119.180 -2.553 6.022 302 H THR 44 H THR 44 112.648 1.278 3.670 303 HA THR 44 HA THR 44 114.778 1.317 1.610 304 HB THR 44 HB THR 44 112.022 2.571 1.530 305 HG1 THR 44 HG1 THR 44 111.915 0.341 1.358 306 HG21 THR 44 3HG2 THR 44 113.225 3.887 0.059 307 HG22 THR 44 1HG2 THR 44 112.794 2.557 -1.015 308 HG23 THR 44 2HG2 THR 44 114.397 2.617 -0.286 309 H TYR 45 H TYR 45 116.115 2.978 1.564 310 HA TYR 45 HA TYR 45 115.439 5.431 3.092 311 HB2 TYR 45 1HB TYR 45 117.355 4.258 4.062 312 HB3 TYR 45 2HB TYR 45 118.143 4.212 2.496 313 HD1 TYR 45 HD1 TYR 45 116.339 6.988 4.254 314 HD2 TYR 45 HD2 TYR 45 120.056 5.539 2.663 315 HE1 TYR 45 HE1 TYR 45 117.400 9.176 4.739 316 HE2 TYR 45 HE2 TYR 45 121.118 7.728 3.149 317 HH TYR 45 HH TYR 45 119.235 10.485 4.214 318 H THR 46 H THR 46 115.075 7.134 1.821 319 HA THR 46 HA THR 46 116.265 7.175 -0.893 320 HB THR 46 HB THR 46 113.508 8.160 -0.130 321 HG1 THR 46 HG1 THR 46 112.770 6.297 -1.039 322 HG21 THR 46 3HG2 THR 46 114.474 9.325 -2.040 323 HG22 THR 46 1HG2 THR 46 113.231 8.212 -2.609 324 HG23 THR 46 2HG2 THR 46 114.936 7.792 -2.777 325 H GLU 47 H GLU 47 116.942 9.142 -1.673 326 HA GLU 47 HA GLU 47 116.741 11.472 0.116 327 HB2 GLU 47 1HB GLU 47 118.886 10.233 0.549 328 HB3 GLU 47 2HB GLU 47 119.336 10.534 -1.128 329 HG2 GLU 47 1HG GLU 47 119.104 12.978 -0.724 330 HG3 GLU 47 2HG GLU 47 118.734 12.646 0.963 331 H LYS 48 H LYS 48 116.880 13.464 -0.937 332 HA LYS 48 HA LYS 48 116.380 13.399 -3.812 333 HB2 LYS 48 1HB LYS 48 116.352 15.668 -1.804 334 HB3 LYS 48 2HB LYS 48 115.920 15.826 -3.507 335 HG2 LYS 48 1HG LYS 48 114.150 14.099 -3.183 336 HG3 LYS 48 2HG LYS 48 114.537 14.066 -1.463 337 HD2 LYS 48 1HD LYS 48 114.045 16.514 -1.349 338 HD3 LYS 48 2HD LYS 48 113.534 16.455 -3.036 339 HE2 LYS 48 1HE LYS 48 111.807 14.792 -2.464 340 HE3 LYS 48 2HE LYS 48 112.315 14.844 -0.775 341 HZ1 LYS 48 3HZ LYS 48 111.242 17.122 -2.349 342 HZ2 LYS 48 1HZ LYS 48 111.777 17.211 -0.742 343 HZ3 LYS 48 2HZ LYS 48 110.418 16.270 -1.133 344 H SER 49 H SER 49 117.761 14.181 -5.356 345 HA SER 49 HA SER 49 120.467 14.943 -4.427 346 HB2 SER 49 1HB SER 49 120.319 12.873 -5.788 347 HB3 SER 49 2HB SER 49 119.609 13.809 -7.099 348 HG SER 49 HG SER 49 121.543 15.109 -7.018 349 H ARG 50 H ARG 50 121.286 16.871 -4.941 350 HA ARG 50 HA ARG 50 120.000 18.470 -7.059 351 HB2 ARG 50 1HB ARG 50 120.663 19.428 -4.264 352 HB3 ARG 50 2HB ARG 50 120.166 20.472 -5.596 353 HG2 ARG 50 1HG ARG 50 118.048 19.204 -5.788 354 HG3 ARG 50 2HG ARG 50 118.538 18.195 -4.427 355 HD2 ARG 50 1HD ARG 50 117.093 19.916 -3.558 356 HD3 ARG 50 2HD ARG 50 118.735 20.293 -3.045 357 HE ARG 50 HE ARG 50 118.411 21.642 -5.422 358 HH11 ARG 50 1HH1 ARG 50 116.712 21.647 -2.351 359 HH12 ARG 50 2HH1 ARG 50 116.217 23.299 -2.513 360 HH21 ARG 50 1HH2 ARG 50 117.746 23.764 -5.576 361 HH22 ARG 50 2HH2 ARG 50 116.796 24.482 -4.318 362 H THR 51 H THR 51 121.367 20.091 -7.979 363 HA THR 51 HA THR 51 124.138 19.321 -8.085 364 HB THR 51 HB THR 51 124.362 21.144 -9.703 365 HG1 THR 51 HG1 THR 51 121.669 21.733 -9.050 366 HG21 THR 51 3HG2 THR 51 122.560 20.419 -11.300 367 HG22 THR 51 1HG2 THR 51 121.831 19.503 -9.981 368 HG23 THR 51 2HG2 THR 51 123.442 19.081 -10.564 369 H ALA 52 H ALA 52 125.935 20.535 -7.426 370 HA ALA 52 HA ALA 52 125.371 22.382 -5.195 371 HB1 ALA 52 1HB ALA 52 127.915 21.923 -4.795 372 HB2 ALA 52 2HB ALA 52 127.644 20.540 -5.856 373 HB3 ALA 52 3HB ALA 52 126.731 20.691 -4.355 374 H SER 53 H SER 53 125.974 24.459 -5.261 375 HA SER 53 HA SER 53 128.120 25.409 -6.925 376 HB2 SER 53 1HB SER 53 125.402 26.530 -7.586 377 HB3 SER 53 2HB SER 53 126.913 26.721 -8.465 378 HG SER 53 HG SER 53 125.127 25.033 -9.054 379 H SER 54 H SER 54 125.080 26.807 -5.686 380 HA SER 54 HA SER 54 126.255 29.118 -4.599 381 HB2 SER 54 1HB SER 54 123.708 27.738 -3.722 382 HB3 SER 54 2HB SER 54 124.148 29.413 -3.406 383 HG SER 54 HG SER 54 124.031 28.315 -6.016 384 H GLY 55 H GLY 55 125.748 25.908 -3.228 385 HA2 GLY 55 1HA GLY 55 127.132 25.069 -1.463 386 HA3 GLY 55 2HA GLY 55 127.332 26.712 -0.879 387 H ASP 56 H ASP 56 124.135 26.668 -1.479 388 HA ASP 56 HA ASP 56 123.457 26.071 1.284 389 HB2 ASP 56 1HB ASP 56 122.512 28.048 0.100 390 HB3 ASP 56 2HB ASP 56 121.672 26.952 -0.995 391 H TYR 57 H TYR 57 122.804 24.127 1.948 392 HA TYR 57 HA TYR 57 121.798 22.204 -0.070 393 HB2 TYR 57 1HB TYR 57 123.120 21.673 2.592 394 HB3 TYR 57 2HB TYR 57 122.578 20.456 1.452 395 HD1 TYR 57 HD1 TYR 57 123.720 20.264 -0.787 396 HD2 TYR 57 HD2 TYR 57 125.216 22.767 2.367 397 HE1 TYR 57 HE1 TYR 57 125.932 20.352 -1.906 398 HE2 TYR 57 HE2 TYR 57 127.428 22.856 1.247 399 HH TYR 57 HH TYR 57 128.661 21.110 -0.524 400 H ASN 58 H ASN 58 119.840 21.315 0.183 401 HA ASN 58 HA ASN 58 118.279 22.053 2.580 402 HB2 ASN 58 1HB ASN 58 117.482 22.689 0.235 403 HB3 ASN 58 2HB ASN 58 117.192 20.970 -0.019 404 HD21 ASN 58 1HD2 ASN 58 115.102 20.333 0.503 405 HD22 ASN 58 2HD2 ASN 58 114.107 21.098 1.646 406 H LYS 59 H LYS 59 117.836 20.507 4.026 407 HA LYS 59 HA LYS 59 118.694 17.794 3.505 408 HB2 LYS 59 1HB LYS 59 118.992 19.054 5.699 409 HB3 LYS 59 2HB LYS 59 117.269 18.792 5.970 410 HG2 LYS 59 1HG LYS 59 117.774 16.300 5.480 411 HG3 LYS 59 2HG LYS 59 119.464 16.736 5.742 412 HD2 LYS 59 1HD LYS 59 117.281 17.378 7.737 413 HD3 LYS 59 2HD LYS 59 118.228 15.891 7.800 414 HE2 LYS 59 1HE LYS 59 119.638 18.541 7.630 415 HE3 LYS 59 2HE LYS 59 119.020 17.976 9.181 416 HZ1 LYS 59 3HZ LYS 59 120.296 15.979 8.977 417 HZ2 LYS 59 1HZ LYS 59 121.334 17.300 8.743 418 HZ3 LYS 59 2HZ LYS 59 120.800 16.395 7.409 419 H ASN 60 H ASN 60 117.436 16.435 2.438 420 HA ASN 60 HA ASN 60 114.572 16.279 3.175 421 HB2 ASN 60 1HB ASN 60 115.788 15.838 0.434 422 HB3 ASN 60 2HB ASN 60 114.094 15.594 0.855 423 HD21 ASN 60 1HD2 ASN 60 113.278 17.759 2.198 424 HD22 ASN 60 2HD2 ASN 60 113.599 19.202 1.364 425 H GLN 61 H GLN 61 113.952 14.298 3.879 426 HA GLN 61 HA GLN 61 115.482 11.948 3.012 427 HB2 GLN 61 1HB GLN 61 115.833 11.148 5.277 428 HB3 GLN 61 2HB GLN 61 116.570 12.736 5.087 429 HG2 GLN 61 1HG GLN 61 114.430 13.713 6.060 430 HG3 GLN 61 2HG GLN 61 113.962 12.064 6.470 431 HE21 GLN 61 1HE2 GLN 61 114.220 12.093 8.744 432 HE22 GLN 61 2HE2 GLN 61 115.687 12.459 9.518 433 H TYR 62 H TYR 62 114.327 10.069 2.923 434 HA TYR 62 HA TYR 62 111.615 10.048 4.094 435 HB2 TYR 62 1HB TYR 62 111.538 10.653 1.674 436 HB3 TYR 62 2HB TYR 62 112.319 9.130 1.304 437 HD1 TYR 62 HD1 TYR 62 109.235 10.718 2.587 438 HD2 TYR 62 HD2 TYR 62 111.083 7.062 1.297 439 HE1 TYR 62 HE1 TYR 62 107.009 9.627 2.493 440 HE2 TYR 62 HE2 TYR 62 108.858 5.970 1.204 441 HH TYR 62 HH TYR 62 105.909 7.725 2.169 442 H TYR 63 H TYR 63 111.119 8.173 5.105 443 HA TYR 63 HA TYR 63 112.800 5.789 4.559 444 HB2 TYR 63 1HB TYR 63 111.756 6.678 7.253 445 HB3 TYR 63 2HB TYR 63 112.697 5.235 6.933 446 HD1 TYR 63 HD1 TYR 63 115.105 5.387 6.438 447 HD2 TYR 63 HD2 TYR 63 112.767 8.876 7.338 448 HE1 TYR 63 HE1 TYR 63 117.185 6.682 6.821 449 HE2 TYR 63 HE2 TYR 63 114.847 10.171 7.721 450 HH TYR 63 HH TYR 63 118.046 8.708 7.189 451 H GLY 64 H GLY 64 111.656 3.875 4.347 452 HA2 GLY 64 1HA GLY 64 108.773 3.924 5.000 453 HA3 GLY 64 2HA GLY 64 109.278 3.539 3.359 454 H ILE 65 H ILE 65 107.961 1.994 5.710 455 HA ILE 65 HA ILE 65 109.779 -0.350 5.601 456 HB ILE 65 HB ILE 65 108.794 -1.077 7.722 457 HG12 ILE 65 1HG1 ILE 65 107.340 1.589 7.693 458 HG13 ILE 65 2HG1 ILE 65 106.569 0.033 7.395 459 HG21 ILE 65 1HG2 ILE 65 109.705 1.806 7.916 460 HG22 ILE 65 2HG2 ILE 65 110.800 0.456 7.616 461 HG23 ILE 65 3HG2 ILE 65 109.898 0.541 9.129 462 HD11 ILE 65 3HD1 ILE 65 107.362 -0.738 9.640 463 HD12 ILE 65 1HD1 ILE 65 106.239 0.618 9.727 464 HD13 ILE 65 2HD1 ILE 65 107.968 0.890 9.941 465 H THR 66 H THR 66 108.977 -2.247 4.863 466 HA THR 66 HA THR 66 106.096 -2.389 4.220 467 HB THR 66 HB THR 66 106.638 -3.378 2.041 468 HG1 THR 66 HG1 THR 66 109.256 -2.942 2.978 469 HG21 THR 66 3HG2 THR 66 106.251 -1.089 1.795 470 HG22 THR 66 1HG2 THR 66 107.846 -1.274 1.070 471 HG23 THR 66 2HG2 THR 66 107.692 -0.641 2.707 472 H ALA 67 H ALA 67 105.298 -4.541 3.889 473 HA ALA 67 HA ALA 67 107.057 -6.803 4.426 474 HB1 ALA 67 1HB ALA 67 104.541 -6.682 6.047 475 HB2 ALA 67 2HB ALA 67 105.973 -5.835 6.632 476 HB3 ALA 67 3HB ALA 67 106.029 -7.575 6.357 477 H GLY 68 H GLY 68 106.240 -8.743 3.535 478 HA2 GLY 68 1HA GLY 68 103.562 -8.661 2.359 479 HA3 GLY 68 2HA GLY 68 104.911 -8.776 1.251 480 HA PRO 69 HA PRO 69 104.183 -13.162 2.903 481 HB2 PRO 69 1HB PRO 69 101.705 -13.697 1.487 482 HB3 PRO 69 2HB PRO 69 102.067 -13.893 3.208 483 HG2 PRO 69 1HG PRO 69 100.357 -12.031 2.180 484 HG3 PRO 69 2HG PRO 69 101.171 -11.903 3.749 485 HD2 PRO 69 1HD PRO 69 101.845 -10.552 1.164 486 HD3 PRO 69 2HD PRO 69 101.985 -9.948 2.832 487 H ALA 70 H ALA 70 104.461 -15.075 1.396 488 HA ALA 70 HA ALA 70 104.514 -14.344 -1.455 489 HB1 ALA 70 1HB ALA 70 106.742 -14.611 -1.745 490 HB2 ALA 70 2HB ALA 70 106.853 -15.926 -0.580 491 HB3 ALA 70 3HB ALA 70 106.830 -14.254 -0.022 492 H TYR 71 H TYR 71 104.241 -16.074 -2.869 493 HA TYR 71 HA TYR 71 103.478 -18.639 -1.597 494 HB2 TYR 71 1HB TYR 71 102.134 -17.242 -3.912 495 HB3 TYR 71 2HB TYR 71 101.724 -18.837 -3.313 496 HD1 TYR 71 HD1 TYR 71 101.551 -15.220 -2.682 497 HD2 TYR 71 HD2 TYR 71 100.533 -19.120 -1.193 498 HE1 TYR 71 HE1 TYR 71 99.983 -14.192 -1.058 499 HE2 TYR 71 HE2 TYR 71 98.966 -18.090 0.429 500 HH TYR 71 HH TYR 71 99.017 -15.116 1.402 501 H ARG 72 H ARG 72 104.510 -20.364 -2.382 502 HA ARG 72 HA ARG 72 105.709 -20.197 -5.089 503 HB2 ARG 72 1HB ARG 72 107.327 -20.522 -3.214 504 HB3 ARG 72 2HB ARG 72 106.496 -22.024 -2.806 505 HG2 ARG 72 1HG ARG 72 106.938 -22.854 -5.118 506 HG3 ARG 72 2HG ARG 72 107.869 -21.389 -5.432 507 HD2 ARG 72 1HD ARG 72 108.468 -23.411 -3.255 508 HD3 ARG 72 2HD ARG 72 109.340 -23.263 -4.777 509 HE ARG 72 HE ARG 72 109.266 -20.791 -3.317 510 HH11 ARG 72 1HH1 ARG 72 110.967 -23.854 -3.543 511 HH12 ARG 72 2HH1 ARG 72 112.416 -23.214 -2.843 512 HH21 ARG 72 1HH2 ARG 72 111.158 -20.025 -2.422 513 HH22 ARG 72 2HH2 ARG 72 112.522 -21.072 -2.216 514 H ILE 73 H ILE 73 104.340 -21.147 -6.492 515 HA ILE 73 HA ILE 73 103.237 -23.795 -5.773 516 HB ILE 73 HB ILE 73 101.474 -22.090 -5.562 517 HG12 ILE 73 1HG1 ILE 73 99.873 -23.113 -7.218 518 HG13 ILE 73 2HG1 ILE 73 101.243 -23.961 -7.935 519 HG21 ILE 73 1HG2 ILE 73 102.628 -20.649 -7.420 520 HG22 ILE 73 2HG2 ILE 73 100.871 -20.623 -7.273 521 HG23 ILE 73 3HG2 ILE 73 101.637 -21.604 -8.521 522 HD11 ILE 73 3HD1 ILE 73 101.587 -25.287 -6.038 523 HD12 ILE 73 1HD1 ILE 73 99.828 -25.171 -6.096 524 HD13 ILE 73 2HD1 ILE 73 100.743 -24.159 -4.977 525 H ASN 74 H ASN 74 103.543 -25.329 -7.236 526 HA ASN 74 HA ASN 74 104.181 -26.422 -9.125 527 HB2 ASN 74 1HB ASN 74 103.074 -23.925 -10.418 528 HB3 ASN 74 2HB ASN 74 103.508 -25.391 -11.292 529 HD21 ASN 74 1HD2 ASN 74 100.800 -24.322 -11.155 530 HD22 ASN 74 2HD2 ASN 74 99.849 -25.468 -10.341 531 H ASP 75 H ASP 75 104.962 -23.234 -10.513 532 HA ASP 75 HA ASP 75 107.562 -24.080 -11.272 533 HB2 ASP 75 1HB ASP 75 106.363 -21.309 -11.093 534 HB3 ASP 75 2HB ASP 75 107.900 -21.689 -11.866 535 H TRP 76 H TRP 76 109.569 -23.588 -10.440 536 HA TRP 76 HA TRP 76 109.907 -23.498 -7.676 537 HB2 TRP 76 1HB TRP 76 111.796 -22.638 -9.868 538 HB3 TRP 76 2HB TRP 76 112.257 -22.861 -8.190 539 HD1 TRP 76 HD1 TRP 76 111.926 -25.431 -7.220 540 HE1 TRP 76 HE1 TRP 76 112.300 -27.669 -8.442 541 HE3 TRP 76 HE3 TRP 76 111.716 -23.837 -12.067 542 HZ2 TRP 76 HZ2 TRP 76 112.485 -28.656 -11.125 543 HZ3 TRP 76 HZ3 TRP 76 111.993 -25.440 -13.931 544 HH2 TRP 76 HH2 TRP 76 112.376 -27.845 -13.471 545 H ALA 77 H ALA 77 109.743 -20.855 -10.018 546 HA ALA 77 HA ALA 77 110.679 -18.769 -8.399 547 HB1 ALA 77 1HB ALA 77 110.427 -18.210 -10.652 548 HB2 ALA 77 2HB ALA 77 109.069 -17.374 -9.897 549 HB3 ALA 77 3HB ALA 77 108.806 -18.899 -10.743 550 H SER 78 H SER 78 109.664 -17.294 -7.065 551 HA SER 78 HA SER 78 106.948 -18.015 -6.122 552 HB2 SER 78 1HB SER 78 107.635 -17.379 -3.871 553 HB3 SER 78 2HB SER 78 108.714 -18.628 -4.484 554 HG SER 78 HG SER 78 109.162 -15.818 -4.458 555 H ILE 79 H ILE 79 105.632 -16.250 -5.411 556 HA ILE 79 HA ILE 79 106.559 -13.593 -6.363 557 HB ILE 79 HB ILE 79 104.286 -13.161 -7.183 558 HG12 ILE 79 1HG1 ILE 79 103.747 -16.085 -6.575 559 HG13 ILE 79 2HG1 ILE 79 103.147 -14.747 -5.594 560 HG21 ILE 79 1HG2 ILE 79 105.100 -15.794 -8.384 561 HG22 ILE 79 2HG2 ILE 79 106.166 -14.397 -8.526 562 HG23 ILE 79 3HG2 ILE 79 104.534 -14.333 -9.192 563 HD11 ILE 79 3HD1 ILE 79 101.394 -15.358 -7.138 564 HD12 ILE 79 1HD1 ILE 79 102.509 -15.305 -8.502 565 HD13 ILE 79 2HD1 ILE 79 102.061 -13.816 -7.671 566 H TYR 80 H TYR 80 105.677 -11.782 -5.235 567 HA TYR 80 HA TYR 80 104.220 -12.382 -2.761 568 HB2 TYR 80 1HB TYR 80 105.831 -11.304 -1.351 569 HB3 TYR 80 2HB TYR 80 106.632 -12.578 -2.246 570 HD1 TYR 80 HD1 TYR 80 106.308 -8.951 -1.758 571 HD2 TYR 80 HD2 TYR 80 108.289 -12.053 -3.970 572 HE1 TYR 80 HE1 TYR 80 107.991 -7.310 -2.550 573 HE2 TYR 80 HE2 TYR 80 109.973 -10.413 -4.763 574 HH TYR 80 HH TYR 80 110.704 -8.322 -4.630 575 H GLY 81 H GLY 81 103.385 -10.519 -1.695 576 HA2 GLY 81 1HA GLY 81 103.410 -8.017 -3.288 577 HA3 GLY 81 2HA GLY 81 101.883 -8.681 -2.701 578 H VAL 82 H VAL 82 103.225 -6.105 -2.016 579 HA VAL 82 HA VAL 82 103.556 -6.514 0.891 580 HB VAL 82 HB VAL 82 105.471 -4.940 0.863 581 HG11 VAL 82 1HG1 VAL 82 106.207 -7.146 1.000 582 HG12 VAL 82 2HG1 VAL 82 107.043 -6.583 -0.445 583 HG13 VAL 82 3HG1 VAL 82 105.587 -7.563 -0.598 584 HG21 VAL 82 3HG2 VAL 82 105.148 -5.232 -2.136 585 HG22 VAL 82 1HG2 VAL 82 106.593 -4.576 -1.366 586 HG23 VAL 82 2HG2 VAL 82 105.047 -3.745 -1.195 587 H VAL 83 H VAL 83 103.049 -4.813 2.180 588 HA VAL 83 HA VAL 83 102.107 -2.307 0.913 589 HB VAL 83 HB VAL 83 100.983 -3.629 3.405 590 HG11 VAL 83 1HG1 VAL 83 100.877 -1.231 3.623 591 HG12 VAL 83 2HG1 VAL 83 99.262 -1.792 3.189 592 HG13 VAL 83 3HG1 VAL 83 100.297 -1.053 1.968 593 HG21 VAL 83 3HG2 VAL 83 99.169 -4.357 2.174 594 HG22 VAL 83 1HG2 VAL 83 100.414 -4.485 0.935 595 HG23 VAL 83 2HG2 VAL 83 99.337 -3.092 0.959 596 H GLY 84 H GLY 84 102.652 -0.384 2.162 597 HA2 GLY 84 1HA GLY 84 104.069 -0.695 4.671 598 HA3 GLY 84 2HA GLY 84 105.106 -0.234 3.329 599 H VAL 85 H VAL 85 105.164 1.467 5.243 600 HA VAL 85 HA VAL 85 103.578 3.755 4.302 601 HB VAL 85 HB VAL 85 102.393 2.877 6.279 602 HG11 VAL 85 1HG1 VAL 85 105.060 3.297 7.656 603 HG12 VAL 85 2HG1 VAL 85 104.234 1.759 7.413 604 HG13 VAL 85 3HG1 VAL 85 103.543 2.970 8.494 605 HG21 VAL 85 3HG2 VAL 85 102.346 4.949 7.559 606 HG22 VAL 85 1HG2 VAL 85 102.523 5.336 5.848 607 HG23 VAL 85 2HG2 VAL 85 103.921 5.417 6.920 608 H GLY 86 H GLY 86 104.727 5.669 4.313 609 HA2 GLY 86 1HA GLY 86 107.455 5.581 5.457 610 HA3 GLY 86 2HA GLY 86 107.200 6.079 3.788 611 H TYR 87 H TYR 87 108.402 7.624 5.882 612 HA TYR 87 HA TYR 87 106.527 9.909 5.918 613 HB2 TYR 87 1HB TYR 87 107.277 10.545 8.103 614 HB3 TYR 87 2HB TYR 87 106.718 8.887 8.170 615 HD1 TYR 87 HD1 TYR 87 109.629 11.122 8.370 616 HD2 TYR 87 HD2 TYR 87 108.287 7.045 8.548 617 HE1 TYR 87 HE1 TYR 87 111.797 10.451 9.369 618 HE2 TYR 87 HE2 TYR 87 110.456 6.374 9.545 619 HH TYR 87 HH TYR 87 112.895 8.784 10.426 620 H GLY 88 H GLY 88 107.457 11.925 5.573 621 HA2 GLY 88 1HA GLY 88 110.330 11.950 4.862 622 HA3 GLY 88 2HA GLY 88 109.120 12.608 3.768 623 H LYS 89 H LYS 89 111.402 13.853 5.117 624 HA LYS 89 HA LYS 89 109.969 16.108 6.388 625 HB2 LYS 89 1HB LYS 89 112.715 15.072 7.144 626 HB3 LYS 89 2HB LYS 89 111.884 16.446 7.868 627 HG2 LYS 89 1HG LYS 89 110.835 13.603 7.899 628 HG3 LYS 89 2HG LYS 89 111.697 14.364 9.236 629 HD2 LYS 89 1HD LYS 89 109.949 16.180 9.229 630 HD3 LYS 89 2HD LYS 89 109.045 15.228 8.052 631 HE2 LYS 89 1HE LYS 89 108.260 14.830 10.370 632 HE3 LYS 89 2HE LYS 89 108.896 13.362 9.628 633 HZ1 LYS 89 3HZ LYS 89 109.634 14.146 12.017 634 HZ2 LYS 89 1HZ LYS 89 110.756 15.051 11.123 635 HZ3 LYS 89 2HZ LYS 89 110.711 13.360 10.964 636 H PHE 90 H PHE 90 110.579 18.117 5.687 637 HA PHE 90 HA PHE 90 112.975 18.386 4.016 638 HB2 PHE 90 1HB PHE 90 111.759 19.538 2.258 639 HB3 PHE 90 2HB PHE 90 111.130 17.914 2.464 640 HD1 PHE 90 HD1 PHE 90 108.920 17.555 3.549 641 HD2 PHE 90 HD2 PHE 90 110.425 21.486 2.689 642 HE1 PHE 90 HE1 PHE 90 106.643 18.491 3.844 643 HE2 PHE 90 HE2 PHE 90 108.148 22.422 2.985 644 HZ PHE 90 HZ PHE 90 106.257 20.925 3.562 645 H GLN 91 H GLN 91 113.674 20.603 3.773 646 HA GLN 91 HA GLN 91 112.677 22.337 5.954 647 HB2 GLN 91 1HB GLN 91 115.344 22.279 4.526 648 HB3 GLN 91 2HB GLN 91 114.888 23.459 5.756 649 HG2 GLN 91 1HG GLN 91 114.575 21.676 7.398 650 HG3 GLN 91 2HG GLN 91 114.930 20.458 6.176 651 HE21 GLN 91 1HE2 GLN 91 116.489 20.664 8.565 652 HE22 GLN 91 2HE2 GLN 91 118.051 21.175 8.140 653 H THR 92 H THR 92 111.443 23.969 5.362 654 HA THR 92 HA THR 92 112.142 25.540 2.987 655 HB THR 92 HB THR 92 109.329 24.541 3.502 656 HG1 THR 92 HG1 THR 92 110.956 23.904 1.299 657 HG21 THR 92 3HG2 THR 92 109.097 25.485 1.109 658 HG22 THR 92 1HG2 THR 92 110.602 26.341 1.445 659 HG23 THR 92 2HG2 THR 92 109.174 26.643 2.436 660 H THR 93 H THR 93 111.250 27.714 3.057 661 HA THR 93 HA THR 93 110.616 28.565 5.807 662 HB THR 93 HB THR 93 111.303 30.259 3.392 663 HG1 THR 93 HG1 THR 93 113.250 29.631 3.787 664 HG21 THR 93 3HG2 THR 93 110.033 31.384 5.217 665 HG22 THR 93 1HG2 THR 93 111.672 32.015 5.048 666 HG23 THR 93 2HG2 THR 93 111.289 30.895 6.356 667 H GLU 94 H GLU 94 108.649 29.142 6.359 668 HA GLU 94 HA GLU 94 106.644 30.395 4.897 669 HB2 GLU 94 1HB GLU 94 106.768 28.286 3.478 670 HB3 GLU 94 2HB GLU 94 106.259 27.387 4.903 671 HG2 GLU 94 1HG GLU 94 104.212 28.783 5.027 672 HG3 GLU 94 2HG GLU 94 104.715 29.626 3.569 673 H TYR 95 H TYR 95 104.773 30.670 6.225 674 HA TYR 95 HA TYR 95 105.076 29.845 8.974 675 HB2 TYR 95 1HB TYR 95 103.994 32.012 7.957 676 HB3 TYR 95 2HB TYR 95 102.552 31.019 7.878 677 HD1 TYR 95 HD1 TYR 95 105.131 32.399 10.173 678 HD2 TYR 95 HD2 TYR 95 101.259 30.571 9.828 679 HE1 TYR 95 HE1 TYR 95 104.689 32.885 12.565 680 HE2 TYR 95 HE2 TYR 95 100.818 31.056 12.220 681 HH TYR 95 HH TYR 95 102.934 33.086 14.104 682 HA PRO 96 HA PRO 96 103.020 26.051 7.647 683 HB2 PRO 96 1HB PRO 96 103.115 24.587 9.923 684 HB3 PRO 96 2HB PRO 96 104.552 24.899 8.929 685 HG2 PRO 96 1HG PRO 96 103.690 26.194 11.459 686 HG3 PRO 96 2HG PRO 96 105.315 25.737 10.918 687 HD2 PRO 96 1HD PRO 96 104.326 28.307 10.785 688 HD3 PRO 96 2HD PRO 96 105.617 27.682 9.739 689 H THR 97 H THR 97 100.902 25.631 7.391 690 HA THR 97 HA THR 97 99.122 25.881 9.753 691 HB THR 97 HB THR 97 98.340 25.947 6.826 692 HG1 THR 97 HG1 THR 97 99.476 27.814 7.514 693 HG21 THR 97 3HG2 THR 97 96.722 26.644 9.284 694 HG22 THR 97 1HG2 THR 97 96.677 25.056 8.520 695 HG23 THR 97 2HG2 THR 97 96.141 26.480 7.627 696 H TYR 98 H TYR 98 98.566 23.950 10.579 697 HA TYR 98 HA TYR 98 97.852 21.746 8.861 698 HB2 TYR 98 1HB TYR 98 99.541 20.198 9.611 699 HB3 TYR 98 2HB TYR 98 100.307 21.588 8.867 700 HD1 TYR 98 HD2 TYR 98 101.602 23.178 10.204 701 HD2 TYR 98 HD1 TYR 98 99.716 19.764 12.002 702 HE1 TYR 98 HE2 TYR 98 102.965 23.503 12.251 703 HE2 TYR 98 HE1 TYR 98 101.080 20.087 14.048 704 HH TYR 98 HH TYR 98 102.353 22.515 15.042 705 H LYS 99 H LYS 99 96.778 20.067 9.949 706 HA LYS 99 HA LYS 99 96.272 20.526 12.830 707 HB2 LYS 99 1HB LYS 99 94.097 19.544 12.541 708 HB3 LYS 99 2HB LYS 99 94.296 20.819 11.345 709 HG2 LYS 99 1HG LYS 99 94.943 19.054 9.671 710 HG3 LYS 99 2HG LYS 99 94.535 17.833 10.877 711 HD2 LYS 99 1HD LYS 99 92.247 18.927 11.044 712 HD3 LYS 99 2HD LYS 99 92.681 19.848 9.604 713 HE2 LYS 99 1HE LYS 99 92.748 16.823 9.763 714 HE3 LYS 99 2HE LYS 99 91.405 17.749 9.093 715 HZ1 LYS 99 3HZ LYS 99 94.214 17.812 8.131 716 HZ2 LYS 99 1HZ LYS 99 92.939 18.733 7.497 717 HZ3 LYS 99 2HZ LYS 99 92.913 17.040 7.358 718 H HIS 100 H HIS 100 97.149 19.132 14.140 719 HA HIS 100 HA HIS 100 98.276 17.288 14.921 720 HB2 HIS 100 1HB HIS 100 96.919 15.256 14.844 721 HB3 HIS 100 2HB HIS 100 95.968 16.672 15.249 722 HD1 HIS 100 HD1 HIS 100 96.708 14.398 12.297 723 HD2 HIS 100 HD2 HIS 100 93.785 17.081 13.576 724 HE1 HIS 100 HE1 HIS 100 94.798 14.214 10.647 725 H ASP 101 H ASP 101 99.168 18.073 12.212 726 HA ASP 101 HA ASP 101 100.392 15.510 11.483 727 HB2 ASP 101 1HB ASP 101 98.376 15.753 10.056 728 HB3 ASP 101 2HB ASP 101 99.017 17.281 9.453 729 H THR 102 H THR 102 102.332 16.376 12.297 730 HA THR 102 HA THR 102 103.433 18.775 11.070 731 HB THR 102 HB THR 102 105.347 18.386 12.555 732 HG1 THR 102 HG1 THR 102 105.592 16.542 13.568 733 HG21 THR 102 3HG2 THR 102 103.530 19.613 13.521 734 HG22 THR 102 1HG2 THR 102 104.041 18.438 14.733 735 HG23 THR 102 2HG2 THR 102 102.590 18.143 13.777 736 H SER 103 H SER 103 103.516 15.382 10.431 737 HA SER 103 HA SER 103 105.934 15.713 8.743 738 HB2 SER 103 1HB SER 103 104.915 13.105 9.869 739 HB3 SER 103 2HB SER 103 106.491 13.444 9.164 740 HG SER 103 HG SER 103 106.524 13.422 11.466 741 H ASP 104 H ASP 104 105.951 14.508 6.718 742 HA ASP 104 HA ASP 104 103.244 14.275 5.590 743 HB2 ASP 104 1HB ASP 104 104.943 15.653 4.404 744 HB3 ASP 104 2HB ASP 104 105.930 14.210 4.196 745 H TYR 105 H TYR 105 102.321 12.324 5.410 746 HA TYR 105 HA TYR 105 104.069 9.928 5.389 747 HB2 TYR 105 1HB TYR 105 101.269 10.237 6.475 748 HB3 TYR 105 2HB TYR 105 102.171 8.737 6.417 749 HD1 TYR 105 HD1 TYR 105 104.359 8.591 7.745 750 HD2 TYR 105 HD2 TYR 105 101.484 11.739 8.273 751 HE1 TYR 105 HE1 TYR 105 105.335 9.109 9.964 752 HE2 TYR 105 HE2 TYR 105 102.460 12.258 10.492 753 HH TYR 105 HH TYR 105 103.848 10.791 12.275 754 H GLY 106 H GLY 106 103.586 8.251 3.994 755 HA2 GLY 106 1HA GLY 106 101.292 8.564 2.177 756 HA3 GLY 106 2HA GLY 106 102.902 8.411 1.481 757 H PHE 107 H PHE 107 100.808 6.600 0.978 758 HA PHE 107 HA PHE 107 101.670 4.160 2.432 759 HB2 PHE 107 1HB PHE 107 99.056 4.739 1.032 760 HB3 PHE 107 2HB PHE 107 99.489 3.206 1.765 761 HD1 PHE 107 HD2 PHE 107 99.548 2.945 4.197 762 HD2 PHE 107 HD1 PHE 107 98.492 6.691 2.377 763 HE1 PHE 107 HE2 PHE 107 98.653 3.748 6.367 764 HE2 PHE 107 HE1 PHE 107 97.598 7.492 4.547 765 HZ PHE 107 HZ PHE 107 97.679 6.022 6.542 766 H SER 108 H SER 108 102.216 2.313 1.218 767 HA SER 108 HA SER 108 102.334 2.684 -1.716 768 HB2 SER 108 1HB SER 108 104.528 3.277 -0.721 769 HB3 SER 108 2HB SER 108 104.608 1.675 0.005 770 HG SER 108 HG SER 108 104.222 2.123 -2.770 771 H TYR 109 H TYR 109 102.140 0.871 -2.939 772 HA TYR 109 HA TYR 109 102.067 -1.764 -1.632 773 HB2 TYR 109 1HB TYR 109 99.744 -1.026 -1.723 774 HB3 TYR 109 2HB TYR 109 99.908 -0.635 -3.423 775 HD1 TYR 109 HD1 TYR 109 99.952 -2.392 -5.121 776 HD2 TYR 109 HD2 TYR 109 99.557 -3.335 -0.951 777 HE1 TYR 109 HE1 TYR 109 99.245 -4.696 -5.708 778 HE2 TYR 109 HE2 TYR 109 98.850 -5.638 -1.537 779 HH TYR 109 HH TYR 109 98.314 -7.032 -3.185 780 H GLY 110 H GLY 110 102.689 -3.474 -3.010 781 HA2 GLY 110 1HA GLY 110 102.879 -3.164 -5.850 782 HA3 GLY 110 2HA GLY 110 104.454 -2.968 -5.092 783 H ALA 111 H ALA 111 104.455 -4.943 -6.751 784 HA ALA 111 HA ALA 111 104.582 -7.318 -5.050 785 HB1 ALA 111 1HB ALA 111 103.522 -8.620 -7.033 786 HB2 ALA 111 2HB ALA 111 102.846 -7.057 -7.493 787 HB3 ALA 111 3HB ALA 111 102.451 -7.760 -5.925 788 H GLY 112 H GLY 112 105.874 -9.050 -6.064 789 HA2 GLY 112 1HA GLY 112 107.412 -8.382 -8.430 790 HA3 GLY 112 2HA GLY 112 108.331 -8.290 -6.931 791 H LEU 113 H LEU 113 109.324 -10.015 -8.603 792 HA LEU 113 HA LEU 113 108.622 -12.614 -7.461 793 HB2 LEU 113 1HB LEU 113 109.001 -13.647 -9.792 794 HB3 LEU 113 2HB LEU 113 107.435 -12.969 -9.406 795 HG LEU 113 HG LEU 113 108.378 -12.471 -11.711 796 HD11 LEU 113 1HD1 LEU 113 107.195 -10.512 -11.846 797 HD12 LEU 113 2HD1 LEU 113 107.868 -9.871 -10.347 798 HD13 LEU 113 3HD1 LEU 113 106.618 -11.114 -10.291 799 HD21 LEU 113 3HD2 LEU 113 110.706 -11.909 -10.739 800 HD22 LEU 113 1HD2 LEU 113 110.015 -10.325 -10.380 801 HD23 LEU 113 2HD2 LEU 113 110.082 -10.902 -12.042 802 H GLN 114 H GLN 114 110.284 -14.178 -7.546 803 HA GLN 114 HA GLN 114 112.978 -13.064 -8.082 804 HB2 GLN 114 1HB GLN 114 112.389 -13.231 -5.644 805 HB3 GLN 114 2HB GLN 114 112.218 -14.972 -5.857 806 HG2 GLN 114 1HG GLN 114 114.550 -15.141 -6.581 807 HG3 GLN 114 2HG GLN 114 114.735 -13.394 -6.457 808 HE21 GLN 114 1HE2 GLN 114 116.499 -14.832 -4.941 809 HE22 GLN 114 2HE2 GLN 114 116.073 -14.794 -3.300 810 H PHE 115 H PHE 115 114.126 -14.241 -9.518 811 HA PHE 115 HA PHE 115 113.421 -17.091 -9.892 812 HB2 PHE 115 1HB PHE 115 113.463 -16.837 -12.296 813 HB3 PHE 115 2HB PHE 115 112.254 -15.771 -11.604 814 HD1 PHE 115 HD1 PHE 115 115.495 -15.975 -13.326 815 HD2 PHE 115 HD2 PHE 115 112.549 -13.343 -11.641 816 HE1 PHE 115 HE1 PHE 115 116.540 -14.055 -14.497 817 HE2 PHE 115 HE2 PHE 115 113.594 -11.423 -12.812 818 HZ PHE 115 HZ PHE 115 115.590 -11.779 -14.240 819 H ASN 116 H ASN 116 115.087 -18.352 -10.953 820 HA ASN 116 HA ASN 116 117.705 -17.098 -11.241 821 HB2 ASN 116 1HB ASN 116 118.785 -18.812 -9.796 822 HB3 ASN 116 2HB ASN 116 117.722 -17.731 -8.899 823 HD21 ASN 116 1HD2 ASN 116 118.497 -20.957 -9.194 824 HD22 ASN 116 2HD2 ASN 116 117.031 -21.639 -8.680 825 HA PRO 117 HA PRO 117 117.841 -20.426 -14.240 826 HB2 PRO 117 1HB PRO 117 120.331 -20.121 -15.211 827 HB3 PRO 117 2HB PRO 117 119.088 -18.878 -15.458 828 HG2 PRO 117 1HG PRO 117 121.412 -18.883 -13.641 829 HG3 PRO 117 2HG PRO 117 120.592 -17.527 -14.432 830 HD2 PRO 117 1HD PRO 117 120.237 -18.403 -11.745 831 HD3 PRO 117 2HD PRO 117 119.301 -17.159 -12.601 832 H MET 118 H MET 118 117.993 -21.548 -11.781 833 HA MET 118 HA MET 118 118.805 -23.295 -10.544 834 HB2 MET 118 1HB MET 118 120.044 -24.024 -13.208 835 HB3 MET 118 2HB MET 118 119.981 -25.087 -11.803 836 HG2 MET 118 1HG MET 118 117.501 -24.884 -11.794 837 HG3 MET 118 2HG MET 118 117.599 -23.905 -13.258 838 HE1 MET 118 3HE MET 118 116.149 -27.267 -14.504 839 HE2 MET 118 1HE MET 118 116.089 -25.515 -14.736 840 HE3 MET 118 2HE MET 118 115.803 -26.206 -13.141 841 H GLU 119 H GLU 119 120.294 -20.832 -10.498 842 HA GLU 119 HA GLU 119 122.986 -21.888 -9.846 843 HB2 GLU 119 1HB GLU 119 122.234 -19.119 -10.814 844 HB3 GLU 119 2HB GLU 119 123.846 -19.608 -10.289 845 HG2 GLU 119 1HG GLU 119 122.303 -20.856 -12.578 846 HG3 GLU 119 2HG GLU 119 123.615 -19.698 -12.755 847 H ASN 120 H ASN 120 124.088 -20.344 -8.204 848 HA ASN 120 HA ASN 120 122.358 -20.233 -5.889 849 HB2 ASN 120 1HB ASN 120 125.261 -19.463 -6.213 850 HB3 ASN 120 2HB ASN 120 124.400 -19.604 -4.681 851 HD21 ASN 120 1HD2 ASN 120 126.696 -21.252 -5.989 852 HD22 ASN 120 2HD2 ASN 120 126.161 -22.855 -5.827 853 H VAL 121 H VAL 121 122.591 -18.070 -8.340 854 HA VAL 121 HA VAL 121 122.202 -15.761 -6.521 855 HB VAL 121 HB VAL 121 123.254 -15.700 -9.364 856 HG11 VAL 121 1HG1 VAL 121 122.655 -13.603 -7.280 857 HG12 VAL 121 2HG1 VAL 121 122.169 -13.640 -8.975 858 HG13 VAL 121 3HG1 VAL 121 123.847 -13.309 -8.547 859 HG21 VAL 121 3HG2 VAL 121 124.692 -15.253 -6.728 860 HG22 VAL 121 1HG2 VAL 121 125.402 -15.081 -8.333 861 HG23 VAL 121 2HG2 VAL 121 124.884 -16.667 -7.763 862 H ALA 122 H ALA 122 120.335 -14.637 -6.742 863 HA ALA 122 HA ALA 122 118.536 -15.371 -8.983 864 HB1 ALA 122 1HB ALA 122 117.496 -16.478 -7.232 865 HB2 ALA 122 2HB ALA 122 116.722 -14.897 -7.134 866 HB3 ALA 122 3HB ALA 122 118.037 -15.306 -6.033 867 H LEU 123 H LEU 123 116.968 -13.754 -9.547 868 HA LEU 123 HA LEU 123 117.852 -11.006 -8.871 869 HB2 LEU 123 1HB LEU 123 116.926 -12.255 -11.447 870 HB3 LEU 123 2HB LEU 123 116.658 -10.541 -11.166 871 HG LEU 123 HG LEU 123 118.751 -11.000 -12.423 872 HD11 LEU 123 1HD1 LEU 123 120.076 -9.424 -11.265 873 HD12 LEU 123 2HD1 LEU 123 119.453 -9.928 -9.694 874 HD13 LEU 123 3HD1 LEU 123 118.417 -9.037 -10.809 875 HD21 LEU 123 3HD2 LEU 123 119.929 -12.108 -9.881 876 HD22 LEU 123 1HD2 LEU 123 120.568 -12.188 -11.523 877 HD23 LEU 123 2HD2 LEU 123 119.180 -13.176 -11.068 878 H ASP 124 H ASP 124 116.297 -9.535 -8.282 879 HA ASP 124 HA ASP 124 113.512 -10.549 -8.100 880 HB2 ASP 124 1HB ASP 124 113.304 -9.257 -6.012 881 HB3 ASP 124 2HB ASP 124 114.555 -10.493 -5.884 882 H PHE 125 H PHE 125 112.059 -9.342 -9.108 883 HA PHE 125 HA PHE 125 112.662 -6.479 -9.603 884 HB2 PHE 125 1HB PHE 125 111.316 -8.440 -11.468 885 HB3 PHE 125 2HB PHE 125 111.419 -6.710 -11.736 886 HD1 PHE 125 HD1 PHE 125 113.611 -5.646 -12.223 887 HD2 PHE 125 HD2 PHE 125 113.185 -9.903 -11.846 888 HE1 PHE 125 HE1 PHE 125 115.809 -5.963 -13.324 889 HE2 PHE 125 HE2 PHE 125 115.384 -10.221 -12.948 890 HZ PHE 125 HZ PHE 125 116.696 -8.250 -13.687 891 H SER 126 H SER 126 111.042 -5.079 -9.102 892 HA SER 126 HA SER 126 108.351 -6.144 -8.607 893 HB2 SER 126 1HB SER 126 109.881 -4.510 -6.570 894 HB3 SER 126 2HB SER 126 108.220 -5.071 -6.421 895 HG SER 126 HG SER 126 110.635 -6.508 -6.356 896 H TYR 127 H TYR 127 106.700 -4.615 -8.731 897 HA TYR 127 HA TYR 127 107.487 -1.918 -9.677 898 HB2 TYR 127 1HB TYR 127 104.906 -3.408 -10.185 899 HB3 TYR 127 2HB TYR 127 105.356 -1.847 -10.844 900 HD1 TYR 127 HD1 TYR 127 105.864 -5.481 -11.025 901 HD2 TYR 127 HD2 TYR 127 106.989 -1.672 -12.663 902 HE1 TYR 127 HE1 TYR 127 106.888 -6.622 -12.974 903 HE2 TYR 127 HE2 TYR 127 108.012 -2.814 -14.613 904 HH TYR 127 HH TYR 127 107.681 -5.073 -15.799 905 H GLU 128 H GLU 128 106.928 -0.254 -8.380 906 HA GLU 128 HA GLU 128 104.931 -0.762 -6.244 907 HB2 GLU 128 1HB GLU 128 107.547 0.742 -6.025 908 HB3 GLU 128 2HB GLU 128 106.330 0.622 -4.754 909 HG2 GLU 128 1HG GLU 128 106.554 -1.855 -4.814 910 HG3 GLU 128 2HG GLU 128 107.830 -1.692 -6.012 911 H GLN 129 H GLN 129 103.447 0.757 -5.898 912 HA GLN 129 HA GLN 129 103.827 3.441 -7.076 913 HB2 GLN 129 1HB GLN 129 102.225 2.093 -8.443 914 HB3 GLN 129 2HB GLN 129 101.217 1.902 -7.007 915 HG2 GLN 129 1HG GLN 129 101.106 4.406 -6.831 916 HG3 GLN 129 2HG GLN 129 101.948 4.503 -8.378 917 HE21 GLN 129 1HE2 GLN 129 100.486 4.862 -10.043 918 HE22 GLN 129 2HE2 GLN 129 98.929 4.193 -10.135 919 H SER 130 H SER 130 103.325 5.106 -5.690 920 HA SER 130 HA SER 130 101.901 4.448 -3.196 921 HB2 SER 130 1HB SER 130 104.298 4.187 -2.707 922 HB3 SER 130 2HB SER 130 104.598 5.816 -3.300 923 HG SER 130 HG SER 130 103.976 6.520 -1.425 924 H ARG 131 H ARG 131 100.892 6.157 -2.201 925 HA ARG 131 HA ARG 131 100.767 8.678 -3.758 926 HB2 ARG 131 1HB ARG 131 98.636 7.352 -2.060 927 HB3 ARG 131 2HB ARG 131 98.477 8.927 -2.839 928 HG2 ARG 131 1HG ARG 131 98.887 7.839 -5.045 929 HG3 ARG 131 2HG ARG 131 98.915 6.272 -4.234 930 HD2 ARG 131 1HD ARG 131 96.609 6.776 -3.353 931 HD3 ARG 131 2HD ARG 131 96.591 8.208 -4.379 932 HE ARG 131 HE ARG 131 96.187 5.498 -5.218 933 HH11 ARG 131 1HH1 ARG 131 97.467 8.580 -6.309 934 HH12 ARG 131 2HH1 ARG 131 97.206 8.209 -7.981 935 HH21 ARG 131 1HH2 ARG 131 95.875 5.077 -7.385 936 HH22 ARG 131 2HH2 ARG 131 96.316 6.251 -8.582 937 H ILE 132 H ILE 132 101.408 10.457 -2.746 938 HA ILE 132 HA ILE 132 101.573 10.474 0.192 939 HB ILE 132 HB ILE 132 103.831 9.991 -0.567 940 HG12 ILE 132 1HG1 ILE 132 103.736 12.936 0.100 941 HG13 ILE 132 2HG1 ILE 132 103.372 11.683 1.288 942 HG21 ILE 132 1HG2 ILE 132 103.332 11.161 -2.888 943 HG22 ILE 132 2HG2 ILE 132 104.971 11.099 -2.244 944 HG23 ILE 132 3HG2 ILE 132 104.014 12.569 -2.075 945 HD11 ILE 132 3HD1 ILE 132 105.634 10.639 0.574 946 HD12 ILE 132 1HD1 ILE 132 105.678 12.078 1.593 947 HD13 ILE 132 2HD1 ILE 132 105.973 12.214 -0.141 948 H ARG 133 H ARG 133 99.947 11.818 0.542 949 HA ARG 133 HA ARG 133 98.167 13.124 -0.321 950 HB2 ARG 133 1HB ARG 133 100.341 14.935 0.723 951 HB3 ARG 133 2HB ARG 133 98.658 15.420 0.504 952 HG2 ARG 133 1HG ARG 133 97.967 13.540 2.000 953 HG3 ARG 133 2HG ARG 133 99.671 13.191 2.292 954 HD2 ARG 133 1HD ARG 133 98.246 15.790 2.929 955 HD3 ARG 133 2HD ARG 133 98.783 14.587 4.097 956 HE ARG 133 HE ARG 133 101.091 15.163 2.881 957 HH11 ARG 133 1HH1 ARG 133 98.600 17.346 4.046 958 HH12 ARG 133 2HH1 ARG 133 99.725 18.627 4.349 959 HH21 ARG 133 1HH2 ARG 133 102.491 16.849 3.290 960 HH22 ARG 133 2HH2 ARG 133 101.900 18.348 3.926 961 H SER 134 H SER 134 98.048 12.901 -2.579 962 HA SER 134 HA SER 134 97.399 14.030 -4.464 963 HB2 SER 134 1HB SER 134 97.463 16.331 -4.664 964 HB3 SER 134 2HB SER 134 97.454 16.112 -2.921 965 HG SER 134 HG SER 134 99.557 16.648 -2.841 966 H VAL 135 H VAL 135 100.675 13.522 -3.546 967 HA VAL 135 HA VAL 135 101.571 13.976 -6.321 968 HB VAL 135 HB VAL 135 103.205 13.333 -3.852 969 HG11 VAL 135 1HG1 VAL 135 104.167 12.683 -6.095 970 HG12 VAL 135 2HG1 VAL 135 105.121 13.880 -5.217 971 HG13 VAL 135 3HG1 VAL 135 104.086 14.384 -6.553 972 HG21 VAL 135 3HG2 VAL 135 102.767 15.966 -5.298 973 HG22 VAL 135 1HG2 VAL 135 103.851 15.711 -3.930 974 HG23 VAL 135 2HG2 VAL 135 102.108 15.550 -3.715 975 H ASP 136 H ASP 136 101.998 12.313 -7.646 976 HA ASP 136 HA ASP 136 101.588 9.585 -6.569 977 HB2 ASP 136 1HB ASP 136 100.046 10.348 -8.370 978 HB3 ASP 136 2HB ASP 136 101.435 10.539 -9.437 979 H VAL 137 H VAL 137 103.350 8.292 -6.389 980 HA VAL 137 HA VAL 137 105.721 8.970 -8.041 981 HB VAL 137 HB VAL 137 106.022 9.619 -5.685 982 HG11 VAL 137 1HG1 VAL 137 104.513 7.984 -4.650 983 HG12 VAL 137 2HG1 VAL 137 106.128 7.859 -3.952 984 HG13 VAL 137 3HG1 VAL 137 105.584 6.671 -5.137 985 HG21 VAL 137 3HG2 VAL 137 107.636 7.206 -6.564 986 HG22 VAL 137 1HG2 VAL 137 108.117 8.332 -5.294 987 HG23 VAL 137 2HG2 VAL 137 107.977 8.891 -6.961 988 H GLY 138 H GLY 138 106.727 7.363 -9.080 989 HA2 GLY 138 1HA GLY 138 105.777 4.590 -8.634 990 HA3 GLY 138 2HA GLY 138 106.125 5.238 -10.238 991 H THR 139 H THR 139 107.362 3.077 -8.335 992 HA THR 139 HA THR 139 110.172 4.001 -8.595 993 HB THR 139 HB THR 139 109.069 2.115 -6.504 994 HG1 THR 139 HG1 THR 139 109.986 4.727 -6.036 995 HG21 THR 139 3HG2 THR 139 111.315 2.743 -5.443 996 HG22 THR 139 1HG2 THR 139 111.755 3.399 -7.020 997 HG23 THR 139 2HG2 THR 139 111.384 1.683 -6.851 998 H TRP 140 H TRP 140 111.488 2.769 -9.750 999 HA TRP 140 HA TRP 140 110.670 0.003 -10.414 1000 HB2 TRP 140 1HB TRP 140 111.074 1.544 -12.323 1001 HB3 TRP 140 2HB TRP 140 112.709 1.800 -11.744 1002 HD1 TRP 140 HD1 TRP 140 114.303 -0.462 -11.718 1003 HE1 TRP 140 HE1 TRP 140 114.366 -2.399 -13.416 1004 HE3 TRP 140 HE3 TRP 140 109.750 0.166 -13.941 1005 HZ2 TRP 140 HZ2 TRP 140 112.705 -3.532 -15.457 1006 HZ3 TRP 140 HZ3 TRP 140 109.018 -1.348 -15.756 1007 HH2 TRP 140 HH2 TRP 140 110.484 -3.194 -16.518 1008 H ILE 141 H ILE 141 111.759 -1.589 -9.388 1009 HA ILE 141 HA ILE 141 114.404 -0.942 -8.214 1010 HB ILE 141 HB ILE 141 112.650 -0.807 -6.527 1011 HG12 ILE 141 1HG1 ILE 141 115.001 -1.750 -6.106 1012 HG13 ILE 141 2HG1 ILE 141 113.785 -1.976 -4.868 1013 HG21 ILE 141 1HG2 ILE 141 112.045 -3.670 -7.269 1014 HG22 ILE 141 2HG2 ILE 141 110.994 -2.270 -7.497 1015 HG23 ILE 141 3HG2 ILE 141 111.384 -2.825 -5.868 1016 HD11 ILE 141 3HD1 ILE 141 114.061 -4.205 -4.943 1017 HD12 ILE 141 1HD1 ILE 141 115.420 -3.941 -6.026 1018 HD13 ILE 141 2HD1 ILE 141 113.823 -4.268 -6.683 1019 H ALA 142 H ALA 142 115.948 -2.394 -8.486 1020 HA ALA 142 HA ALA 142 115.222 -5.193 -9.052 1021 HB1 ALA 142 1HB ALA 142 115.679 -4.227 -11.240 1022 HB2 ALA 142 2HB ALA 142 117.013 -5.288 -10.786 1023 HB3 ALA 142 3HB ALA 142 117.192 -3.538 -10.653 1024 H GLY 143 H GLY 143 116.590 -6.678 -8.088 1025 HA2 GLY 143 1HA GLY 143 119.113 -5.727 -6.934 1026 HA3 GLY 143 2HA GLY 143 117.882 -6.275 -5.805 1027 H VAL 144 H VAL 144 120.077 -7.592 -5.557 1028 HA VAL 144 HA VAL 144 119.711 -10.156 -6.989 1029 HB VAL 144 HB VAL 144 122.357 -8.954 -6.122 1030 HG11 VAL 144 1HG1 VAL 144 123.287 -10.859 -7.434 1031 HG12 VAL 144 2HG1 VAL 144 121.648 -11.466 -7.668 1032 HG13 VAL 144 3HG1 VAL 144 122.340 -11.398 -6.048 1033 HG21 VAL 144 3HG2 VAL 144 121.339 -9.401 -8.941 1034 HG22 VAL 144 1HG2 VAL 144 122.807 -8.557 -8.451 1035 HG23 VAL 144 2HG2 VAL 144 121.230 -7.844 -8.119 1036 H GLY 145 H GLY 145 119.954 -12.014 -5.702 1037 HA2 GLY 145 1HA GLY 145 120.454 -11.585 -2.827 1038 HA3 GLY 145 2HA GLY 145 118.941 -12.326 -3.332 1039 H TYR 146 H TYR 146 120.704 -13.592 -1.629 1040 HA TYR 146 HA TYR 146 121.519 -15.906 -3.255 1041 HB2 TYR 146 1HB TYR 146 123.588 -16.136 -2.057 1042 HB3 TYR 146 2HB TYR 146 123.519 -14.532 -2.757 1043 HD1 TYR 146 HD2 TYR 146 123.301 -12.549 -1.337 1044 HD2 TYR 146 HD1 TYR 146 123.475 -16.495 0.352 1045 HE1 TYR 146 HE2 TYR 146 123.739 -11.572 0.900 1046 HE2 TYR 146 HE1 TYR 146 123.912 -15.518 2.589 1047 HH TYR 146 HH TYR 146 124.816 -12.308 3.047 1048 H ARG 147 H ARG 147 121.207 -17.886 -2.277 1049 HA ARG 147 HA ARG 147 119.656 -17.819 0.238 1050 HB2 ARG 147 1HB ARG 147 119.797 -19.913 -1.946 1051 HB3 ARG 147 2HB ARG 147 118.823 -20.039 -0.481 1052 HG2 ARG 147 1HG ARG 147 117.611 -17.978 -1.116 1053 HG3 ARG 147 2HG ARG 147 118.565 -17.882 -2.597 1054 HD2 ARG 147 1HD ARG 147 116.474 -18.938 -3.160 1055 HD3 ARG 147 2HD ARG 147 117.723 -20.179 -3.197 1056 HE ARG 147 HE ARG 147 116.279 -19.885 -0.679 1057 HH11 ARG 147 1HH1 ARG 147 116.553 -21.653 -3.699 1058 HH12 ARG 147 2HH1 ARG 147 115.675 -23.018 -3.094 1059 HH21 ARG 147 1HH2 ARG 147 115.156 -21.671 0.043 1060 HH22 ARG 147 2HH2 ARG 147 114.894 -23.027 -1.002 1061 H PHE 148 H PHE 148 120.286 -18.983 1.990 1062 HA PHE 148 HA PHE 148 122.567 -20.819 1.744 1063 HB2 PHE 148 1HB PHE 148 123.470 -18.583 2.313 1064 HB3 PHE 148 2HB PHE 148 122.446 -18.552 3.737 1065 HD1 PHE 148 HD1 PHE 148 125.361 -20.177 2.137 1066 HD2 PHE 148 HD2 PHE 148 123.024 -19.788 5.722 1067 HE1 PHE 148 HE1 PHE 148 127.133 -21.346 3.419 1068 HE2 PHE 148 HE2 PHE 148 124.797 -20.958 7.003 1069 HZ PHE 148 HZ PHE 148 126.851 -21.736 5.852 Start of MODEL 6 1 H1 ALA 1 3H ALA 1 116.247 -25.332 7.847 2 H2 ALA 1 2H ALA 1 116.092 -25.342 9.539 3 H3 ALA 1 HT3 ALA 1 117.617 -25.120 8.825 4 HA ALA 1 HA ALA 1 115.326 -23.244 8.606 5 HB1 ALA 1 2HB ALA 1 117.947 -22.820 10.052 6 HB2 ALA 1 3HB ALA 1 116.523 -23.468 10.866 7 HB3 ALA 1 1HB ALA 1 116.476 -21.854 10.158 8 H THR 2 H THR 2 115.480 -21.968 6.875 9 HA THR 2 HA THR 2 118.122 -21.630 5.569 10 HB THR 2 HB THR 2 116.957 -21.540 3.421 11 HG1 THR 2 HG1 THR 2 114.661 -22.318 3.614 12 HG21 THR 2 3HG2 THR 2 116.184 -23.969 5.063 13 HG22 THR 2 1HG2 THR 2 117.726 -23.732 4.242 14 HG23 THR 2 2HG2 THR 2 116.244 -23.900 3.302 15 H SER 3 H SER 3 118.678 -19.593 4.918 16 HA SER 3 HA SER 3 116.746 -17.414 5.463 17 HB2 SER 3 1HB SER 3 118.442 -17.586 7.278 18 HB3 SER 3 2HB SER 3 119.710 -17.371 6.077 19 HG SER 3 HG SER 3 118.343 -15.511 7.330 20 H THR 4 H THR 4 116.745 -15.733 4.030 21 HA THR 4 HA THR 4 118.653 -15.862 1.767 22 HB THR 4 HB THR 4 115.713 -15.162 1.580 23 HG1 THR 4 HG1 THR 4 117.012 -17.449 0.557 24 HG21 THR 4 3HG2 THR 4 117.850 -15.614 -0.524 25 HG22 THR 4 1HG2 THR 4 117.153 -14.055 -0.084 26 HG23 THR 4 2HG2 THR 4 116.147 -15.286 -0.847 27 H VAL 5 H VAL 5 119.600 -13.970 1.235 28 HA VAL 5 HA VAL 5 118.571 -11.498 2.524 29 HB VAL 5 HB VAL 5 121.462 -12.193 1.934 30 HG11 VAL 5 1HG1 VAL 5 121.051 -9.799 1.818 31 HG12 VAL 5 2HG1 VAL 5 121.875 -10.155 3.337 32 HG13 VAL 5 3HG1 VAL 5 120.139 -9.846 3.327 33 HG21 VAL 5 3HG2 VAL 5 119.764 -12.372 4.416 34 HG22 VAL 5 1HG2 VAL 5 121.492 -12.041 4.550 35 HG23 VAL 5 2HG2 VAL 5 120.936 -13.531 3.790 36 H THR 6 H THR 6 118.175 -9.830 1.181 37 HA THR 6 HA THR 6 119.237 -9.940 -1.572 38 HB THR 6 HB THR 6 116.358 -9.316 -0.891 39 HG1 THR 6 HG1 THR 6 117.678 -11.679 -1.634 40 HG21 THR 6 3HG2 THR 6 116.037 -9.439 -3.304 41 HG22 THR 6 1HG2 THR 6 117.727 -9.881 -3.534 42 HG23 THR 6 2HG2 THR 6 117.309 -8.271 -2.948 43 H GLY 7 H GLY 7 119.590 -7.956 -2.545 44 HA2 GLY 7 1HA GLY 7 118.717 -5.530 -1.127 45 HA3 GLY 7 2HA GLY 7 120.440 -5.728 -1.457 46 H GLY 8 H GLY 8 118.592 -3.680 -2.515 47 HA2 GLY 8 1HA GLY 8 119.283 -3.955 -5.322 48 HA3 GLY 8 2HA GLY 8 117.556 -4.022 -4.995 49 H TYR 9 H TYR 9 118.405 -2.086 -6.605 50 HA TYR 9 HA TYR 9 118.233 0.368 -4.959 51 HB2 TYR 9 1HB TYR 9 119.626 1.526 -6.527 52 HB3 TYR 9 2HB TYR 9 120.471 0.087 -5.998 53 HD1 TYR 9 HD1 TYR 9 120.709 -1.859 -7.540 54 HD2 TYR 9 HD2 TYR 9 118.970 1.859 -8.808 55 HE1 TYR 9 HE1 TYR 9 121.017 -2.524 -9.909 56 HE2 TYR 9 HE2 TYR 9 119.279 1.194 -11.178 57 HH TYR 9 HH TYR 9 120.756 -0.347 -12.476 58 H ALA 10 H ALA 10 116.827 1.963 -5.692 59 HA ALA 10 HA ALA 10 115.299 1.392 -8.145 60 HB1 ALA 10 1HB ALA 10 113.772 2.274 -5.740 61 HB2 ALA 10 2HB ALA 10 114.238 0.578 -5.852 62 HB3 ALA 10 3HB ALA 10 113.248 1.304 -7.116 63 H GLN 11 H GLN 11 114.399 3.168 -9.142 64 HA GLN 11 HA GLN 11 115.065 5.823 -8.006 65 HB2 GLN 11 1HB GLN 11 114.867 4.957 -10.904 66 HB3 GLN 11 2HB GLN 11 115.112 6.619 -10.364 67 HG2 GLN 11 1HG GLN 11 117.204 5.991 -9.267 68 HG3 GLN 11 2HG GLN 11 116.952 4.303 -9.703 69 HE21 GLN 11 1HE2 GLN 11 119.284 5.737 -10.547 70 HE22 GLN 11 2HE2 GLN 11 119.219 5.910 -12.235 71 H SER 12 H SER 12 113.433 7.381 -7.993 72 HA SER 12 HA SER 12 110.734 6.393 -8.739 73 HB2 SER 12 1HB SER 12 111.467 8.066 -6.326 74 HB3 SER 12 2HB SER 12 109.857 7.501 -6.757 75 HG SER 12 HG SER 12 111.200 6.228 -5.187 76 H ASP 13 H ASP 13 109.305 7.861 -9.573 77 HA ASP 13 HA ASP 13 110.300 10.606 -10.067 78 HB2 ASP 13 1HB ASP 13 110.397 9.180 -12.121 79 HB3 ASP 13 2HB ASP 13 108.657 8.928 -11.980 80 H ALA 14 H ALA 14 108.797 12.227 -9.805 81 HA ALA 14 HA ALA 14 106.300 11.403 -8.484 82 HB1 ALA 14 1HB ALA 14 107.602 14.128 -8.418 83 HB2 ALA 14 2HB ALA 14 107.975 12.859 -7.251 84 HB3 ALA 14 3HB ALA 14 106.338 13.508 -7.355 85 H GLN 15 H GLN 15 104.766 11.279 -9.953 86 HA GLN 15 HA GLN 15 104.505 13.010 -12.211 87 HB2 GLN 15 1HB GLN 15 103.558 10.706 -12.122 88 HB3 GLN 15 2HB GLN 15 102.397 11.263 -10.918 89 HG2 GLN 15 1HG GLN 15 101.503 12.906 -12.504 90 HG3 GLN 15 2HG GLN 15 102.690 12.412 -13.707 91 HE21 GLN 15 1HE2 GLN 15 100.074 12.210 -14.502 92 HE22 GLN 15 2HE2 GLN 15 99.563 10.592 -14.512 93 H GLY 16 H GLY 16 103.777 14.972 -12.256 94 HA2 GLY 16 1HA GLY 16 102.332 16.776 -11.781 95 HA3 GLY 16 2HA GLY 16 101.881 15.996 -10.273 96 H GLN 17 H GLN 17 104.947 15.556 -9.834 97 HA GLN 17 HA GLN 17 105.694 18.355 -9.234 98 HB2 GLN 17 1HB GLN 17 106.464 15.792 -7.830 99 HB3 GLN 17 2HB GLN 17 107.269 17.336 -7.548 100 HG2 GLN 17 1HG GLN 17 105.033 18.330 -7.000 101 HG3 GLN 17 2HG GLN 17 104.333 16.726 -7.128 102 HE21 GLN 17 1HE2 GLN 17 107.320 16.094 -5.726 103 HE22 GLN 17 2HE2 GLN 17 106.875 16.251 -4.097 104 H MET 18 H MET 18 107.904 18.955 -9.638 105 HA MET 18 HA MET 18 109.218 17.275 -11.680 106 HB2 MET 18 1HB MET 18 109.669 20.166 -10.896 107 HB3 MET 18 2HB MET 18 110.554 19.307 -12.159 108 HG2 MET 18 1HG MET 18 108.353 18.837 -13.283 109 HG3 MET 18 2HG MET 18 107.580 19.888 -12.096 110 HE1 MET 18 3HE MET 18 109.897 19.339 -14.892 111 HE2 MET 18 1HE MET 18 111.145 20.273 -14.057 112 HE3 MET 18 2HE MET 18 110.395 20.909 -15.518 113 H ASN 19 H ASN 19 110.339 15.757 -10.504 114 HA ASN 19 HA ASN 19 112.818 16.493 -9.368 115 HB2 ASN 19 1HB ASN 19 112.444 15.944 -7.026 116 HB3 ASN 19 2HB ASN 19 111.407 17.281 -7.500 117 HD21 ASN 19 1HD2 ASN 19 110.390 16.197 -5.342 118 HD22 ASN 19 2HD2 ASN 19 109.151 15.078 -5.651 119 H LYS 20 H LYS 20 113.977 14.631 -8.434 120 HA LYS 20 HA LYS 20 112.775 12.013 -9.038 121 HB2 LYS 20 1HB LYS 20 114.789 11.241 -10.126 122 HB3 LYS 20 2HB LYS 20 114.235 12.704 -10.934 123 HG2 LYS 20 1HG LYS 20 115.875 14.018 -9.570 124 HG3 LYS 20 2HG LYS 20 116.482 12.501 -8.905 125 HD2 LYS 20 1HD LYS 20 116.872 11.751 -11.312 126 HD3 LYS 20 2HD LYS 20 116.567 13.423 -11.784 127 HE2 LYS 20 1HE LYS 20 118.448 14.224 -10.582 128 HE3 LYS 20 2HE LYS 20 118.602 12.725 -9.666 129 HZ1 LYS 20 3HZ LYS 20 118.727 12.293 -12.487 130 HZ2 LYS 20 1HZ LYS 20 119.808 11.808 -11.273 131 HZ3 LYS 20 2HZ LYS 20 119.939 13.358 -11.957 132 H MET 21 H MET 21 113.593 10.258 -7.771 133 HA MET 21 HA MET 21 115.270 11.072 -5.465 134 HB2 MET 21 1HB MET 21 112.720 9.441 -5.350 135 HB3 MET 21 2HB MET 21 113.790 9.770 -3.986 136 HG2 MET 21 1HG MET 21 113.437 12.228 -4.396 137 HG3 MET 21 2HG MET 21 112.223 11.799 -5.600 138 HE1 MET 21 3HE MET 21 112.551 12.082 -1.383 139 HE2 MET 21 1HE MET 21 113.634 11.074 -2.350 140 HE3 MET 21 2HE MET 21 112.371 10.330 -1.373 141 H GLY 22 H GLY 22 116.468 9.368 -4.491 142 HA2 GLY 22 1HA GLY 22 116.502 6.807 -5.977 143 HA3 GLY 22 2HA GLY 22 118.003 7.696 -5.724 144 H GLY 23 H GLY 23 116.702 5.037 -4.676 145 HA2 GLY 23 1HA GLY 23 117.705 5.382 -1.941 146 HA3 GLY 23 2HA GLY 23 116.042 4.842 -2.127 147 H PHE 24 H PHE 24 117.742 3.274 -0.766 148 HA PHE 24 HA PHE 24 118.179 0.983 -2.590 149 HB2 PHE 24 1HB PHE 24 120.294 2.213 -1.753 150 HB3 PHE 24 2HB PHE 24 119.905 1.527 -0.188 151 HD1 PHE 24 HD1 PHE 24 120.573 0.617 -3.745 152 HD2 PHE 24 HD2 PHE 24 120.586 -0.664 0.354 153 HE1 PHE 24 HE1 PHE 24 121.733 -1.474 -4.403 154 HE2 PHE 24 HE2 PHE 24 121.744 -2.756 -0.305 155 HZ PHE 24 HZ PHE 24 122.317 -3.162 -2.683 156 H ASN 25 H ASN 25 117.800 -1.094 -1.605 157 HA ASN 25 HA ASN 25 116.298 -0.970 0.944 158 HB2 ASN 25 1HB ASN 25 115.453 -2.430 -1.565 159 HB3 ASN 25 2HB ASN 25 114.630 -2.502 -0.011 160 HD21 ASN 25 1HD2 ASN 25 113.106 -1.612 -2.120 161 HD22 ASN 25 2HD2 ASN 25 112.865 0.065 -2.024 162 H LEU 26 H LEU 26 116.654 -2.581 2.337 163 HA LEU 26 HA LEU 26 118.078 -5.001 1.389 164 HB2 LEU 26 1HB LEU 26 118.455 -3.356 3.889 165 HB3 LEU 26 2HB LEU 26 118.814 -5.076 3.906 166 HG LEU 26 HG LEU 26 120.817 -3.695 3.465 167 HD11 LEU 26 1HD1 LEU 26 120.234 -5.133 0.901 168 HD12 LEU 26 2HD1 LEU 26 120.308 -6.038 2.414 169 HD13 LEU 26 3HD1 LEU 26 121.710 -5.120 1.865 170 HD21 LEU 26 3HD2 LEU 26 119.848 -3.034 0.719 171 HD22 LEU 26 1HD2 LEU 26 121.007 -2.187 1.739 172 HD23 LEU 26 2HD2 LEU 26 119.280 -2.030 2.053 173 H LYS 27 H LYS 27 117.107 -6.939 1.987 174 HA LYS 27 HA LYS 27 114.931 -6.806 3.955 175 HB2 LYS 27 1HB LYS 27 113.336 -7.868 2.522 176 HB3 LYS 27 2HB LYS 27 113.957 -6.442 1.699 177 HG2 LYS 27 1HG LYS 27 115.540 -7.913 0.440 178 HG3 LYS 27 2HG LYS 27 114.784 -9.317 1.198 179 HD2 LYS 27 1HD LYS 27 112.563 -8.439 0.292 180 HD3 LYS 27 2HD LYS 27 113.513 -7.320 -0.686 181 HE2 LYS 27 1HE LYS 27 114.486 -9.043 -1.944 182 HE3 LYS 27 2HE LYS 27 114.133 -10.265 -0.722 183 HZ1 LYS 27 3HZ LYS 27 111.811 -10.116 -1.231 184 HZ2 LYS 27 1HZ LYS 27 112.661 -10.389 -2.674 185 HZ3 LYS 27 2HZ LYS 27 112.077 -8.834 -2.315 186 H TYR 28 H TYR 28 114.269 -8.720 4.865 187 HA TYR 28 HA TYR 28 116.116 -11.010 4.529 188 HB2 TYR 28 1HB TYR 28 116.099 -11.374 6.899 189 HB3 TYR 28 2HB TYR 28 116.579 -9.717 6.593 190 HD1 TYR 28 HD1 TYR 28 114.997 -7.849 7.070 191 HD2 TYR 28 HD2 TYR 28 114.093 -11.922 8.091 192 HE1 TYR 28 HE1 TYR 28 113.206 -7.068 8.597 193 HE2 TYR 28 HE2 TYR 28 112.301 -11.142 9.618 194 HH TYR 28 HH TYR 28 112.037 -8.032 10.702 195 H ARG 29 H ARG 29 115.211 -13.021 4.505 196 HA ARG 29 HA ARG 29 112.275 -13.203 4.812 197 HB2 ARG 29 1HB ARG 29 112.954 -13.080 2.408 198 HB3 ARG 29 2HB ARG 29 113.896 -14.552 2.644 199 HG2 ARG 29 1HG ARG 29 111.876 -15.771 3.309 200 HG3 ARG 29 2HG ARG 29 110.916 -14.301 3.144 201 HD2 ARG 29 1HD ARG 29 110.620 -15.580 1.125 202 HD3 ARG 29 2HD ARG 29 111.636 -14.196 0.731 203 HE ARG 29 HE ARG 29 113.497 -16.026 1.266 204 HH11 ARG 29 1HH1 ARG 29 110.575 -16.362 -0.654 205 HH12 ARG 29 2HH1 ARG 29 111.263 -17.590 -1.663 206 HH21 ARG 29 1HH2 ARG 29 114.325 -17.610 -0.067 207 HH22 ARG 29 2HH2 ARG 29 113.358 -18.286 -1.335 208 H TYR 30 H TYR 30 111.505 -15.017 5.793 209 HA TYR 30 HA TYR 30 113.408 -17.197 6.390 210 HB2 TYR 30 1HB TYR 30 112.616 -17.351 8.642 211 HB3 TYR 30 2HB TYR 30 113.141 -15.706 8.352 212 HD1 TYR 30 HD1 TYR 30 111.482 -13.877 8.159 213 HD2 TYR 30 HD2 TYR 30 110.316 -17.902 9.103 214 HE1 TYR 30 HE1 TYR 30 109.275 -13.056 8.937 215 HE2 TYR 30 HE2 TYR 30 108.109 -17.081 9.880 216 HH TYR 30 HH TYR 30 107.411 -14.294 10.810 217 H GLU 31 H GLU 31 112.569 -19.261 6.371 218 HA GLU 31 HA GLU 31 109.722 -19.528 5.596 219 HB2 GLU 31 1HB GLU 31 112.097 -20.978 4.405 220 HB3 GLU 31 2HB GLU 31 110.406 -21.314 4.031 221 HG2 GLU 31 1HG GLU 31 110.137 -18.957 3.276 222 HG3 GLU 31 2HG GLU 31 111.848 -18.688 3.572 223 H GLU 32 H GLU 32 108.656 -21.381 6.279 224 HA GLU 32 HA GLU 32 109.805 -22.716 8.592 225 HB2 GLU 32 1HB GLU 32 107.429 -21.957 8.549 226 HB3 GLU 32 2HB GLU 32 107.112 -23.137 7.276 227 HG2 GLU 32 1HG GLU 32 106.484 -24.162 9.358 228 HG3 GLU 32 2HG GLU 32 107.981 -24.923 8.833 229 H ASP 33 H ASP 33 110.250 -24.913 8.753 230 HA ASP 33 HA ASP 33 111.398 -26.011 6.405 231 HB2 ASP 33 1HB ASP 33 112.040 -27.882 7.817 232 HB3 ASP 33 2HB ASP 33 112.331 -26.358 8.650 233 H ASN 34 H ASN 34 108.465 -26.944 8.242 234 HA ASN 34 HA ASN 34 107.990 -29.061 6.233 235 HB2 ASN 34 1HB ASN 34 108.076 -29.699 8.632 236 HB3 ASN 34 2HB ASN 34 106.665 -28.682 8.918 237 HD21 ASN 34 1HD2 ASN 34 107.734 -31.460 6.890 238 HD22 ASN 34 2HD2 ASN 34 106.193 -32.167 6.794 239 H SER 35 H SER 35 106.774 -25.970 7.152 240 HA SER 35 HA SER 35 104.715 -26.257 5.099 241 HB2 SER 35 1HB SER 35 104.123 -25.356 7.931 242 HB3 SER 35 2HB SER 35 103.027 -25.131 6.572 243 HG SER 35 HG SER 35 102.476 -27.046 7.538 244 HA PRO 36 HA PRO 36 107.404 -22.501 5.297 245 HB2 PRO 36 1HB PRO 36 107.618 -22.602 2.372 246 HB3 PRO 36 2HB PRO 36 108.888 -22.720 3.601 247 HG2 PRO 36 1HG PRO 36 108.106 -24.795 2.063 248 HG3 PRO 36 2HG PRO 36 108.772 -24.981 3.694 249 HD2 PRO 36 1HD PRO 36 105.913 -25.134 2.803 250 HD3 PRO 36 2HD PRO 36 106.762 -26.086 4.045 251 H LEU 37 H LEU 37 106.638 -20.534 5.390 252 HA LEU 37 HA LEU 37 104.845 -19.531 3.262 253 HB2 LEU 37 1HB LEU 37 104.881 -18.675 6.175 254 HB3 LEU 37 2HB LEU 37 103.822 -18.042 4.916 255 HG LEU 37 HG LEU 37 103.888 -20.944 5.792 256 HD11 LEU 37 1HD1 LEU 37 101.841 -18.788 6.399 257 HD12 LEU 37 2HD1 LEU 37 103.035 -19.384 7.552 258 HD13 LEU 37 3HD1 LEU 37 101.786 -20.467 6.937 259 HD21 LEU 37 3HD2 LEU 37 102.095 -19.347 3.939 260 HD22 LEU 37 1HD2 LEU 37 101.703 -20.965 4.518 261 HD23 LEU 37 2HD2 LEU 37 103.123 -20.711 3.505 262 H GLY 38 H GLY 38 105.556 -17.557 2.324 263 HA2 GLY 38 1HA GLY 38 108.326 -16.905 3.070 264 HA3 GLY 38 2HA GLY 38 107.529 -16.462 1.563 265 H VAL 39 H VAL 39 108.594 -15.286 4.472 266 HA VAL 39 HA VAL 39 106.821 -12.915 4.238 267 HB VAL 39 HB VAL 39 108.082 -14.002 6.773 268 HG11 VAL 39 1HG1 VAL 39 107.826 -11.562 6.771 269 HG12 VAL 39 2HG1 VAL 39 106.641 -12.291 7.855 270 HG13 VAL 39 3HG1 VAL 39 106.145 -11.722 6.261 271 HG21 VAL 39 3HG2 VAL 39 106.174 -15.375 5.837 272 HG22 VAL 39 1HG2 VAL 39 105.155 -13.943 5.979 273 HG23 VAL 39 2HG2 VAL 39 105.853 -14.675 7.424 274 H ILE 40 H ILE 40 107.855 -11.079 3.850 275 HA ILE 40 HA ILE 40 110.763 -10.933 4.407 276 HB ILE 40 HB ILE 40 111.032 -9.670 2.323 277 HG12 ILE 40 1HG1 ILE 40 108.137 -10.391 1.772 278 HG13 ILE 40 2HG1 ILE 40 108.676 -8.785 2.265 279 HG21 ILE 40 1HG2 ILE 40 109.543 -12.166 1.560 280 HG22 ILE 40 2HG2 ILE 40 111.013 -12.291 2.525 281 HG23 ILE 40 3HG2 ILE 40 111.067 -11.542 0.930 282 HD11 ILE 40 3HD1 ILE 40 108.560 -8.712 -0.115 283 HD12 ILE 40 1HD1 ILE 40 109.365 -10.273 -0.274 284 HD13 ILE 40 2HD1 ILE 40 110.274 -8.863 0.271 285 H GLY 41 H GLY 41 111.504 -9.116 5.286 286 HA2 GLY 41 1HA GLY 41 109.681 -6.776 5.477 287 HA3 GLY 41 2HA GLY 41 110.803 -7.227 6.765 288 H SER 42 H SER 42 110.490 -4.915 4.623 289 HA SER 42 HA SER 42 113.335 -4.895 3.793 290 HB2 SER 42 1HB SER 42 110.995 -3.916 2.143 291 HB3 SER 42 2HB SER 42 112.688 -3.940 1.663 292 HG SER 42 HG SER 42 110.837 -5.905 1.579 293 H PHE 43 H PHE 43 114.418 -3.006 4.083 294 HA PHE 43 HA PHE 43 112.860 -0.690 5.091 295 HB2 PHE 43 1HB PHE 43 115.741 -1.462 5.582 296 HB3 PHE 43 2HB PHE 43 114.986 0.016 6.150 297 HD1 PHE 43 HD1 PHE 43 113.203 -0.082 7.891 298 HD2 PHE 43 HD2 PHE 43 115.396 -3.568 6.672 299 HE1 PHE 43 HE1 PHE 43 112.445 -1.272 9.930 300 HE2 PHE 43 HE2 PHE 43 114.639 -4.758 8.711 301 HZ PHE 43 HZ PHE 43 113.162 -3.611 10.340 302 H THR 44 H THR 44 112.794 1.038 3.786 303 HA THR 44 HA THR 44 114.776 1.209 1.585 304 HB THR 44 HB THR 44 111.950 2.292 1.739 305 HG1 THR 44 HG1 THR 44 111.541 0.308 1.232 306 HG21 THR 44 3HG2 THR 44 112.800 3.707 0.162 307 HG22 THR 44 1HG2 THR 44 112.601 2.308 -0.891 308 HG23 THR 44 2HG2 THR 44 114.179 2.668 -0.192 309 H TYR 45 H TYR 45 116.093 2.912 1.543 310 HA TYR 45 HA TYR 45 115.279 5.386 2.962 311 HB2 TYR 45 1HB TYR 45 118.065 4.226 2.764 312 HB3 TYR 45 2HB TYR 45 117.649 5.766 3.491 313 HD1 TYR 45 HD1 TYR 45 116.239 5.805 5.581 314 HD2 TYR 45 HD2 TYR 45 117.857 2.177 3.948 315 HE1 TYR 45 HE1 TYR 45 115.865 4.662 7.751 316 HE2 TYR 45 HE2 TYR 45 117.483 1.034 6.116 317 HH TYR 45 HH TYR 45 116.389 2.809 8.965 318 H THR 46 H THR 46 115.273 7.155 1.673 319 HA THR 46 HA THR 46 116.920 7.135 -0.763 320 HB THR 46 HB THR 46 114.695 6.265 -1.381 321 HG1 THR 46 HG1 THR 46 114.873 8.892 -2.352 322 HG21 THR 46 3HG2 THR 46 113.398 7.439 0.381 323 HG22 THR 46 1HG2 THR 46 112.723 7.693 -1.229 324 HG23 THR 46 2HG2 THR 46 113.677 8.963 -0.461 325 H GLU 47 H GLU 47 117.199 9.206 -1.733 326 HA GLU 47 HA GLU 47 116.660 11.493 0.065 327 HB2 GLU 47 1HB GLU 47 119.240 10.898 -1.406 328 HB3 GLU 47 2HB GLU 47 118.900 12.374 -0.501 329 HG2 GLU 47 1HG GLU 47 118.532 11.002 1.541 330 HG3 GLU 47 2HG GLU 47 118.970 9.563 0.630 331 H LYS 48 H LYS 48 116.631 13.556 -1.016 332 HA LYS 48 HA LYS 48 116.216 13.426 -3.938 333 HB2 LYS 48 1HB LYS 48 114.023 13.385 -2.745 334 HB3 LYS 48 2HB LYS 48 114.444 14.926 -1.997 335 HG2 LYS 48 1HG LYS 48 114.601 15.995 -4.180 336 HG3 LYS 48 2HG LYS 48 114.311 14.455 -4.988 337 HD2 LYS 48 1HD LYS 48 112.221 15.657 -4.957 338 HD3 LYS 48 2HD LYS 48 112.092 14.339 -3.794 339 HE2 LYS 48 1HE LYS 48 111.215 16.487 -2.889 340 HE3 LYS 48 2HE LYS 48 112.574 15.872 -1.950 341 HZ1 LYS 48 3HZ LYS 48 113.961 17.492 -2.718 342 HZ2 LYS 48 1HZ LYS 48 112.496 18.347 -2.740 343 HZ3 LYS 48 2HZ LYS 48 113.120 17.694 -4.180 344 H SER 49 H SER 49 117.128 15.073 -5.045 345 HA SER 49 HA SER 49 118.327 17.286 -3.474 346 HB2 SER 49 1HB SER 49 119.962 15.762 -4.567 347 HB3 SER 49 2HB SER 49 119.241 16.148 -6.126 348 HG SER 49 HG SER 49 120.711 17.686 -6.026 349 H ARG 50 H ARG 50 117.914 19.347 -4.060 350 HA ARG 50 HA ARG 50 116.455 19.846 -6.575 351 HB2 ARG 50 1HB ARG 50 114.830 19.700 -4.689 352 HB3 ARG 50 2HB ARG 50 115.685 21.022 -3.894 353 HG2 ARG 50 1HG ARG 50 115.279 22.444 -5.905 354 HG3 ARG 50 2HG ARG 50 114.321 21.136 -6.598 355 HD2 ARG 50 1HD ARG 50 113.746 22.519 -3.963 356 HD3 ARG 50 2HD ARG 50 112.886 22.807 -5.472 357 HE ARG 50 HE ARG 50 112.913 20.036 -4.631 358 HH11 ARG 50 1HH1 ARG 50 111.181 23.080 -4.401 359 HH12 ARG 50 2HH1 ARG 50 109.687 22.313 -3.981 360 HH21 ARG 50 1HH2 ARG 50 110.962 19.104 -4.086 361 HH22 ARG 50 2HH2 ARG 50 109.566 20.089 -3.804 362 H THR 51 H THR 51 116.914 21.788 -7.554 363 HA THR 51 HA THR 51 118.936 23.506 -6.227 364 HB THR 51 HB THR 51 118.685 22.942 -9.192 365 HG1 THR 51 HG1 THR 51 119.957 21.324 -8.847 366 HG21 THR 51 3HG2 THR 51 120.746 24.166 -9.386 367 HG22 THR 51 1HG2 THR 51 120.918 24.264 -7.634 368 HG23 THR 51 2HG2 THR 51 119.638 25.166 -8.444 369 H ALA 52 H ALA 52 118.563 25.656 -6.214 370 HA ALA 52 HA ALA 52 116.285 26.699 -7.790 371 HB1 ALA 52 1HB ALA 52 115.407 26.510 -5.590 372 HB2 ALA 52 2HB ALA 52 115.857 28.205 -5.774 373 HB3 ALA 52 3HB ALA 52 116.897 27.111 -4.863 374 H SER 53 H SER 53 116.416 28.929 -8.333 375 HA SER 53 HA SER 53 118.946 29.840 -9.115 376 HB2 SER 53 1HB SER 53 116.770 30.605 -10.077 377 HB3 SER 53 2HB SER 53 116.493 31.536 -8.609 378 HG SER 53 HG SER 53 117.684 33.009 -9.512 379 H SER 54 H SER 54 117.036 30.556 -6.219 380 HA SER 54 HA SER 54 118.593 32.630 -5.165 381 HB2 SER 54 1HB SER 54 117.134 30.473 -3.625 382 HB3 SER 54 2HB SER 54 117.622 32.049 -3.011 383 HG SER 54 HG SER 54 115.364 31.622 -3.966 384 H GLY 55 H GLY 55 119.049 29.129 -5.034 385 HA2 GLY 55 1HA GLY 55 121.102 28.027 -4.756 386 HA3 GLY 55 2HA GLY 55 121.814 29.532 -4.197 387 H ASP 56 H ASP 56 118.815 28.590 -2.716 388 HA ASP 56 HA ASP 56 120.049 28.340 -0.141 389 HB2 ASP 56 1HB ASP 56 117.229 27.743 -1.067 390 HB3 ASP 56 2HB ASP 56 117.752 27.756 0.615 391 H TYR 57 H TYR 57 120.427 26.518 1.073 392 HA TYR 57 HA TYR 57 120.218 23.932 -0.363 393 HB2 TYR 57 1HB TYR 57 122.525 24.730 0.051 394 HB3 TYR 57 2HB TYR 57 122.186 24.763 1.771 395 HD1 TYR 57 HD1 TYR 57 122.627 22.582 -1.186 396 HD2 TYR 57 HD2 TYR 57 122.170 22.743 3.082 397 HE1 TYR 57 HE1 TYR 57 123.290 20.198 -1.025 398 HE2 TYR 57 HE2 TYR 57 122.833 20.358 3.242 399 HH TYR 57 HH TYR 57 123.162 18.349 0.419 400 H ASN 58 H ASN 58 119.133 22.311 0.569 401 HA ASN 58 HA ASN 58 118.524 22.442 3.441 402 HB2 ASN 58 1HB ASN 58 116.178 21.896 3.042 403 HB3 ASN 58 2HB ASN 58 116.592 23.414 2.250 404 HD21 ASN 58 1HD2 ASN 58 114.364 21.811 1.398 405 HD22 ASN 58 2HD2 ASN 58 114.705 21.220 -0.157 406 H LYS 59 H LYS 59 117.370 20.290 4.082 407 HA LYS 59 HA LYS 59 118.579 18.037 2.588 408 HB2 LYS 59 1HB LYS 59 119.941 18.631 4.599 409 HB3 LYS 59 2HB LYS 59 118.527 18.303 5.602 410 HG2 LYS 59 1HG LYS 59 118.442 15.994 4.683 411 HG3 LYS 59 2HG LYS 59 119.911 16.327 3.766 412 HD2 LYS 59 1HD LYS 59 121.062 16.875 5.931 413 HD3 LYS 59 2HD LYS 59 119.613 16.336 6.782 414 HE2 LYS 59 1HE LYS 59 120.883 14.383 6.776 415 HE3 LYS 59 2HE LYS 59 119.916 14.167 5.317 416 HZ1 LYS 59 3HZ LYS 59 122.476 13.865 5.232 417 HZ2 LYS 59 1HZ LYS 59 122.499 15.558 5.148 418 HZ3 LYS 59 2HZ LYS 59 121.678 14.661 3.961 419 H ASN 60 H ASN 60 117.170 16.501 2.106 420 HA ASN 60 HA ASN 60 114.710 16.234 3.736 421 HB2 ASN 60 1HB ASN 60 114.314 17.321 1.509 422 HB3 ASN 60 2HB ASN 60 114.905 15.848 0.742 423 HD21 ASN 60 1HD2 ASN 60 113.209 14.519 0.120 424 HD22 ASN 60 2HD2 ASN 60 111.743 14.347 0.960 425 H GLN 61 H GLN 61 114.187 14.205 4.360 426 HA GLN 61 HA GLN 61 115.625 11.939 3.100 427 HB2 GLN 61 1HB GLN 61 115.174 12.406 6.058 428 HB3 GLN 61 2HB GLN 61 115.738 10.886 5.364 429 HG2 GLN 61 1HG GLN 61 117.709 11.999 4.442 430 HG3 GLN 61 2HG GLN 61 117.135 13.555 5.035 431 HE21 GLN 61 1HE2 GLN 61 119.665 12.306 5.825 432 HE22 GLN 61 2HE2 GLN 61 119.569 12.013 7.494 433 H TYR 62 H TYR 62 114.414 10.087 2.807 434 HA TYR 62 HA TYR 62 111.706 10.015 3.979 435 HB2 TYR 62 1HB TYR 62 111.595 10.975 1.690 436 HB3 TYR 62 2HB TYR 62 112.358 9.530 1.069 437 HD1 TYR 62 HD1 TYR 62 111.119 7.415 0.928 438 HD2 TYR 62 HD2 TYR 62 109.280 11.000 2.417 439 HE1 TYR 62 HE1 TYR 62 108.880 6.385 0.648 440 HE2 TYR 62 HE2 TYR 62 107.042 9.968 2.140 441 HH TYR 62 HH TYR 62 105.977 7.937 1.854 442 H TYR 63 H TYR 63 111.158 8.009 4.702 443 HA TYR 63 HA TYR 63 112.698 5.696 3.712 444 HB2 TYR 63 1HB TYR 63 113.109 4.878 5.923 445 HB3 TYR 63 2HB TYR 63 113.730 6.512 5.814 446 HD1 TYR 63 HD1 TYR 63 111.177 4.325 7.302 447 HD2 TYR 63 HD2 TYR 63 112.689 8.338 7.064 448 HE1 TYR 63 HE1 TYR 63 109.859 4.941 9.310 449 HE2 TYR 63 HE2 TYR 63 111.370 8.955 9.071 450 HH TYR 63 HH TYR 63 110.405 7.643 11.108 451 H GLY 64 H GLY 64 111.669 3.634 4.137 452 HA2 GLY 64 1HA GLY 64 108.784 3.800 4.705 453 HA3 GLY 64 2HA GLY 64 109.301 3.169 3.146 454 H ILE 65 H ILE 65 107.965 2.020 5.683 455 HA ILE 65 HA ILE 65 109.740 -0.346 5.943 456 HB ILE 65 HB ILE 65 109.476 0.861 8.074 457 HG12 ILE 65 1HG1 ILE 65 107.785 -1.642 8.183 458 HG13 ILE 65 2HG1 ILE 65 109.525 -1.701 7.898 459 HG21 ILE 65 1HG2 ILE 65 107.211 1.823 7.466 460 HG22 ILE 65 2HG2 ILE 65 107.332 1.183 9.106 461 HG23 ILE 65 3HG2 ILE 65 106.520 0.247 7.850 462 HD11 ILE 65 3HD1 ILE 65 109.905 -0.456 10.003 463 HD12 ILE 65 1HD1 ILE 65 109.040 -1.965 10.295 464 HD13 ILE 65 2HD1 ILE 65 108.166 -0.433 10.296 465 H THR 66 H THR 66 108.938 -2.187 5.131 466 HA THR 66 HA THR 66 106.029 -2.368 4.621 467 HB THR 66 HB THR 66 106.506 -3.344 2.416 468 HG1 THR 66 HG1 THR 66 108.456 -4.095 2.272 469 HG21 THR 66 3HG2 THR 66 107.485 -0.582 3.077 470 HG22 THR 66 1HG2 THR 66 106.044 -1.071 2.188 471 HG23 THR 66 2HG2 THR 66 107.630 -1.189 1.429 472 H ALA 67 H ALA 67 105.258 -4.517 4.245 473 HA ALA 67 HA ALA 67 107.048 -6.754 4.863 474 HB1 ALA 67 1HB ALA 67 106.191 -6.534 7.028 475 HB2 ALA 67 2HB ALA 67 105.049 -7.662 6.298 476 HB3 ALA 67 3HB ALA 67 104.626 -5.957 6.456 477 H GLY 68 H GLY 68 106.314 -8.733 3.912 478 HA2 GLY 68 1HA GLY 68 103.848 -8.590 2.334 479 HA3 GLY 68 2HA GLY 68 105.352 -8.740 1.460 480 HA PRO 69 HA PRO 69 104.297 -13.131 2.940 481 HB2 PRO 69 1HB PRO 69 102.000 -13.912 1.713 482 HB3 PRO 69 2HB PRO 69 102.036 -13.307 3.382 483 HG2 PRO 69 1HG PRO 69 101.258 -11.904 0.880 484 HG3 PRO 69 2HG PRO 69 100.536 -11.818 2.498 485 HD2 PRO 69 1HD PRO 69 102.236 -9.905 1.513 486 HD3 PRO 69 2HD PRO 69 102.050 -10.255 3.244 487 H ALA 70 H ALA 70 104.529 -14.992 1.371 488 HA ALA 70 HA ALA 70 104.767 -14.130 -1.446 489 HB1 ALA 70 1HB ALA 70 106.941 -14.836 -1.684 490 HB2 ALA 70 2HB ALA 70 106.836 -15.982 -0.351 491 HB3 ALA 70 3HB ALA 70 107.000 -14.257 -0.018 492 H TYR 71 H TYR 71 104.578 -15.809 -2.982 493 HA TYR 71 HA TYR 71 103.409 -18.322 -1.924 494 HB2 TYR 71 1HB TYR 71 102.584 -16.781 -4.387 495 HB3 TYR 71 2HB TYR 71 101.934 -18.332 -3.890 496 HD1 TYR 71 HD1 TYR 71 100.625 -18.485 -1.731 497 HD2 TYR 71 HD2 TYR 71 101.785 -14.738 -3.485 498 HE1 TYR 71 HE1 TYR 71 98.926 -17.314 -0.356 499 HE2 TYR 71 HE2 TYR 71 100.085 -13.569 -2.110 500 HH TYR 71 HH TYR 71 97.672 -14.574 -0.924 501 H ARG 72 H ARG 72 104.374 -20.126 -2.603 502 HA ARG 72 HA ARG 72 106.082 -20.009 -5.023 503 HB2 ARG 72 1HB ARG 72 107.277 -20.498 -2.888 504 HB3 ARG 72 2HB ARG 72 106.269 -21.932 -2.691 505 HG2 ARG 72 1HG ARG 72 107.085 -22.766 -4.896 506 HG3 ARG 72 2HG ARG 72 108.168 -21.375 -4.988 507 HD2 ARG 72 1HD ARG 72 108.181 -23.462 -2.790 508 HD3 ARG 72 2HD ARG 72 109.338 -23.370 -4.113 509 HE ARG 72 HE ARG 72 109.350 -21.793 -1.729 510 HH11 ARG 72 1HH1 ARG 72 110.157 -21.643 -5.141 511 HH12 ARG 72 2HH1 ARG 72 111.344 -20.402 -4.908 512 HH21 ARG 72 1HH2 ARG 72 110.889 -20.197 -1.491 513 HH22 ARG 72 2HH2 ARG 72 111.752 -19.596 -2.866 514 H ILE 73 H ILE 73 105.577 -21.333 -6.695 515 HA ILE 73 HA ILE 73 103.474 -23.381 -6.242 516 HB ILE 73 HB ILE 73 103.890 -21.700 -8.729 517 HG12 ILE 73 1HG1 ILE 73 101.650 -21.595 -6.684 518 HG13 ILE 73 2HG1 ILE 73 102.987 -20.446 -6.740 519 HG21 ILE 73 1HG2 ILE 73 102.964 -23.963 -9.144 520 HG22 ILE 73 2HG2 ILE 73 101.761 -22.709 -9.443 521 HG23 ILE 73 3HG2 ILE 73 101.698 -23.653 -7.956 522 HD11 ILE 73 3HD1 ILE 73 100.976 -20.953 -8.951 523 HD12 ILE 73 1HD1 ILE 73 102.355 -19.863 -9.074 524 HD13 ILE 73 2HD1 ILE 73 101.059 -19.520 -7.928 525 H ASN 74 H ASN 74 104.292 -25.338 -6.444 526 HA ASN 74 HA ASN 74 105.511 -27.130 -7.192 527 HB2 ASN 74 1HB ASN 74 105.302 -25.645 -9.818 528 HB3 ASN 74 2HB ASN 74 105.646 -27.362 -9.618 529 HD21 ASN 74 1HD2 ASN 74 103.783 -28.068 -7.622 530 HD22 ASN 74 2HD2 ASN 74 102.211 -27.833 -8.216 531 H ASP 75 H ASP 75 107.065 -24.803 -6.213 532 HA ASP 75 HA ASP 75 109.250 -24.104 -6.080 533 HB2 ASP 75 1HB ASP 75 109.650 -26.937 -7.056 534 HB3 ASP 75 2HB ASP 75 110.917 -25.923 -6.373 535 H TRP 76 H TRP 76 107.962 -23.371 -8.516 536 HA TRP 76 HA TRP 76 110.107 -23.631 -10.527 537 HB2 TRP 76 1HB TRP 76 107.801 -24.228 -11.209 538 HB3 TRP 76 2HB TRP 76 107.283 -22.599 -10.822 539 HD1 TRP 76 HD1 TRP 76 107.576 -20.796 -12.629 540 HE1 TRP 76 HE1 TRP 76 108.557 -20.770 -15.011 541 HE3 TRP 76 HE3 TRP 76 109.805 -25.389 -12.713 542 HZ2 TRP 76 HZ2 TRP 76 110.088 -22.475 -16.730 543 HZ3 TRP 76 HZ3 TRP 76 111.014 -26.162 -14.730 544 HH2 TRP 76 HH2 TRP 76 111.160 -24.716 -16.737 545 H ALA 77 H ALA 77 107.793 -21.134 -9.483 546 HA ALA 77 HA ALA 77 109.995 -19.200 -9.274 547 HB1 ALA 77 1HB ALA 77 109.194 -18.778 -11.495 548 HB2 ALA 77 2HB ALA 77 108.528 -17.512 -10.464 549 HB3 ALA 77 3HB ALA 77 107.513 -18.863 -10.970 550 H SER 78 H SER 78 109.380 -17.281 -8.025 551 HA SER 78 HA SER 78 107.091 -17.808 -6.209 552 HB2 SER 78 1HB SER 78 109.804 -16.682 -5.472 553 HB3 SER 78 2HB SER 78 108.443 -16.896 -4.378 554 HG SER 78 HG SER 78 108.650 -19.070 -4.553 555 H ILE 79 H ILE 79 105.937 -16.013 -5.503 556 HA ILE 79 HA ILE 79 106.686 -13.416 -6.733 557 HB ILE 79 HB ILE 79 104.780 -14.435 -7.921 558 HG12 ILE 79 1HG1 ILE 79 103.759 -12.166 -6.206 559 HG13 ILE 79 2HG1 ILE 79 105.000 -11.923 -7.436 560 HG21 ILE 79 1HG2 ILE 79 103.975 -15.722 -5.876 561 HG22 ILE 79 2HG2 ILE 79 102.715 -14.943 -6.834 562 HG23 ILE 79 3HG2 ILE 79 103.252 -14.212 -5.320 563 HD11 ILE 79 3HD1 ILE 79 102.292 -13.172 -7.974 564 HD12 ILE 79 1HD1 ILE 79 103.518 -12.759 -9.173 565 HD13 ILE 79 2HD1 ILE 79 102.688 -11.481 -8.285 566 H TYR 80 H TYR 80 106.144 -11.565 -5.537 567 HA TYR 80 HA TYR 80 105.429 -12.028 -2.701 568 HB2 TYR 80 1HB TYR 80 107.566 -10.143 -3.711 569 HB3 TYR 80 2HB TYR 80 107.118 -10.412 -2.039 570 HD1 TYR 80 HD1 TYR 80 107.821 -12.438 -0.859 571 HD2 TYR 80 HD2 TYR 80 108.901 -11.749 -4.958 572 HE1 TYR 80 HE1 TYR 80 109.523 -14.236 -0.713 573 HE2 TYR 80 HE2 TYR 80 110.604 -13.546 -4.812 574 HH TYR 80 HH TYR 80 111.972 -14.597 -2.504 575 H GLY 81 H GLY 81 104.131 -10.445 -1.791 576 HA2 GLY 81 1HA GLY 81 103.758 -7.939 -3.346 577 HA3 GLY 81 2HA GLY 81 102.375 -8.789 -2.652 578 H VAL 82 H VAL 82 103.469 -6.076 -2.050 579 HA VAL 82 HA VAL 82 103.955 -6.431 0.835 580 HB VAL 82 HB VAL 82 105.789 -4.770 0.738 581 HG11 VAL 82 1HG1 VAL 82 106.095 -7.289 -0.914 582 HG12 VAL 82 2HG1 VAL 82 106.447 -7.079 0.801 583 HG13 VAL 82 3HG1 VAL 82 107.456 -6.292 -0.409 584 HG21 VAL 82 3HG2 VAL 82 106.763 -4.147 -1.401 585 HG22 VAL 82 1HG2 VAL 82 105.050 -3.726 -1.421 586 HG23 VAL 82 2HG2 VAL 82 105.613 -5.168 -2.264 587 H VAL 83 H VAL 83 103.388 -4.732 2.125 588 HA VAL 83 HA VAL 83 102.454 -2.236 0.878 589 HB VAL 83 HB VAL 83 100.441 -3.581 1.341 590 HG11 VAL 83 1HG1 VAL 83 101.318 -5.013 3.116 591 HG12 VAL 83 2HG1 VAL 83 99.894 -4.153 3.702 592 HG13 VAL 83 3HG1 VAL 83 101.504 -3.618 4.180 593 HG21 VAL 83 3HG2 VAL 83 100.387 -1.116 1.659 594 HG22 VAL 83 1HG2 VAL 83 100.814 -1.345 3.356 595 HG23 VAL 83 2HG2 VAL 83 99.273 -1.948 2.745 596 H GLY 84 H GLY 84 102.683 -0.375 2.337 597 HA2 GLY 84 1HA GLY 84 103.685 -0.704 4.995 598 HA3 GLY 84 2HA GLY 84 104.996 -0.380 3.870 599 H VAL 85 H VAL 85 105.143 1.498 5.401 600 HA VAL 85 HA VAL 85 103.449 3.732 4.445 601 HB VAL 85 HB VAL 85 103.482 4.660 6.734 602 HG11 VAL 85 1HG1 VAL 85 101.962 2.934 7.752 603 HG12 VAL 85 2HG1 VAL 85 102.409 1.839 6.445 604 HG13 VAL 85 3HG1 VAL 85 101.554 3.339 6.086 605 HG21 VAL 85 3HG2 VAL 85 105.552 3.584 7.526 606 HG22 VAL 85 1HG2 VAL 85 104.778 2.002 7.428 607 HG23 VAL 85 2HG2 VAL 85 104.209 3.191 8.600 608 H GLY 86 H GLY 86 104.488 5.733 4.291 609 HA2 GLY 86 1HA GLY 86 107.441 5.659 4.580 610 HA3 GLY 86 2HA GLY 86 106.644 6.368 3.181 611 H TYR 87 H TYR 87 108.426 7.455 5.342 612 HA TYR 87 HA TYR 87 106.736 9.742 6.152 613 HB2 TYR 87 1HB TYR 87 107.208 8.257 8.069 614 HB3 TYR 87 2HB TYR 87 108.923 8.394 7.747 615 HD1 TYR 87 HD1 TYR 87 105.935 10.083 9.060 616 HD2 TYR 87 HD2 TYR 87 110.147 10.437 8.298 617 HE1 TYR 87 HE1 TYR 87 106.037 12.071 10.541 618 HE2 TYR 87 HE2 TYR 87 110.249 12.425 9.776 619 HH TYR 87 HH TYR 87 107.565 13.359 11.782 620 H GLY 88 H GLY 88 107.581 11.690 5.590 621 HA2 GLY 88 1HA GLY 88 110.451 11.820 4.860 622 HA3 GLY 88 2HA GLY 88 109.214 12.463 3.785 623 H LYS 89 H LYS 89 111.497 13.721 5.297 624 HA LYS 89 HA LYS 89 109.942 15.959 6.386 625 HB2 LYS 89 1HB LYS 89 111.305 16.120 8.374 626 HB3 LYS 89 2HB LYS 89 110.606 14.507 8.293 627 HG2 LYS 89 1HG LYS 89 112.750 13.682 7.293 628 HG3 LYS 89 2HG LYS 89 113.438 15.288 7.537 629 HD2 LYS 89 1HD LYS 89 112.802 15.049 9.993 630 HD3 LYS 89 2HD LYS 89 112.477 13.349 9.649 631 HE2 LYS 89 1HE LYS 89 114.724 13.365 10.390 632 HE3 LYS 89 2HE LYS 89 114.850 13.296 8.633 633 HZ1 LYS 89 3HZ LYS 89 116.177 15.054 10.049 634 HZ2 LYS 89 1HZ LYS 89 114.735 15.933 9.885 635 HZ3 LYS 89 2HZ LYS 89 115.580 15.423 8.502 636 H PHE 90 H PHE 90 110.811 17.953 6.019 637 HA PHE 90 HA PHE 90 113.474 18.083 4.743 638 HB2 PHE 90 1HB PHE 90 112.614 19.671 3.113 639 HB3 PHE 90 2HB PHE 90 111.764 18.143 2.991 640 HD1 PHE 90 HD2 PHE 90 109.410 17.956 3.644 641 HD2 PHE 90 HD1 PHE 90 111.522 21.684 3.927 642 HE1 PHE 90 HE2 PHE 90 107.255 19.156 3.906 643 HE2 PHE 90 HE1 PHE 90 109.368 22.886 4.189 644 HZ PHE 90 HZ PHE 90 107.234 21.621 4.179 645 H GLN 91 H GLN 91 114.489 20.191 4.886 646 HA GLN 91 HA GLN 91 113.549 21.708 7.256 647 HB2 GLN 91 1HB GLN 91 116.378 21.372 6.234 648 HB3 GLN 91 2HB GLN 91 115.888 22.233 7.690 649 HG2 GLN 91 1HG GLN 91 115.506 19.270 7.169 650 HG3 GLN 91 2HG GLN 91 116.701 19.981 8.250 651 HE21 GLN 91 1HE2 GLN 91 113.948 18.319 8.497 652 HE22 GLN 91 2HE2 GLN 91 113.225 19.077 9.833 653 H THR 92 H THR 92 113.152 23.800 7.053 654 HA THR 92 HA THR 92 114.354 25.315 4.832 655 HB THR 92 HB THR 92 112.246 26.448 4.386 656 HG1 THR 92 HG1 THR 92 111.104 24.641 6.241 657 HG21 THR 92 3HG2 THR 92 111.284 24.770 3.115 658 HG22 THR 92 1HG2 THR 92 111.436 23.570 4.397 659 HG23 THR 92 2HG2 THR 92 112.852 24.040 3.456 660 H THR 93 H THR 93 113.958 27.757 5.236 661 HA THR 93 HA THR 93 114.409 28.293 8.100 662 HB THR 93 HB THR 93 116.090 29.170 6.517 663 HG1 THR 93 HG1 THR 93 115.848 30.358 8.336 664 HG21 THR 93 3HG2 THR 93 115.568 30.843 4.891 665 HG22 THR 93 1HG2 THR 93 113.918 31.006 5.486 666 HG23 THR 93 2HG2 THR 93 114.409 29.542 4.635 667 H GLU 94 H GLU 94 112.923 29.251 9.310 668 HA GLU 94 HA GLU 94 110.850 30.970 8.576 669 HB2 GLU 94 1HB GLU 94 110.154 28.992 7.148 670 HB3 GLU 94 2HB GLU 94 109.924 28.087 8.640 671 HG2 GLU 94 1HG GLU 94 108.303 29.804 9.406 672 HG3 GLU 94 2HG GLU 94 108.505 30.654 7.882 673 H TYR 95 H TYR 95 109.547 31.473 10.393 674 HA TYR 95 HA TYR 95 110.448 30.395 12.926 675 HB2 TYR 95 1HB TYR 95 108.254 32.356 12.225 676 HB3 TYR 95 2HB TYR 95 108.685 31.912 13.865 677 HD1 TYR 95 HD1 TYR 95 111.390 32.087 14.272 678 HD2 TYR 95 HD2 TYR 95 109.082 34.364 11.453 679 HE1 TYR 95 HE1 TYR 95 113.129 33.855 14.276 680 HE2 TYR 95 HE2 TYR 95 110.822 36.132 11.457 681 HH TYR 95 HH TYR 95 112.844 36.717 12.172 682 HA PRO 96 HA PRO 96 107.975 26.943 12.689 683 HB2 PRO 96 1HB PRO 96 107.399 26.293 15.293 684 HB3 PRO 96 2HB PRO 96 108.998 26.094 14.552 685 HG2 PRO 96 1HG PRO 96 108.003 28.247 16.341 686 HG3 PRO 96 2HG PRO 96 109.587 27.452 16.298 687 HD2 PRO 96 1HD PRO 96 109.156 29.924 15.224 688 HD3 PRO 96 2HD PRO 96 110.375 28.796 14.590 689 H THR 97 H THR 97 105.980 26.518 12.099 690 HA THR 97 HA THR 97 103.708 27.659 13.611 691 HB THR 97 HB THR 97 103.750 26.772 10.712 692 HG1 THR 97 HG1 THR 97 104.777 28.642 10.647 693 HG21 THR 97 3HG2 THR 97 101.668 28.100 12.464 694 HG22 THR 97 1HG2 THR 97 101.553 26.529 11.671 695 HG23 THR 97 2HG2 THR 97 101.547 28.006 10.707 696 H TYR 98 H TYR 98 102.028 26.196 14.180 697 HA TYR 98 HA TYR 98 102.819 23.358 13.999 698 HB2 TYR 98 1HB TYR 98 101.399 22.967 15.870 699 HB3 TYR 98 2HB TYR 98 102.392 24.362 16.231 700 HD1 TYR 98 HD2 TYR 98 101.405 26.594 16.409 701 HD2 TYR 98 HD1 TYR 98 98.991 23.151 15.534 702 HE1 TYR 98 HE2 TYR 98 99.361 27.895 16.936 703 HE2 TYR 98 HE1 TYR 98 96.946 24.452 16.061 704 HH TYR 98 HH TYR 98 96.688 26.863 17.758 705 H LYS 99 H LYS 99 101.916 22.143 12.529 706 HA LYS 99 HA LYS 99 99.153 22.726 11.644 707 HB2 LYS 99 1HB LYS 99 100.921 22.900 9.877 708 HB3 LYS 99 2HB LYS 99 101.281 21.192 10.133 709 HG2 LYS 99 1HG LYS 99 99.033 20.557 9.489 710 HG3 LYS 99 2HG LYS 99 98.536 22.248 9.401 711 HD2 LYS 99 1HD LYS 99 98.972 21.473 7.150 712 HD3 LYS 99 2HD LYS 99 100.257 22.590 7.605 713 HE2 LYS 99 1HE LYS 99 101.850 20.930 7.729 714 HE3 LYS 99 2HE LYS 99 100.683 19.685 8.174 715 HZ1 LYS 99 3HZ LYS 99 101.106 19.126 6.019 716 HZ2 LYS 99 1HZ LYS 99 101.377 20.726 5.523 717 HZ3 LYS 99 2HZ LYS 99 99.790 20.176 5.786 718 H HIS 100 H HIS 100 97.778 20.872 11.255 719 HA HIS 100 HA HIS 100 97.679 19.031 13.325 720 HB2 HIS 100 1HB HIS 100 96.583 18.745 10.527 721 HB3 HIS 100 2HB HIS 100 96.112 17.760 11.900 722 HD1 HIS 100 HD1 HIS 100 95.108 19.285 14.001 723 HD2 HIS 100 HD2 HIS 100 94.983 20.949 10.181 724 HE1 HIS 100 HE1 HIS 100 93.402 21.152 14.091 725 H ASP 101 H ASP 101 99.238 18.720 10.163 726 HA ASP 101 HA ASP 101 100.837 16.514 11.215 727 HB2 ASP 101 1HB ASP 101 98.839 15.455 10.158 728 HB3 ASP 101 2HB ASP 101 99.281 16.225 8.635 729 H THR 102 H THR 102 102.478 18.146 11.086 730 HA THR 102 HA THR 102 103.105 19.610 8.767 731 HB THR 102 HB THR 102 105.010 18.724 10.942 732 HG1 THR 102 HG1 THR 102 103.508 21.112 10.801 733 HG21 THR 102 3HG2 THR 102 106.240 20.741 10.331 734 HG22 THR 102 1HG2 THR 102 105.018 21.151 9.126 735 HG23 THR 102 2HG2 THR 102 106.033 19.726 8.902 736 H SER 103 H SER 103 104.285 16.470 9.927 737 HA SER 103 HA SER 103 106.260 16.172 7.889 738 HB2 SER 103 1HB SER 103 104.925 14.022 9.546 739 HB3 SER 103 2HB SER 103 106.445 13.884 8.668 740 HG SER 103 HG SER 103 105.831 15.223 11.036 741 H ASP 104 H ASP 104 106.241 14.546 6.183 742 HA ASP 104 HA ASP 104 103.614 14.424 4.873 743 HB2 ASP 104 1HB ASP 104 106.375 13.786 3.807 744 HB3 ASP 104 2HB ASP 104 104.887 13.810 2.862 745 H TYR 105 H TYR 105 102.500 12.579 4.662 746 HA TYR 105 HA TYR 105 103.833 10.023 5.348 747 HB2 TYR 105 1HB TYR 105 102.427 10.806 7.202 748 HB3 TYR 105 2HB TYR 105 101.059 10.943 6.115 749 HD1 TYR 105 HD1 TYR 105 99.888 8.953 5.309 750 HD2 TYR 105 HD2 TYR 105 103.235 8.647 7.985 751 HE1 TYR 105 HE1 TYR 105 99.279 6.600 5.802 752 HE2 TYR 105 HE2 TYR 105 102.626 6.293 8.476 753 HH TYR 105 HH TYR 105 101.140 4.675 8.155 754 H GLY 106 H GLY 106 103.419 8.334 3.997 755 HA2 GLY 106 1HA GLY 106 101.219 8.598 2.045 756 HA3 GLY 106 2HA GLY 106 102.854 8.314 1.462 757 H PHE 107 H PHE 107 100.715 6.617 0.920 758 HA PHE 107 HA PHE 107 101.297 4.196 2.529 759 HB2 PHE 107 1HB PHE 107 98.944 4.972 2.522 760 HB3 PHE 107 2HB PHE 107 98.924 4.856 0.776 761 HD1 PHE 107 HD1 PHE 107 99.084 2.935 3.937 762 HD2 PHE 107 HD2 PHE 107 98.624 2.745 -0.329 763 HE1 PHE 107 HE1 PHE 107 98.328 0.580 4.123 764 HE2 PHE 107 HE2 PHE 107 97.872 0.389 -0.144 765 HZ PHE 107 HZ PHE 107 97.723 -0.693 2.083 766 H SER 108 H SER 108 102.139 2.379 1.447 767 HA SER 108 HA SER 108 102.522 2.686 -1.481 768 HB2 SER 108 1HB SER 108 104.617 1.824 0.524 769 HB3 SER 108 2HB SER 108 104.816 1.862 -1.224 770 HG SER 108 HG SER 108 104.257 4.149 -1.044 771 H TYR 109 H TYR 109 102.490 0.849 -2.682 772 HA TYR 109 HA TYR 109 102.622 -1.763 -1.418 773 HB2 TYR 109 1HB TYR 109 100.496 -2.546 -2.189 774 HB3 TYR 109 2HB TYR 109 100.233 -1.100 -1.238 775 HD1 TYR 109 HD1 TYR 109 99.609 1.037 -2.357 776 HD2 TYR 109 HD2 TYR 109 99.962 -2.654 -4.526 777 HE1 TYR 109 HE1 TYR 109 98.347 2.027 -4.249 778 HE2 TYR 109 HE2 TYR 109 98.700 -1.664 -6.417 779 HH TYR 109 HH TYR 109 98.149 0.500 -7.324 780 H GLY 110 H GLY 110 102.802 -3.509 -3.021 781 HA2 GLY 110 1HA GLY 110 102.809 -3.106 -5.806 782 HA3 GLY 110 2HA GLY 110 104.445 -2.829 -5.220 783 H ALA 111 H ALA 111 104.535 -4.764 -6.855 784 HA ALA 111 HA ALA 111 104.805 -7.178 -5.231 785 HB1 ALA 111 1HB ALA 111 103.607 -8.571 -6.870 786 HB2 ALA 111 2HB ALA 111 103.176 -7.126 -7.785 787 HB3 ALA 111 3HB ALA 111 102.536 -7.363 -6.158 788 H GLY 112 H GLY 112 106.096 -8.837 -6.305 789 HA2 GLY 112 1HA GLY 112 107.557 -8.031 -8.704 790 HA3 GLY 112 2HA GLY 112 108.505 -8.175 -7.228 791 H LEU 113 H LEU 113 109.153 -9.748 -9.347 792 HA LEU 113 HA LEU 113 108.220 -12.442 -8.534 793 HB2 LEU 113 1HB LEU 113 108.956 -11.517 -11.323 794 HB3 LEU 113 2HB LEU 113 108.532 -13.166 -10.865 795 HG LEU 113 HG LEU 113 106.362 -11.995 -9.887 796 HD11 LEU 113 1HD1 LEU 113 107.541 -9.994 -11.792 797 HD12 LEU 113 2HD1 LEU 113 106.721 -9.718 -10.256 798 HD13 LEU 113 3HD1 LEU 113 105.789 -10.155 -11.685 799 HD21 LEU 113 3HD2 LEU 113 105.241 -12.396 -12.058 800 HD22 LEU 113 1HD2 LEU 113 106.385 -13.687 -11.685 801 HD23 LEU 113 2HD2 LEU 113 106.813 -12.440 -12.857 802 H GLN 114 H GLN 114 109.791 -14.090 -8.515 803 HA GLN 114 HA GLN 114 112.592 -13.125 -8.591 804 HB2 GLN 114 1HB GLN 114 111.751 -13.873 -6.364 805 HB3 GLN 114 2HB GLN 114 111.456 -15.471 -7.051 806 HG2 GLN 114 1HG GLN 114 113.881 -15.560 -7.711 807 HG3 GLN 114 2HG GLN 114 114.125 -14.056 -6.824 808 HE21 GLN 114 1HE2 GLN 114 114.983 -14.480 -4.793 809 HE22 GLN 114 2HE2 GLN 114 114.569 -15.806 -3.817 810 H PHE 115 H PHE 115 114.009 -14.113 -9.925 811 HA PHE 115 HA PHE 115 113.122 -16.570 -11.332 812 HB2 PHE 115 1HB PHE 115 113.091 -14.486 -12.736 813 HB3 PHE 115 2HB PHE 115 114.819 -14.350 -12.476 814 HD1 PHE 115 HD1 PHE 115 112.168 -16.544 -13.898 815 HD2 PHE 115 HD2 PHE 115 116.351 -15.571 -13.814 816 HE1 PHE 115 HE1 PHE 115 112.555 -18.041 -15.836 817 HE2 PHE 115 HE2 PHE 115 116.737 -17.069 -15.752 818 HZ PHE 115 HZ PHE 115 114.840 -18.304 -16.763 819 H ASN 116 H ASN 116 114.588 -18.208 -11.467 820 HA ASN 116 HA ASN 116 117.246 -17.742 -10.239 821 HB2 ASN 116 1HB ASN 116 115.577 -18.971 -8.786 822 HB3 ASN 116 2HB ASN 116 115.618 -20.271 -9.976 823 HD21 ASN 116 1HD2 ASN 116 117.081 -19.201 -7.128 824 HD22 ASN 116 2HD2 ASN 116 118.526 -20.084 -7.242 825 HA PRO 117 HA PRO 117 117.963 -19.744 -14.330 826 HB2 PRO 117 1HB PRO 117 120.165 -18.323 -15.052 827 HB3 PRO 117 2HB PRO 117 118.517 -17.722 -15.310 828 HG2 PRO 117 1HG PRO 117 120.480 -17.004 -13.203 829 HG3 PRO 117 2HG PRO 117 119.323 -15.979 -14.070 830 HD2 PRO 117 1HD PRO 117 118.913 -16.941 -11.515 831 HD3 PRO 117 2HD PRO 117 117.611 -16.456 -12.621 832 H MET 118 H MET 118 120.494 -20.293 -15.157 833 HA MET 118 HA MET 118 121.356 -22.385 -13.524 834 HB2 MET 118 1HB MET 118 122.872 -20.807 -15.611 835 HB3 MET 118 2HB MET 118 123.446 -22.313 -14.894 836 HG2 MET 118 1HG MET 118 121.364 -23.440 -15.673 837 HG3 MET 118 2HG MET 118 120.882 -21.943 -16.469 838 HE1 MET 118 3HE MET 118 120.524 -23.154 -18.501 839 HE2 MET 118 1HE MET 118 121.218 -24.745 -18.165 840 HE3 MET 118 2HE MET 118 121.728 -23.840 -19.588 841 H GLU 119 H GLU 119 122.364 -18.999 -13.585 842 HA GLU 119 HA GLU 119 124.668 -19.132 -12.024 843 HB2 GLU 119 1HB GLU 119 122.544 -16.975 -12.091 844 HB3 GLU 119 2HB GLU 119 124.162 -16.787 -11.410 845 HG2 GLU 119 1HG GLU 119 125.129 -17.372 -13.626 846 HG3 GLU 119 2HG GLU 119 123.504 -17.460 -14.291 847 H ASN 120 H ASN 120 125.032 -18.780 -9.783 848 HA ASN 120 HA ASN 120 123.126 -20.180 -8.122 849 HB2 ASN 120 1HB ASN 120 124.838 -20.007 -6.385 850 HB3 ASN 120 2HB ASN 120 125.522 -20.602 -7.895 851 HD21 ASN 120 1HD2 ASN 120 127.571 -19.706 -8.118 852 HD22 ASN 120 2HD2 ASN 120 127.959 -18.081 -7.816 853 H VAL 121 H VAL 121 122.839 -17.156 -9.117 854 HA VAL 121 HA VAL 121 121.887 -16.179 -6.486 855 HB VAL 121 HB VAL 121 122.340 -13.889 -7.299 856 HG11 VAL 121 1HG1 VAL 121 124.611 -13.937 -6.759 857 HG12 VAL 121 2HG1 VAL 121 124.896 -15.431 -7.651 858 HG13 VAL 121 3HG1 VAL 121 124.058 -15.476 -6.100 859 HG21 VAL 121 3HG2 VAL 121 122.173 -14.450 -9.737 860 HG22 VAL 121 1HG2 VAL 121 123.721 -15.286 -9.614 861 HG23 VAL 121 2HG2 VAL 121 123.634 -13.546 -9.340 862 H ALA 122 H ALA 122 119.998 -14.798 -6.581 863 HA ALA 122 HA ALA 122 118.265 -15.432 -8.905 864 HB1 ALA 122 1HB ALA 122 117.285 -16.534 -7.085 865 HB2 ALA 122 2HB ALA 122 116.415 -15.001 -7.132 866 HB3 ALA 122 3HB ALA 122 117.705 -15.246 -5.956 867 H LEU 123 H LEU 123 116.853 -13.818 -9.648 868 HA LEU 123 HA LEU 123 117.685 -11.066 -8.929 869 HB2 LEU 123 1HB LEU 123 116.495 -12.059 -11.531 870 HB3 LEU 123 2HB LEU 123 116.950 -10.405 -11.179 871 HG LEU 123 HG LEU 123 118.708 -11.271 -12.490 872 HD11 LEU 123 1HD1 LEU 123 119.631 -11.579 -9.626 873 HD12 LEU 123 2HD1 LEU 123 119.566 -10.068 -10.534 874 HD13 LEU 123 3HD1 LEU 123 120.675 -11.347 -11.029 875 HD21 LEU 123 3HD2 LEU 123 117.908 -13.709 -11.950 876 HD22 LEU 123 1HD2 LEU 123 119.178 -13.645 -10.728 877 HD23 LEU 123 2HD2 LEU 123 119.579 -13.416 -12.430 878 H ASP 124 H ASP 124 116.093 -9.556 -8.445 879 HA ASP 124 HA ASP 124 113.290 -10.530 -8.512 880 HB2 ASP 124 1HB ASP 124 112.871 -9.470 -6.375 881 HB3 ASP 124 2HB ASP 124 114.194 -10.616 -6.207 882 H PHE 125 H PHE 125 111.960 -9.256 -9.574 883 HA PHE 125 HA PHE 125 112.669 -6.392 -9.912 884 HB2 PHE 125 1HB PHE 125 111.271 -8.228 -11.866 885 HB3 PHE 125 2HB PHE 125 111.491 -6.502 -12.084 886 HD1 PHE 125 HD2 PHE 125 113.686 -5.573 -12.634 887 HD2 PHE 125 HD1 PHE 125 113.120 -9.796 -12.092 888 HE1 PHE 125 HE2 PHE 125 115.888 -6.005 -13.692 889 HE2 PHE 125 HE1 PHE 125 115.322 -10.227 -13.150 890 HZ PHE 125 HZ PHE 125 116.705 -8.332 -13.950 891 H SER 126 H SER 126 111.143 -4.979 -9.237 892 HA SER 126 HA SER 126 108.373 -5.908 -8.932 893 HB2 SER 126 1HB SER 126 109.508 -6.334 -6.768 894 HB3 SER 126 2HB SER 126 109.946 -4.630 -6.686 895 HG SER 126 HG SER 126 107.910 -5.402 -5.614 896 H TYR 127 H TYR 127 106.836 -4.300 -9.017 897 HA TYR 127 HA TYR 127 107.811 -1.563 -9.594 898 HB2 TYR 127 1HB TYR 127 106.591 -2.651 -11.442 899 HB3 TYR 127 2HB TYR 127 105.216 -2.898 -10.384 900 HD1 TYR 127 HD1 TYR 127 103.779 -1.029 -9.729 901 HD2 TYR 127 HD2 TYR 127 107.154 -0.448 -12.321 902 HE1 TYR 127 HE1 TYR 127 102.912 1.207 -10.358 903 HE2 TYR 127 HE2 TYR 127 106.287 1.788 -12.951 904 HH TYR 127 HH TYR 127 103.217 3.013 -11.605 905 H GLU 128 H GLU 128 107.381 -0.067 -8.095 906 HA GLU 128 HA GLU 128 105.322 -0.679 -6.051 907 HB2 GLU 128 1HB GLU 128 107.858 0.957 -5.815 908 HB3 GLU 128 2HB GLU 128 106.667 0.730 -4.533 909 HG2 GLU 128 1HG GLU 128 107.024 -1.728 -4.678 910 HG3 GLU 128 2HG GLU 128 108.272 -1.456 -5.884 911 H GLN 129 H GLN 129 103.769 0.770 -5.636 912 HA GLN 129 HA GLN 129 103.927 3.433 -6.923 913 HB2 GLN 129 1HB GLN 129 102.234 1.933 -7.982 914 HB3 GLN 129 2HB GLN 129 101.429 1.796 -6.419 915 HG2 GLN 129 1HG GLN 129 101.075 4.222 -6.361 916 HG3 GLN 129 2HG GLN 129 101.926 4.396 -7.893 917 HE21 GLN 129 1HE2 GLN 129 99.364 5.370 -7.868 918 HE22 GLN 129 2HE2 GLN 129 98.311 4.335 -8.706 919 H SER 130 H SER 130 103.583 5.149 -5.608 920 HA SER 130 HA SER 130 102.553 4.638 -2.879 921 HB2 SER 130 1HB SER 130 105.034 4.858 -2.842 922 HB3 SER 130 2HB SER 130 104.878 6.444 -3.588 923 HG SER 130 HG SER 130 104.086 7.233 -1.759 924 H ARG 131 H ARG 131 101.022 6.032 -2.236 925 HA ARG 131 HA ARG 131 100.560 8.453 -3.888 926 HB2 ARG 131 1HB ARG 131 98.838 6.681 -4.192 927 HB3 ARG 131 2HB ARG 131 98.497 6.752 -2.466 928 HG2 ARG 131 1HG ARG 131 96.856 8.144 -3.459 929 HG3 ARG 131 2HG ARG 131 98.059 9.266 -2.828 930 HD2 ARG 131 1HD ARG 131 99.107 9.374 -5.079 931 HD3 ARG 131 2HD ARG 131 97.853 8.302 -5.694 932 HE ARG 131 HE ARG 131 96.401 10.297 -4.614 933 HH11 ARG 131 1HH1 ARG 131 99.147 10.396 -6.797 934 HH12 ARG 131 2HH1 ARG 131 98.635 11.876 -7.535 935 HH21 ARG 131 1HH2 ARG 131 95.792 12.202 -5.600 936 HH22 ARG 131 2HH2 ARG 131 96.759 12.885 -6.865 937 H ILE 132 H ILE 132 100.736 10.329 -2.816 938 HA ILE 132 HA ILE 132 99.848 10.386 0.004 939 HB ILE 132 HB ILE 132 102.284 10.604 0.082 940 HG12 ILE 132 1HG1 ILE 132 101.151 13.395 0.311 941 HG13 ILE 132 2HG1 ILE 132 100.753 12.120 1.465 942 HG21 ILE 132 1HG2 ILE 132 102.448 11.396 -2.348 943 HG22 ILE 132 2HG2 ILE 132 103.528 12.172 -1.192 944 HG23 ILE 132 3HG2 ILE 132 102.073 13.006 -1.733 945 HD11 ILE 132 3HD1 ILE 132 103.460 13.328 0.882 946 HD12 ILE 132 1HD1 ILE 132 103.288 11.784 1.716 947 HD13 ILE 132 2HD1 ILE 132 102.610 13.249 2.425 948 H ARG 133 H ARG 133 98.130 11.837 0.147 949 HA ARG 133 HA ARG 133 96.783 12.208 -2.217 950 HB2 ARG 133 1HB ARG 133 95.793 12.267 0.072 951 HB3 ARG 133 2HB ARG 133 96.395 13.916 0.245 952 HG2 ARG 133 1HG ARG 133 95.082 14.633 -1.691 953 HG3 ARG 133 2HG ARG 133 94.523 12.979 -1.950 954 HD2 ARG 133 1HD ARG 133 92.781 14.146 -0.763 955 HD3 ARG 133 2HD ARG 133 93.542 13.035 0.372 956 HE ARG 133 HE ARG 133 94.204 14.863 1.606 957 HH11 ARG 133 1HH1 ARG 133 93.530 15.976 -1.655 958 HH12 ARG 133 2HH1 ARG 133 93.776 17.640 -1.244 959 HH21 ARG 133 1HH2 ARG 133 94.509 17.022 2.074 960 HH22 ARG 133 2HH2 ARG 133 94.324 18.224 0.841 961 H SER 134 H SER 134 97.888 13.120 -3.799 962 HA SER 134 HA SER 134 97.590 15.565 -4.783 963 HB2 SER 134 1HB SER 134 99.713 16.830 -4.286 964 HB3 SER 134 2HB SER 134 98.591 16.750 -2.932 965 HG SER 134 HG SER 134 99.888 15.329 -1.936 966 H VAL 135 H VAL 135 100.370 13.449 -3.996 967 HA VAL 135 HA VAL 135 101.324 13.797 -6.775 968 HB VAL 135 HB VAL 135 102.941 13.063 -4.322 969 HG11 VAL 135 1HG1 VAL 135 104.866 13.465 -5.797 970 HG12 VAL 135 2HG1 VAL 135 103.777 13.839 -7.134 971 HG13 VAL 135 3HG1 VAL 135 103.832 12.205 -6.471 972 HG21 VAL 135 3HG2 VAL 135 102.942 15.678 -5.852 973 HG22 VAL 135 1HG2 VAL 135 103.788 15.313 -4.350 974 HG23 VAL 135 2HG2 VAL 135 102.031 15.436 -4.362 975 H ASP 136 H ASP 136 101.577 12.047 -8.027 976 HA ASP 136 HA ASP 136 101.199 9.377 -6.804 977 HB2 ASP 136 1HB ASP 136 99.666 9.997 -8.673 978 HB3 ASP 136 2HB ASP 136 101.068 10.162 -9.726 979 H VAL 137 H VAL 137 103.041 8.235 -6.452 980 HA VAL 137 HA VAL 137 105.450 9.005 -7.998 981 HB VAL 137 HB VAL 137 105.291 7.698 -5.269 982 HG11 VAL 137 1HG1 VAL 137 107.738 8.510 -5.269 983 HG12 VAL 137 2HG1 VAL 137 107.553 8.679 -7.015 984 HG13 VAL 137 3HG1 VAL 137 107.364 7.098 -6.258 985 HG21 VAL 137 3HG2 VAL 137 104.482 9.988 -5.124 986 HG22 VAL 137 1HG2 VAL 137 105.831 10.566 -6.103 987 HG23 VAL 137 2HG2 VAL 137 106.124 9.935 -4.483 988 H GLY 138 H GLY 138 106.489 7.518 -9.173 989 HA2 GLY 138 1HA GLY 138 105.636 4.684 -8.938 990 HA3 GLY 138 2HA GLY 138 105.985 5.455 -10.485 991 H THR 139 H THR 139 107.263 3.205 -8.725 992 HA THR 139 HA THR 139 110.048 4.160 -9.030 993 HB THR 139 HB THR 139 109.019 2.519 -6.705 994 HG1 THR 139 HG1 THR 139 108.346 4.441 -6.142 995 HG21 THR 139 3HG2 THR 139 111.348 3.409 -5.856 996 HG22 THR 139 1HG2 THR 139 111.693 3.563 -7.579 997 HG23 THR 139 2HG2 THR 139 111.275 1.989 -6.899 998 H TRP 140 H TRP 140 111.379 2.780 -10.018 999 HA TRP 140 HA TRP 140 110.497 -0.020 -10.407 1000 HB2 TRP 140 1HB TRP 140 112.422 1.696 -11.983 1001 HB3 TRP 140 2HB TRP 140 112.175 -0.017 -12.263 1002 HD1 TRP 140 HD1 TRP 140 110.751 3.371 -12.990 1003 HE1 TRP 140 HE1 TRP 140 108.685 3.137 -14.512 1004 HE3 TRP 140 HE3 TRP 140 110.078 -1.686 -12.789 1005 HZ2 TRP 140 HZ2 TRP 140 106.971 1.073 -15.517 1006 HZ3 TRP 140 HZ3 TRP 140 108.227 -2.759 -14.035 1007 HH2 TRP 140 HH2 TRP 140 106.674 -1.390 -15.398 1008 H ILE 141 H ILE 141 111.637 -1.581 -9.400 1009 HA ILE 141 HA ILE 141 114.310 -0.895 -8.324 1010 HB ILE 141 HB ILE 141 112.616 -0.712 -6.547 1011 HG12 ILE 141 1HG1 ILE 141 114.221 -3.239 -6.123 1012 HG13 ILE 141 2HG1 ILE 141 114.974 -1.646 -6.173 1013 HG21 ILE 141 1HG2 ILE 141 111.460 -2.792 -5.794 1014 HG22 ILE 141 2HG2 ILE 141 112.059 -3.610 -7.237 1015 HG23 ILE 141 3HG2 ILE 141 110.939 -2.256 -7.391 1016 HD11 ILE 141 3HD1 ILE 141 113.529 -0.888 -4.333 1017 HD12 ILE 141 1HD1 ILE 141 114.446 -2.315 -3.851 1018 HD13 ILE 141 2HD1 ILE 141 112.745 -2.468 -4.289 1019 H ALA 142 H ALA 142 115.838 -2.408 -8.493 1020 HA ALA 142 HA ALA 142 115.060 -5.194 -9.051 1021 HB1 ALA 142 1HB ALA 142 116.954 -3.507 -10.693 1022 HB2 ALA 142 2HB ALA 142 115.543 -4.407 -11.248 1023 HB3 ALA 142 3HB ALA 142 116.989 -5.270 -10.720 1024 H GLY 143 H GLY 143 116.449 -6.718 -8.149 1025 HA2 GLY 143 1HA GLY 143 118.975 -5.834 -6.976 1026 HA3 GLY 143 2HA GLY 143 117.727 -6.305 -5.830 1027 H VAL 144 H VAL 144 119.713 -7.784 -5.424 1028 HA VAL 144 HA VAL 144 119.238 -10.325 -6.845 1029 HB VAL 144 HB VAL 144 121.666 -10.789 -6.792 1030 HG11 VAL 144 1HG1 VAL 144 122.143 -9.594 -8.739 1031 HG12 VAL 144 2HG1 VAL 144 121.361 -8.126 -8.151 1032 HG13 VAL 144 3HG1 VAL 144 120.383 -9.491 -8.688 1033 HG21 VAL 144 3HG2 VAL 144 122.358 -9.396 -4.932 1034 HG22 VAL 144 1HG2 VAL 144 121.798 -7.941 -5.757 1035 HG23 VAL 144 2HG2 VAL 144 123.195 -8.823 -6.375 1036 H GLY 145 H GLY 145 119.578 -12.192 -5.543 1037 HA2 GLY 145 1HA GLY 145 120.110 -11.706 -2.685 1038 HA3 GLY 145 2HA GLY 145 118.601 -12.483 -3.147 1039 H TYR 146 H TYR 146 120.532 -13.641 -1.463 1040 HA TYR 146 HA TYR 146 121.211 -16.024 -3.051 1041 HB2 TYR 146 1HB TYR 146 123.384 -16.208 -2.059 1042 HB3 TYR 146 2HB TYR 146 123.247 -14.630 -2.804 1043 HD1 TYR 146 HD1 TYR 146 123.068 -12.595 -1.407 1044 HD2 TYR 146 HD2 TYR 146 123.618 -16.487 0.325 1045 HE1 TYR 146 HE1 TYR 146 123.730 -11.546 0.739 1046 HE2 TYR 146 HE2 TYR 146 124.280 -15.437 2.472 1047 HH TYR 146 HH TYR 146 125.081 -13.398 3.351 1048 H ARG 147 H ARG 147 121.011 -17.957 -1.957 1049 HA ARG 147 HA ARG 147 119.761 -17.772 0.724 1050 HB2 ARG 147 1HB ARG 147 118.296 -18.593 -1.124 1051 HB3 ARG 147 2HB ARG 147 119.411 -19.941 -1.356 1052 HG2 ARG 147 1HG ARG 147 119.031 -20.692 0.941 1053 HG3 ARG 147 2HG ARG 147 117.976 -19.311 1.240 1054 HD2 ARG 147 1HD ARG 147 116.562 -21.199 0.746 1055 HD3 ARG 147 2HD ARG 147 116.514 -20.121 -0.645 1056 HE ARG 147 HE ARG 147 118.495 -22.260 -0.748 1057 HH11 ARG 147 1HH1 ARG 147 115.292 -21.195 -1.717 1058 HH12 ARG 147 2HH1 ARG 147 115.194 -22.340 -3.012 1059 HH21 ARG 147 1HH2 ARG 147 118.311 -23.713 -2.430 1060 HH22 ARG 147 2HH2 ARG 147 116.882 -23.749 -3.409 1061 H PHE 148 H PHE 148 120.531 -18.993 2.360 1062 HA PHE 148 HA PHE 148 122.562 -21.042 1.793 1063 HB2 PHE 148 1HB PHE 148 123.754 -18.927 2.260 1064 HB3 PHE 148 2HB PHE 148 122.918 -18.809 3.797 1065 HD1 PHE 148 HD1 PHE 148 123.503 -20.276 5.664 1066 HD2 PHE 148 HD2 PHE 148 125.534 -20.550 1.890 1067 HE1 PHE 148 HE1 PHE 148 125.286 -21.636 6.724 1068 HE2 PHE 148 HE2 PHE 148 127.317 -21.910 2.948 1069 HZ PHE 148 HZ PHE 148 127.193 -22.453 5.366 Start of MODEL 7 1 H1 ALA 1 3H ALA 1 116.636 -23.955 9.914 2 H2 ALA 1 2H ALA 1 116.543 -24.646 8.364 3 H3 ALA 1 HT3 ALA 1 115.244 -24.805 9.448 4 HA ALA 1 HA ALA 1 114.443 -23.126 8.161 5 HB1 ALA 1 2HB ALA 1 116.201 -21.765 10.223 6 HB2 ALA 1 3HB ALA 1 114.533 -22.293 10.449 7 HB3 ALA 1 1HB ALA 1 114.896 -20.969 9.342 8 H THR 2 H THR 2 114.754 -21.550 6.559 9 HA THR 2 HA THR 2 117.546 -21.215 5.616 10 HB THR 2 HB THR 2 115.057 -21.415 3.904 11 HG1 THR 2 HG1 THR 2 115.462 -23.421 4.695 12 HG21 THR 2 3HG2 THR 2 118.017 -21.308 3.265 13 HG22 THR 2 1HG2 THR 2 116.815 -20.076 2.884 14 HG23 THR 2 2HG2 THR 2 116.752 -21.647 2.083 15 H SER 3 H SER 3 118.165 -19.195 4.979 16 HA SER 3 HA SER 3 116.141 -17.036 5.100 17 HB2 SER 3 1HB SER 3 117.748 -15.616 6.252 18 HB3 SER 3 2HB SER 3 117.501 -17.091 7.180 19 HG SER 3 HG SER 3 119.444 -17.847 6.480 20 H THR 4 H THR 4 116.546 -15.241 3.770 21 HA THR 4 HA THR 4 118.682 -15.579 1.750 22 HB THR 4 HB THR 4 115.854 -14.658 1.184 23 HG1 THR 4 HG1 THR 4 115.472 -16.654 0.513 24 HG21 THR 4 3HG2 THR 4 117.421 -13.666 -0.350 25 HG22 THR 4 1HG2 THR 4 116.648 -15.008 -1.192 26 HG23 THR 4 2HG2 THR 4 118.279 -15.195 -0.547 27 H VAL 5 H VAL 5 119.839 -13.777 1.328 28 HA VAL 5 HA VAL 5 118.851 -11.207 2.445 29 HB VAL 5 HB VAL 5 121.730 -12.125 2.204 30 HG11 VAL 5 1HG1 VAL 5 121.379 -9.676 1.999 31 HG12 VAL 5 2HG1 VAL 5 122.214 -10.093 3.496 32 HG13 VAL 5 3HG1 VAL 5 120.498 -9.688 3.526 33 HG21 VAL 5 3HG2 VAL 5 121.686 -12.295 4.643 34 HG22 VAL 5 1HG2 VAL 5 120.435 -13.336 3.964 35 HG23 VAL 5 2HG2 VAL 5 120.000 -11.781 4.673 36 H THR 6 H THR 6 118.694 -9.566 1.020 37 HA THR 6 HA THR 6 120.193 -9.716 -1.502 38 HB THR 6 HB THR 6 117.999 -10.787 -1.897 39 HG1 THR 6 HG1 THR 6 117.433 -9.366 -3.644 40 HG21 THR 6 3HG2 THR 6 116.598 -9.657 -0.298 41 HG22 THR 6 1HG2 THR 6 115.981 -9.299 -1.911 42 HG23 THR 6 2HG2 THR 6 116.926 -8.092 -1.041 43 H GLY 7 H GLY 7 120.241 -7.717 -2.692 44 HA2 GLY 7 1HA GLY 7 119.275 -5.330 -1.267 45 HA3 GLY 7 2HA GLY 7 120.986 -5.416 -1.695 46 H GLY 8 H GLY 8 118.927 -3.530 -2.679 47 HA2 GLY 8 1HA GLY 8 119.432 -3.922 -5.534 48 HA3 GLY 8 2HA GLY 8 117.745 -3.884 -5.038 49 H TYR 9 H TYR 9 118.525 -2.092 -6.816 50 HA TYR 9 HA TYR 9 118.626 0.458 -5.324 51 HB2 TYR 9 1HB TYR 9 119.936 1.441 -7.077 52 HB3 TYR 9 2HB TYR 9 120.750 -0.005 -6.519 53 HD1 TYR 9 HD1 TYR 9 118.940 1.582 -9.296 54 HD2 TYR 9 HD2 TYR 9 120.932 -1.980 -7.956 55 HE1 TYR 9 HE1 TYR 9 119.015 0.746 -11.629 56 HE2 TYR 9 HE2 TYR 9 121.007 -2.816 -10.289 57 HH TYR 9 HH TYR 9 119.447 -2.293 -12.478 58 H ALA 10 H ALA 10 117.237 2.074 -6.032 59 HA ALA 10 HA ALA 10 115.522 1.471 -8.348 60 HB1 ALA 10 1HB ALA 10 114.079 0.703 -6.694 61 HB2 ALA 10 2HB ALA 10 113.599 2.393 -6.839 62 HB3 ALA 10 3HB ALA 10 114.642 1.885 -5.511 63 H GLN 11 H GLN 11 114.648 3.238 -9.382 64 HA GLN 11 HA GLN 11 115.574 5.900 -8.480 65 HB2 GLN 11 1HB GLN 11 116.392 5.155 -10.721 66 HB3 GLN 11 2HB GLN 11 114.716 5.045 -11.258 67 HG2 GLN 11 1HG GLN 11 114.427 7.461 -10.632 68 HG3 GLN 11 2HG GLN 11 116.158 7.534 -10.308 69 HE21 GLN 11 1HE2 GLN 11 117.265 8.406 -12.053 70 HE22 GLN 11 2HE2 GLN 11 116.860 8.167 -13.684 71 H SER 12 H SER 12 114.042 7.563 -8.276 72 HA SER 12 HA SER 12 111.223 6.629 -8.341 73 HB2 SER 12 1HB SER 12 112.108 6.892 -6.053 74 HB3 SER 12 2HB SER 12 112.542 8.559 -6.418 75 HG SER 12 HG SER 12 110.288 7.760 -5.480 76 H ASP 13 H ASP 13 109.746 7.873 -9.316 77 HA ASP 13 HA ASP 13 110.490 10.627 -10.102 78 HB2 ASP 13 1HB ASP 13 110.635 9.059 -12.053 79 HB3 ASP 13 2HB ASP 13 108.935 8.664 -11.810 80 H ALA 14 H ALA 14 108.776 12.123 -9.902 81 HA ALA 14 HA ALA 14 106.284 11.069 -8.745 82 HB1 ALA 14 1HB ALA 14 106.605 13.062 -7.050 83 HB2 ALA 14 2HB ALA 14 108.313 12.804 -7.401 84 HB3 ALA 14 3HB ALA 14 107.342 11.490 -6.738 85 H GLN 15 H GLN 15 104.683 11.912 -9.795 86 HA GLN 15 HA GLN 15 104.823 14.405 -11.240 87 HB2 GLN 15 1HB GLN 15 103.383 12.494 -11.969 88 HB3 GLN 15 2HB GLN 15 102.387 12.745 -10.533 89 HG2 GLN 15 1HG GLN 15 101.878 15.032 -11.257 90 HG3 GLN 15 2HG GLN 15 102.911 14.832 -12.668 91 HE21 GLN 15 1HE2 GLN 15 100.317 15.510 -13.222 92 HE22 GLN 15 2HE2 GLN 15 99.449 14.175 -13.812 93 H GLY 16 H GLY 16 104.456 16.356 -10.435 94 HA2 GLY 16 1HA GLY 16 103.426 17.956 -8.998 95 HA3 GLY 16 2HA GLY 16 103.055 16.664 -7.868 96 H GLN 17 H GLN 17 106.037 15.773 -8.416 97 HA GLN 17 HA GLN 17 107.298 17.749 -6.604 98 HB2 GLN 17 1HB GLN 17 106.980 15.447 -5.652 99 HB3 GLN 17 2HB GLN 17 108.023 14.830 -6.933 100 HG2 GLN 17 1HG GLN 17 109.861 16.247 -6.163 101 HG3 GLN 17 2HG GLN 17 108.829 16.950 -4.923 102 HE21 GLN 17 1HE2 GLN 17 111.127 15.775 -4.001 103 HE22 GLN 17 2HE2 GLN 17 110.795 14.281 -3.265 104 H MET 18 H MET 18 109.508 18.276 -7.016 105 HA MET 18 HA MET 18 110.185 18.060 -9.866 106 HB2 MET 18 1HB MET 18 111.228 19.868 -7.677 107 HB3 MET 18 2HB MET 18 111.813 19.881 -9.341 108 HG2 MET 18 1HG MET 18 109.493 20.344 -10.122 109 HG3 MET 18 2HG MET 18 108.971 20.429 -8.440 110 HE1 MET 18 3HE MET 18 108.508 22.923 -10.473 111 HE2 MET 18 1HE MET 18 108.751 24.111 -9.186 112 HE3 MET 18 2HE MET 18 107.953 22.579 -8.836 113 H ASN 19 H ASN 19 112.223 17.428 -10.582 114 HA ASN 19 HA ASN 19 114.214 16.307 -10.619 115 HB2 ASN 19 1HB ASN 19 114.314 16.879 -7.652 116 HB3 ASN 19 2HB ASN 19 115.666 16.420 -8.682 117 HD21 ASN 19 1HD2 ASN 19 115.179 18.061 -10.947 118 HD22 ASN 19 2HD2 ASN 19 115.316 19.688 -10.482 119 H LYS 20 H LYS 20 114.885 14.234 -10.529 120 HA LYS 20 HA LYS 20 113.126 12.280 -9.296 121 HB2 LYS 20 1HB LYS 20 115.622 11.976 -10.984 122 HB3 LYS 20 2HB LYS 20 114.611 10.638 -10.437 123 HG2 LYS 20 1HG LYS 20 112.664 11.684 -11.592 124 HG3 LYS 20 2HG LYS 20 113.742 12.932 -12.217 125 HD2 LYS 20 1HD LYS 20 115.122 11.145 -13.287 126 HD3 LYS 20 2HD LYS 20 113.934 9.955 -12.755 127 HE2 LYS 20 1HE LYS 20 113.313 10.488 -14.989 128 HE3 LYS 20 2HE LYS 20 112.187 11.386 -13.971 129 HZ1 LYS 20 3HZ LYS 20 114.506 12.383 -15.493 130 HZ2 LYS 20 1HZ LYS 20 113.931 13.244 -14.149 131 HZ3 LYS 20 2HZ LYS 20 112.909 12.962 -15.475 132 H MET 21 H MET 21 114.093 10.446 -8.033 133 HA MET 21 HA MET 21 116.271 11.413 -6.262 134 HB2 MET 21 1HB MET 21 113.702 10.038 -5.428 135 HB3 MET 21 2HB MET 21 115.045 10.439 -4.355 136 HG2 MET 21 1HG MET 21 114.772 12.848 -5.028 137 HG3 MET 21 2HG MET 21 113.316 12.383 -5.906 138 HE1 MET 21 3HE MET 21 115.307 11.952 -2.921 139 HE2 MET 21 1HE MET 21 114.220 11.406 -1.639 140 HE3 MET 21 2HE MET 21 114.496 13.128 -1.890 141 H GLY 22 H GLY 22 117.266 9.601 -4.980 142 HA2 GLY 22 1HA GLY 22 117.169 7.039 -6.479 143 HA3 GLY 22 2HA GLY 22 118.702 7.788 -6.028 144 H GLY 23 H GLY 23 117.229 5.205 -5.195 145 HA2 GLY 23 1HA GLY 23 117.778 5.532 -2.331 146 HA3 GLY 23 2HA GLY 23 116.175 4.975 -2.799 147 H PHE 24 H PHE 24 117.640 3.430 -1.179 148 HA PHE 24 HA PHE 24 118.335 1.128 -2.899 149 HB2 PHE 24 1HB PHE 24 120.158 0.533 -1.412 150 HB3 PHE 24 2HB PHE 24 120.419 2.136 -2.070 151 HD1 PHE 24 HD1 PHE 24 120.120 4.143 -0.634 152 HD2 PHE 24 HD2 PHE 24 119.816 0.156 0.935 153 HE1 PHE 24 HE1 PHE 24 120.364 5.031 1.669 154 HE2 PHE 24 HE2 PHE 24 120.059 1.043 3.238 155 HZ PHE 24 HZ PHE 24 120.335 3.480 3.605 156 H ASN 25 H ASN 25 118.055 -0.955 -1.803 157 HA ASN 25 HA ASN 25 116.284 -0.841 0.554 158 HB2 ASN 25 1HB ASN 25 114.888 -0.846 -1.509 159 HB3 ASN 25 2HB ASN 25 115.627 -2.382 -1.963 160 HD21 ASN 25 1HD2 ASN 25 113.937 -0.893 0.848 161 HD22 ASN 25 2HD2 ASN 25 113.109 -2.305 1.289 162 H LEU 26 H LEU 26 116.475 -2.516 1.936 163 HA LEU 26 HA LEU 26 118.072 -4.865 1.094 164 HB2 LEU 26 1HB LEU 26 118.055 -3.571 3.837 165 HB3 LEU 26 2HB LEU 26 118.990 -4.986 3.356 166 HG LEU 26 HG LEU 26 119.270 -2.238 2.107 167 HD11 LEU 26 1HD1 LEU 26 121.428 -2.169 3.323 168 HD12 LEU 26 2HD1 LEU 26 121.029 -3.700 4.102 169 HD13 LEU 26 3HD1 LEU 26 120.063 -2.262 4.438 170 HD21 LEU 26 3HD2 LEU 26 121.468 -3.402 1.333 171 HD22 LEU 26 1HD2 LEU 26 119.973 -3.812 0.493 172 HD23 LEU 26 2HD2 LEU 26 120.626 -4.904 1.714 173 H LYS 27 H LYS 27 117.228 -6.872 1.730 174 HA LYS 27 HA LYS 27 114.637 -6.771 3.168 175 HB2 LYS 27 1HB LYS 27 115.193 -8.421 0.699 176 HB3 LYS 27 2HB LYS 27 113.683 -8.360 1.604 177 HG2 LYS 27 1HG LYS 27 113.678 -5.847 1.149 178 HG3 LYS 27 2HG LYS 27 114.964 -6.150 -0.011 179 HD2 LYS 27 1HD LYS 27 112.244 -7.485 -0.073 180 HD3 LYS 27 2HD LYS 27 112.709 -6.113 -1.074 181 HE2 LYS 27 1HE LYS 27 114.124 -8.796 -1.077 182 HE3 LYS 27 2HE LYS 27 112.930 -8.290 -2.268 183 HZ1 LYS 27 3HZ LYS 27 115.511 -6.934 -1.704 184 HZ2 LYS 27 1HZ LYS 27 114.345 -6.397 -2.814 185 HZ3 LYS 27 2HZ LYS 27 115.149 -7.871 -3.073 186 H TYR 28 H TYR 28 114.097 -8.482 4.417 187 HA TYR 28 HA TYR 28 116.073 -10.677 4.682 188 HB2 TYR 28 1HB TYR 28 116.132 -9.121 6.608 189 HB3 TYR 28 2HB TYR 28 114.421 -9.401 6.870 190 HD1 TYR 28 HD1 TYR 28 117.794 -10.912 7.009 191 HD2 TYR 28 HD2 TYR 28 113.631 -11.412 7.942 192 HE1 TYR 28 HE1 TYR 28 118.347 -12.865 8.435 193 HE2 TYR 28 HE2 TYR 28 114.185 -13.363 9.368 194 HH TYR 28 HH TYR 28 115.805 -14.613 10.223 195 H ARG 29 H ARG 29 115.239 -12.742 4.801 196 HA ARG 29 HA ARG 29 112.296 -13.013 4.639 197 HB2 ARG 29 1HB ARG 29 113.354 -13.115 2.381 198 HB3 ARG 29 2HB ARG 29 114.292 -14.506 2.926 199 HG2 ARG 29 1HG ARG 29 112.182 -15.709 3.436 200 HG3 ARG 29 2HG ARG 29 111.265 -14.332 2.823 201 HD2 ARG 29 1HD ARG 29 112.436 -14.587 0.629 202 HD3 ARG 29 2HD ARG 29 113.214 -16.039 1.251 203 HE ARG 29 HE ARG 29 110.495 -16.410 1.636 204 HH11 ARG 29 1HH1 ARG 29 112.587 -15.890 -1.136 205 HH12 ARG 29 2HH1 ARG 29 111.548 -16.765 -2.210 206 HH21 ARG 29 1HH2 ARG 29 109.198 -17.527 0.204 207 HH22 ARG 29 2HH2 ARG 29 109.655 -17.680 -1.460 208 H TYR 30 H TYR 30 111.419 -14.728 5.688 209 HA TYR 30 HA TYR 30 113.243 -16.733 6.867 210 HB2 TYR 30 1HB TYR 30 112.632 -15.027 8.556 211 HB3 TYR 30 2HB TYR 30 110.939 -15.387 8.281 212 HD1 TYR 30 HD2 TYR 30 114.094 -16.564 9.753 213 HD2 TYR 30 HD1 TYR 30 109.948 -17.472 9.095 214 HE1 TYR 30 HE2 TYR 30 114.220 -18.367 11.451 215 HE2 TYR 30 HE1 TYR 30 110.073 -19.275 10.793 216 HH TYR 30 HH TYR 30 111.917 -20.754 11.769 217 H GLU 31 H GLU 31 112.465 -18.813 6.940 218 HA GLU 31 HA GLU 31 109.684 -19.286 6.089 219 HB2 GLU 31 1HB GLU 31 112.126 -20.575 4.850 220 HB3 GLU 31 2HB GLU 31 110.456 -21.045 4.529 221 HG2 GLU 31 1HG GLU 31 109.985 -18.727 3.753 222 HG3 GLU 31 2HG GLU 31 111.680 -18.324 3.996 223 H GLU 32 H GLU 32 108.773 -21.211 6.823 224 HA GLU 32 HA GLU 32 110.185 -22.478 9.054 225 HB2 GLU 32 1HB GLU 32 107.831 -21.699 9.332 226 HB3 GLU 32 2HB GLU 32 107.337 -22.878 8.116 227 HG2 GLU 32 1HG GLU 32 106.989 -23.900 10.262 228 HG3 GLU 32 2HG GLU 32 108.400 -24.668 9.542 229 H ASP 33 H ASP 33 110.699 -24.644 9.135 230 HA ASP 33 HA ASP 33 111.459 -25.787 6.662 231 HB2 ASP 33 1HB ASP 33 111.376 -26.973 9.438 232 HB3 ASP 33 2HB ASP 33 112.150 -27.731 8.049 233 H ASN 34 H ASN 34 108.819 -26.651 8.924 234 HA ASN 34 HA ASN 34 108.042 -28.816 7.077 235 HB2 ASN 34 1HB ASN 34 107.210 -28.249 9.924 236 HB3 ASN 34 2HB ASN 34 106.651 -29.612 8.958 237 HD21 ASN 34 1HD2 ASN 34 108.216 -29.837 11.431 238 HD22 ASN 34 2HD2 ASN 34 109.685 -30.580 11.014 239 H SER 35 H SER 35 107.015 -25.650 7.967 240 HA SER 35 HA SER 35 104.698 -25.988 6.217 241 HB2 SER 35 1HB SER 35 104.101 -26.258 8.766 242 HB3 SER 35 2HB SER 35 104.270 -24.506 8.790 243 HG SER 35 HG SER 35 102.435 -24.375 7.776 244 HA PRO 36 HA PRO 36 107.391 -22.248 5.879 245 HB2 PRO 36 1HB PRO 36 107.821 -22.222 3.196 246 HB3 PRO 36 2HB PRO 36 108.741 -23.255 4.310 247 HG2 PRO 36 1HG PRO 36 106.483 -23.956 2.511 248 HG3 PRO 36 2HG PRO 36 107.938 -24.884 2.918 249 HD2 PRO 36 1HD PRO 36 105.465 -25.347 4.046 250 HD3 PRO 36 2HD PRO 36 107.006 -25.769 4.822 251 H LEU 37 H LEU 37 106.639 -20.275 5.827 252 HA LEU 37 HA LEU 37 104.705 -19.463 3.745 253 HB2 LEU 37 1HB LEU 37 103.680 -19.463 6.035 254 HB3 LEU 37 2HB LEU 37 104.923 -18.322 6.549 255 HG LEU 37 HG LEU 37 104.166 -16.827 4.628 256 HD11 LEU 37 1HD1 LEU 37 101.763 -17.274 3.931 257 HD12 LEU 37 2HD1 LEU 37 101.940 -18.880 4.639 258 HD13 LEU 37 3HD1 LEU 37 102.952 -18.400 3.277 259 HD21 LEU 37 3HD2 LEU 37 103.536 -16.550 7.067 260 HD22 LEU 37 1HD2 LEU 37 102.043 -17.418 6.709 261 HD23 LEU 37 2HD2 LEU 37 102.373 -15.872 5.929 262 H GLY 38 H GLY 38 105.328 -17.562 2.601 263 HA2 GLY 38 1HA GLY 38 108.159 -16.906 3.055 264 HA3 GLY 38 2HA GLY 38 107.241 -16.578 1.586 265 H VAL 39 H VAL 39 108.579 -15.178 4.264 266 HA VAL 39 HA VAL 39 106.784 -12.824 4.047 267 HB VAL 39 HB VAL 39 108.338 -13.717 6.492 268 HG11 VAL 39 1HG1 VAL 39 106.255 -11.539 6.150 269 HG12 VAL 39 2HG1 VAL 39 107.994 -11.250 6.213 270 HG13 VAL 39 3HG1 VAL 39 107.158 -11.910 7.619 271 HG21 VAL 39 3HG2 VAL 39 105.873 -13.925 7.350 272 HG22 VAL 39 1HG2 VAL 39 106.550 -15.236 6.384 273 HG23 VAL 39 2HG2 VAL 39 105.470 -14.058 5.639 274 H ILE 40 H ILE 40 107.738 -11.042 3.383 275 HA ILE 40 HA ILE 40 110.684 -10.797 3.643 276 HB ILE 40 HB ILE 40 108.953 -9.764 1.378 277 HG12 ILE 40 1HG1 ILE 40 111.010 -11.993 1.371 278 HG13 ILE 40 2HG1 ILE 40 109.268 -12.261 1.417 279 HG21 ILE 40 1HG2 ILE 40 111.962 -9.795 1.771 280 HG22 ILE 40 2HG2 ILE 40 110.932 -8.367 1.875 281 HG23 ILE 40 3HG2 ILE 40 111.117 -9.208 0.337 282 HD11 ILE 40 3HD1 ILE 40 109.027 -11.022 -0.711 283 HD12 ILE 40 1HD1 ILE 40 110.097 -12.412 -0.894 284 HD13 ILE 40 2HD1 ILE 40 110.774 -10.788 -0.765 285 H GLY 41 H GLY 41 111.337 -9.074 4.736 286 HA2 GLY 41 1HA GLY 41 109.507 -6.746 4.978 287 HA3 GLY 41 2HA GLY 41 110.671 -7.216 6.221 288 H SER 42 H SER 42 110.263 -4.843 4.158 289 HA SER 42 HA SER 42 113.084 -4.771 3.253 290 HB2 SER 42 1HB SER 42 112.471 -4.126 1.104 291 HB3 SER 42 2HB SER 42 111.243 -5.314 1.498 292 HG SER 42 HG SER 42 110.919 -2.783 0.817 293 H PHE 43 H PHE 43 114.158 -2.895 3.561 294 HA PHE 43 HA PHE 43 112.608 -0.593 4.617 295 HB2 PHE 43 1HB PHE 43 115.503 -1.330 5.091 296 HB3 PHE 43 2HB PHE 43 114.681 0.073 5.748 297 HD1 PHE 43 HD1 PHE 43 112.785 -0.267 7.392 298 HD2 PHE 43 HD2 PHE 43 115.360 -3.462 6.119 299 HE1 PHE 43 HE1 PHE 43 112.074 -1.619 9.346 300 HE2 PHE 43 HE2 PHE 43 114.648 -4.813 8.073 301 HZ PHE 43 HZ PHE 43 113.004 -3.892 9.685 302 H THR 44 H THR 44 112.528 1.126 3.297 303 HA THR 44 HA THR 44 114.520 1.286 1.100 304 HB THR 44 HB THR 44 112.814 2.461 -0.180 305 HG1 THR 44 HG1 THR 44 111.754 3.483 1.516 306 HG21 THR 44 3HG2 THR 44 112.738 0.071 -0.422 307 HG22 THR 44 1HG2 THR 44 111.071 0.628 -0.280 308 HG23 THR 44 2HG2 THR 44 111.874 -0.114 1.104 309 H TYR 45 H TYR 45 115.724 3.078 0.903 310 HA TYR 45 HA TYR 45 114.911 5.507 2.394 311 HB2 TYR 45 1HB TYR 45 116.795 4.355 3.523 312 HB3 TYR 45 2HB TYR 45 117.723 4.457 2.039 313 HD1 TYR 45 HD1 TYR 45 116.237 6.389 4.821 314 HD2 TYR 45 HD2 TYR 45 118.788 6.514 1.367 315 HE1 TYR 45 HE1 TYR 45 117.051 8.629 5.504 316 HE2 TYR 45 HE2 TYR 45 119.602 8.755 2.050 317 HH TYR 45 HH TYR 45 119.024 10.055 5.142 318 H THR 46 H THR 46 114.664 7.195 1.085 319 HA THR 46 HA THR 46 116.101 7.230 -1.508 320 HB THR 46 HB THR 46 113.289 8.227 -0.983 321 HG1 THR 46 HG1 THR 46 114.286 5.890 -2.235 322 HG21 THR 46 3HG2 THR 46 115.150 8.241 -3.332 323 HG22 THR 46 1HG2 THR 46 114.028 9.486 -2.784 324 HG23 THR 46 2HG2 THR 46 113.420 8.057 -3.619 325 H GLU 47 H GLU 47 116.976 9.179 -2.133 326 HA GLU 47 HA GLU 47 116.469 11.598 -0.619 327 HB2 GLU 47 1HB GLU 47 118.006 10.208 0.826 328 HB3 GLU 47 2HB GLU 47 119.208 10.323 -0.455 329 HG2 GLU 47 1HG GLU 47 119.128 12.798 -0.282 330 HG3 GLU 47 2HG GLU 47 117.968 12.657 1.031 331 H LYS 48 H LYS 48 117.418 13.439 -1.584 332 HA LYS 48 HA LYS 48 119.106 13.002 -3.956 333 HB2 LYS 48 1HB LYS 48 116.774 13.399 -4.725 334 HB3 LYS 48 2HB LYS 48 116.769 14.929 -3.851 335 HG2 LYS 48 1HG LYS 48 117.315 15.480 -6.105 336 HG3 LYS 48 2HG LYS 48 118.838 15.559 -5.221 337 HD2 LYS 48 1HD LYS 48 119.451 13.328 -5.997 338 HD3 LYS 48 2HD LYS 48 117.889 13.147 -6.794 339 HE2 LYS 48 1HE LYS 48 119.231 13.830 -8.573 340 HE3 LYS 48 2HE LYS 48 118.586 15.375 -8.017 341 HZ1 LYS 48 3HZ LYS 48 121.103 15.142 -8.379 342 HZ2 LYS 48 1HZ LYS 48 121.098 14.314 -6.899 343 HZ3 LYS 48 2HZ LYS 48 120.554 15.922 -6.973 344 H SER 49 H SER 49 120.892 14.229 -3.882 345 HA SER 49 HA SER 49 120.979 16.408 -1.877 346 HB2 SER 49 1HB SER 49 122.506 14.492 -1.477 347 HB3 SER 49 2HB SER 49 123.257 14.791 -3.041 348 HG SER 49 HG SER 49 124.412 16.233 -2.050 349 H ARG 50 H ARG 50 121.364 18.420 -2.514 350 HA ARG 50 HA ARG 50 122.659 18.907 -5.109 351 HB2 ARG 50 1HB ARG 50 120.188 19.036 -5.434 352 HB3 ARG 50 2HB ARG 50 120.127 20.308 -4.214 353 HG2 ARG 50 1HG ARG 50 121.727 21.648 -5.586 354 HG3 ARG 50 2HG ARG 50 121.648 20.404 -6.835 355 HD2 ARG 50 1HD ARG 50 119.286 21.988 -5.787 356 HD3 ARG 50 2HD ARG 50 120.097 22.263 -7.326 357 HE ARG 50 HE ARG 50 118.264 20.103 -6.680 358 HH11 ARG 50 1HH1 ARG 50 120.723 21.235 -8.915 359 HH12 ARG 50 2HH1 ARG 50 120.189 20.189 -10.188 360 HH21 ARG 50 1HH2 ARG 50 117.622 18.779 -8.356 361 HH22 ARG 50 2HH2 ARG 50 118.455 18.817 -9.875 362 H THR 51 H THR 51 124.063 20.602 -5.073 363 HA THR 51 HA THR 51 123.986 22.427 -2.747 364 HB THR 51 HB THR 51 125.703 20.742 -2.307 365 HG1 THR 51 HG1 THR 51 127.134 22.212 -1.748 366 HG21 THR 51 3HG2 THR 51 127.524 20.330 -3.805 367 HG22 THR 51 1HG2 THR 51 127.047 21.666 -4.854 368 HG23 THR 51 2HG2 THR 51 126.051 20.213 -4.768 369 H ALA 52 H ALA 52 124.017 24.486 -3.313 370 HA ALA 52 HA ALA 52 125.256 25.263 -5.886 371 HB1 ALA 52 1HB ALA 52 123.453 26.791 -6.327 372 HB2 ALA 52 2HB ALA 52 122.719 26.463 -4.759 373 HB3 ALA 52 3HB ALA 52 122.739 25.212 -6.002 374 H SER 53 H SER 53 126.140 27.380 -5.940 375 HA SER 53 HA SER 53 127.417 28.257 -3.600 376 HB2 SER 53 1HB SER 53 126.788 29.890 -6.071 377 HB3 SER 53 2HB SER 53 128.029 30.241 -4.875 378 HG SER 53 HG SER 53 129.268 28.836 -5.829 379 H SER 54 H SER 54 124.388 29.297 -5.113 380 HA SER 54 HA SER 54 123.587 30.524 -2.580 381 HB2 SER 54 1HB SER 54 124.622 32.352 -3.922 382 HB3 SER 54 2HB SER 54 123.462 32.027 -5.205 383 HG SER 54 HG SER 54 122.899 32.791 -2.524 384 H GLY 55 H GLY 55 121.324 30.686 -2.329 385 HA2 GLY 55 1HA GLY 55 119.080 30.369 -2.895 386 HA3 GLY 55 2HA GLY 55 119.578 29.851 -4.497 387 H ASP 56 H ASP 56 121.095 28.327 -1.753 388 HA ASP 56 HA ASP 56 120.428 25.736 -2.583 389 HB2 ASP 56 1HB ASP 56 121.268 26.735 0.146 390 HB3 ASP 56 2HB ASP 56 121.219 25.039 -0.328 391 H TYR 57 H TYR 57 118.962 24.220 -1.838 392 HA TYR 57 HA TYR 57 116.620 25.310 -0.384 393 HB2 TYR 57 1HB TYR 57 116.256 24.702 -2.785 394 HB3 TYR 57 2HB TYR 57 116.684 23.049 -2.386 395 HD1 TYR 57 HD1 TYR 57 114.206 25.748 -1.822 396 HD2 TYR 57 HD2 TYR 57 115.112 21.579 -1.327 397 HE1 TYR 57 HE1 TYR 57 111.848 25.312 -1.191 398 HE2 TYR 57 HE2 TYR 57 112.754 21.142 -0.695 399 HH TYR 57 HH TYR 57 110.725 22.006 -0.457 400 H ASN 58 H ASN 58 115.545 23.889 1.085 401 HA ASN 58 HA ASN 58 117.364 22.375 2.674 402 HB2 ASN 58 1HB ASN 58 115.382 21.861 4.046 403 HB3 ASN 58 2HB ASN 58 115.474 23.579 3.665 404 HD21 ASN 58 1HD2 ASN 58 113.678 24.495 2.617 405 HD22 ASN 58 2HD2 ASN 58 112.392 23.596 1.969 406 H LYS 59 H LYS 59 117.062 20.107 3.299 407 HA LYS 59 HA LYS 59 116.518 18.500 0.889 408 HB2 LYS 59 1HB LYS 59 118.141 17.897 3.369 409 HB3 LYS 59 2HB LYS 59 117.906 16.780 2.024 410 HG2 LYS 59 1HG LYS 59 118.889 18.482 0.488 411 HG3 LYS 59 2HG LYS 59 119.215 19.511 1.883 412 HD2 LYS 59 1HD LYS 59 120.579 17.664 2.871 413 HD3 LYS 59 2HD LYS 59 120.337 16.738 1.388 414 HE2 LYS 59 1HE LYS 59 121.382 18.577 0.089 415 HE3 LYS 59 2HE LYS 59 121.676 19.452 1.593 416 HZ1 LYS 59 3HZ LYS 59 123.633 18.228 0.948 417 HZ2 LYS 59 1HZ LYS 59 122.754 16.778 0.876 418 HZ3 LYS 59 2HZ LYS 59 122.988 17.555 2.369 419 H ASN 60 H ASN 60 115.094 16.857 0.858 420 HA ASN 60 HA ASN 60 113.588 16.261 3.341 421 HB2 ASN 60 1HB ASN 60 112.318 17.395 1.454 422 HB3 ASN 60 2HB ASN 60 112.580 15.931 0.511 423 HD21 ASN 60 1HD2 ASN 60 109.952 16.564 1.002 424 HD22 ASN 60 2HD2 ASN 60 109.292 15.536 2.180 425 H GLN 61 H GLN 61 113.502 14.163 3.987 426 HA GLN 61 HA GLN 61 114.730 12.135 2.191 427 HB2 GLN 61 1HB GLN 61 114.948 12.391 5.201 428 HB3 GLN 61 2HB GLN 61 115.563 11.034 4.256 429 HG2 GLN 61 1HG GLN 61 117.042 12.526 3.009 430 HG3 GLN 61 2HG GLN 61 116.389 13.923 3.861 431 HE21 GLN 61 1HE2 GLN 61 119.181 13.273 3.954 432 HE22 GLN 61 2HE2 GLN 61 119.566 12.817 5.543 433 H TYR 62 H TYR 62 113.761 10.122 2.103 434 HA TYR 62 HA TYR 62 111.205 9.830 3.588 435 HB2 TYR 62 1HB TYR 62 111.810 8.979 0.754 436 HB3 TYR 62 2HB TYR 62 110.312 8.681 1.615 437 HD1 TYR 62 HD1 TYR 62 112.392 11.193 -0.077 438 HD2 TYR 62 HD2 TYR 62 108.714 10.489 2.027 439 HE1 TYR 62 HE1 TYR 62 111.525 13.380 -0.862 440 HE2 TYR 62 HE2 TYR 62 107.846 12.676 1.242 441 HH TYR 62 HH TYR 62 108.233 14.264 -0.563 442 H TYR 63 H TYR 63 110.936 7.988 4.666 443 HA TYR 63 HA TYR 63 112.614 5.649 3.970 444 HB2 TYR 63 1HB TYR 63 113.453 6.865 6.008 445 HB3 TYR 63 2HB TYR 63 111.913 6.528 6.775 446 HD1 TYR 63 HD1 TYR 63 115.046 5.056 5.489 447 HD2 TYR 63 HD2 TYR 63 111.391 4.322 7.623 448 HE1 TYR 63 HE1 TYR 63 115.929 2.866 6.245 449 HE2 TYR 63 HE2 TYR 63 112.274 2.131 8.379 450 HH TYR 63 HH TYR 63 115.571 1.261 8.030 451 H GLY 64 H GLY 64 111.489 3.717 3.916 452 HA2 GLY 64 1HA GLY 64 108.664 3.786 4.814 453 HA3 GLY 64 2HA GLY 64 109.071 3.287 3.178 454 H ILE 65 H ILE 65 107.898 1.947 5.697 455 HA ILE 65 HA ILE 65 109.647 -0.447 5.645 456 HB ILE 65 HB ILE 65 109.572 0.589 7.878 457 HG12 ILE 65 1HG1 ILE 65 107.843 -1.894 7.905 458 HG13 ILE 65 2HG1 ILE 65 109.563 -1.946 7.516 459 HG21 ILE 65 1HG2 ILE 65 106.593 0.048 7.828 460 HG22 ILE 65 2HG2 ILE 65 107.294 1.637 7.523 461 HG23 ILE 65 3HG2 ILE 65 107.516 0.863 9.092 462 HD11 ILE 65 3HD1 ILE 65 108.562 -0.612 10.031 463 HD12 ILE 65 1HD1 ILE 65 110.192 -1.179 9.666 464 HD13 ILE 65 2HD1 ILE 65 108.903 -2.341 9.979 465 H THR 66 H THR 66 108.736 -2.214 4.750 466 HA THR 66 HA THR 66 105.805 -2.434 4.704 467 HB THR 66 HB THR 66 106.466 -1.358 2.590 468 HG1 THR 66 HG1 THR 66 105.386 -2.815 1.293 469 HG21 THR 66 3HG2 THR 66 107.873 -3.872 1.766 470 HG22 THR 66 1HG2 THR 66 108.760 -2.639 2.662 471 HG23 THR 66 2HG2 THR 66 108.021 -2.241 1.110 472 H ALA 67 H ALA 67 105.029 -4.569 4.192 473 HA ALA 67 HA ALA 67 106.995 -6.743 4.329 474 HB1 ALA 67 1HB ALA 67 104.634 -6.519 6.215 475 HB2 ALA 67 2HB ALA 67 106.324 -6.302 6.671 476 HB3 ALA 67 3HB ALA 67 105.755 -7.877 6.115 477 H GLY 68 H GLY 68 106.186 -8.730 3.474 478 HA2 GLY 68 1HA GLY 68 103.494 -8.656 2.315 479 HA3 GLY 68 2HA GLY 68 104.853 -8.784 1.222 480 HA PRO 69 HA PRO 69 104.103 -13.161 2.919 481 HB2 PRO 69 1HB PRO 69 101.790 -14.063 1.814 482 HB3 PRO 69 2HB PRO 69 101.860 -13.369 3.448 483 HG2 PRO 69 1HG PRO 69 100.956 -12.125 0.905 484 HG3 PRO 69 2HG PRO 69 100.293 -11.966 2.541 485 HD2 PRO 69 1HD PRO 69 101.915 -10.078 1.375 486 HD3 PRO 69 2HD PRO 69 101.773 -10.311 3.129 487 H ALA 70 H ALA 70 104.329 -15.075 1.431 488 HA ALA 70 HA ALA 70 104.529 -14.312 -1.421 489 HB1 ALA 70 1HB ALA 70 106.585 -16.180 -0.366 490 HB2 ALA 70 2HB ALA 70 106.751 -14.485 0.090 491 HB3 ALA 70 3HB ALA 70 106.710 -14.939 -1.612 492 H TYR 71 H TYR 71 104.293 -16.041 -2.903 493 HA TYR 71 HA TYR 71 103.053 -18.475 -1.754 494 HB2 TYR 71 1HB TYR 71 102.255 -17.034 -4.287 495 HB3 TYR 71 2HB TYR 71 101.523 -18.496 -3.652 496 HD1 TYR 71 HD1 TYR 71 100.310 -18.375 -1.412 497 HD2 TYR 71 HD2 TYR 71 101.552 -14.891 -3.596 498 HE1 TYR 71 HE1 TYR 71 98.720 -16.989 -0.108 499 HE2 TYR 71 HE2 TYR 71 99.962 -13.505 -2.292 500 HH TYR 71 HH TYR 71 98.824 -13.611 -0.077 501 H ARG 72 H ARG 72 103.936 -20.345 -2.444 502 HA ARG 72 HA ARG 72 105.798 -20.219 -4.753 503 HB2 ARG 72 1HB ARG 72 106.811 -20.712 -2.514 504 HB3 ARG 72 2HB ARG 72 105.825 -22.173 -2.443 505 HG2 ARG 72 1HG ARG 72 106.858 -22.952 -4.561 506 HG3 ARG 72 2HG ARG 72 107.884 -21.516 -4.570 507 HD2 ARG 72 1HD ARG 72 108.771 -22.194 -2.333 508 HD3 ARG 72 2HD ARG 72 107.837 -23.681 -2.452 509 HE ARG 72 HE ARG 72 109.600 -23.189 -4.701 510 HH11 ARG 72 1HH1 ARG 72 109.327 -24.690 -1.538 511 HH12 ARG 72 2HH1 ARG 72 110.649 -25.771 -1.828 512 HH21 ARG 72 1HH2 ARG 72 111.294 -24.602 -5.013 513 HH22 ARG 72 2HH2 ARG 72 111.748 -25.721 -3.771 514 H ILE 73 H ILE 73 104.687 -20.929 -6.466 515 HA ILE 73 HA ILE 73 103.118 -23.416 -6.225 516 HB ILE 73 HB ILE 73 103.249 -21.424 -8.508 517 HG12 ILE 73 1HG1 ILE 73 101.054 -21.924 -6.474 518 HG13 ILE 73 2HG1 ILE 73 102.191 -20.578 -6.391 519 HG21 ILE 73 1HG2 ILE 73 101.324 -22.662 -9.383 520 HG22 ILE 73 2HG2 ILE 73 101.376 -23.758 -8.002 521 HG23 ILE 73 3HG2 ILE 73 102.690 -23.758 -9.178 522 HD11 ILE 73 3HD1 ILE 73 100.092 -19.868 -7.460 523 HD12 ILE 73 1HD1 ILE 73 100.275 -21.131 -8.676 524 HD13 ILE 73 2HD1 ILE 73 101.428 -19.798 -8.609 525 H ASN 74 H ASN 74 105.058 -22.036 -8.878 526 HA ASN 74 HA ASN 74 106.238 -24.632 -9.426 527 HB2 ASN 74 1HB ASN 74 105.534 -22.919 -11.190 528 HB3 ASN 74 2HB ASN 74 106.954 -21.995 -10.711 529 HD21 ASN 74 1HD2 ASN 74 107.806 -22.410 -12.940 530 HD22 ASN 74 2HD2 ASN 74 108.516 -23.911 -13.293 531 H ASP 75 H ASP 75 108.340 -25.215 -9.025 532 HA ASP 75 HA ASP 75 109.608 -24.226 -6.761 533 HB2 ASP 75 1HB ASP 75 109.986 -26.453 -7.883 534 HB3 ASP 75 2HB ASP 75 111.004 -25.616 -9.051 535 H TRP 76 H TRP 76 110.139 -23.384 -10.157 536 HA TRP 76 HA TRP 76 112.447 -21.763 -9.617 537 HB2 TRP 76 1HB TRP 76 110.685 -22.125 -12.025 538 HB3 TRP 76 2HB TRP 76 112.003 -20.970 -11.998 539 HD1 TRP 76 HD1 TRP 76 114.491 -22.114 -11.387 540 HE1 TRP 76 HE1 TRP 76 115.446 -24.346 -12.253 541 HE3 TRP 76 HE3 TRP 76 110.170 -24.425 -12.824 542 HZ2 TRP 76 HZ2 TRP 76 114.501 -26.791 -13.405 543 HZ3 TRP 76 HZ3 TRP 76 110.225 -26.698 -13.800 544 HH2 TRP 76 HH2 TRP 76 112.380 -27.885 -14.093 545 H ALA 77 H ALA 77 108.992 -21.107 -10.118 546 HA ALA 77 HA ALA 77 109.546 -18.213 -9.920 547 HB1 ALA 77 1HB ALA 77 107.273 -17.945 -10.870 548 HB2 ALA 77 2HB ALA 77 107.125 -19.701 -10.949 549 HB3 ALA 77 3HB ALA 77 108.344 -18.874 -11.920 550 H SER 78 H SER 78 109.145 -17.207 -8.096 551 HA SER 78 HA SER 78 106.849 -18.075 -6.438 552 HB2 SER 78 1HB SER 78 109.428 -16.792 -5.489 553 HB3 SER 78 2HB SER 78 108.053 -17.222 -4.476 554 HG SER 78 HG SER 78 110.043 -18.742 -5.000 555 H ILE 79 H ILE 79 105.594 -16.341 -5.497 556 HA ILE 79 HA ILE 79 106.083 -13.692 -6.760 557 HB ILE 79 HB ILE 79 103.385 -14.986 -6.273 558 HG12 ILE 79 1HG1 ILE 79 104.774 -14.459 -8.916 559 HG13 ILE 79 2HG1 ILE 79 104.747 -16.036 -8.128 560 HG21 ILE 79 1HG2 ILE 79 103.329 -12.547 -6.136 561 HG22 ILE 79 2HG2 ILE 79 102.581 -13.063 -7.645 562 HG23 ILE 79 3HG2 ILE 79 104.221 -12.416 -7.651 563 HD11 ILE 79 3HD1 ILE 79 102.426 -14.462 -9.244 564 HD12 ILE 79 1HD1 ILE 79 102.183 -15.759 -8.074 565 HD13 ILE 79 2HD1 ILE 79 102.922 -16.108 -9.635 566 H TYR 80 H TYR 80 105.530 -11.865 -5.459 567 HA TYR 80 HA TYR 80 104.341 -12.414 -2.838 568 HB2 TYR 80 1HB TYR 80 106.072 -11.338 -1.594 569 HB3 TYR 80 2HB TYR 80 106.796 -12.608 -2.558 570 HD1 TYR 80 HD1 TYR 80 108.166 -12.029 -4.558 571 HD2 TYR 80 HD2 TYR 80 106.617 -9.025 -1.907 572 HE1 TYR 80 HE1 TYR 80 109.762 -10.378 -5.495 573 HE2 TYR 80 HE2 TYR 80 108.214 -7.375 -2.842 574 HH TYR 80 HH TYR 80 109.548 -6.995 -4.762 575 H GLY 81 H GLY 81 103.510 -10.550 -1.774 576 HA2 GLY 81 1HA GLY 81 103.547 -8.038 -3.335 577 HA3 GLY 81 2HA GLY 81 101.998 -8.708 -2.824 578 H VAL 82 H VAL 82 103.292 -6.150 -2.048 579 HA VAL 82 HA VAL 82 103.571 -6.594 0.859 580 HB VAL 82 HB VAL 82 105.484 -5.018 0.880 581 HG11 VAL 82 1HG1 VAL 82 105.630 -7.609 -0.633 582 HG12 VAL 82 2HG1 VAL 82 106.229 -7.222 0.980 583 HG13 VAL 82 3HG1 VAL 82 107.080 -6.626 -0.443 584 HG21 VAL 82 3HG2 VAL 82 106.578 -4.382 -1.190 585 HG22 VAL 82 1HG2 VAL 82 104.883 -3.907 -1.294 586 HG23 VAL 82 2HG2 VAL 82 105.447 -5.351 -2.133 587 H VAL 83 H VAL 83 103.053 -4.855 2.164 588 HA VAL 83 HA VAL 83 102.292 -2.318 0.883 589 HB VAL 83 HB VAL 83 100.194 -3.557 1.286 590 HG11 VAL 83 1HG1 VAL 83 101.190 -3.638 4.146 591 HG12 VAL 83 2HG1 VAL 83 100.873 -5.018 3.095 592 HG13 VAL 83 3HG1 VAL 83 99.537 -4.018 3.663 593 HG21 VAL 83 3HG2 VAL 83 100.547 -1.350 3.332 594 HG22 VAL 83 1HG2 VAL 83 99.052 -1.825 2.528 595 HG23 VAL 83 2HG2 VAL 83 100.344 -1.060 1.604 596 H GLY 84 H GLY 84 102.546 -0.476 2.334 597 HA2 GLY 84 1HA GLY 84 103.523 -0.823 5.007 598 HA3 GLY 84 2HA GLY 84 104.840 -0.539 3.877 599 H VAL 85 H VAL 85 105.051 1.368 5.389 600 HA VAL 85 HA VAL 85 103.431 3.625 4.383 601 HB VAL 85 HB VAL 85 103.356 4.563 6.671 602 HG11 VAL 85 1HG1 VAL 85 102.185 1.799 6.265 603 HG12 VAL 85 2HG1 VAL 85 101.410 3.348 5.933 604 HG13 VAL 85 3HG1 VAL 85 101.728 2.860 7.597 605 HG21 VAL 85 3HG2 VAL 85 103.986 3.202 8.582 606 HG22 VAL 85 1HG2 VAL 85 105.372 3.298 7.496 607 HG23 VAL 85 2HG2 VAL 85 104.381 1.840 7.534 608 H GLY 86 H GLY 86 104.523 5.573 4.249 609 HA2 GLY 86 1HA GLY 86 107.433 5.490 4.818 610 HA3 GLY 86 2HA GLY 86 106.790 6.143 3.313 611 H TYR 87 H TYR 87 108.337 7.348 5.601 612 HA TYR 87 HA TYR 87 106.500 9.596 6.199 613 HB2 TYR 87 1HB TYR 87 108.845 8.631 7.841 614 HB3 TYR 87 2HB TYR 87 107.771 9.959 8.240 615 HD1 TYR 87 HD1 TYR 87 105.351 9.471 8.774 616 HD2 TYR 87 HD2 TYR 87 108.302 6.379 8.349 617 HE1 TYR 87 HE1 TYR 87 103.861 7.884 9.965 618 HE2 TYR 87 HE2 TYR 87 106.814 4.793 9.539 619 HH TYR 87 HH TYR 87 104.362 5.626 11.411 620 H GLY 88 H GLY 88 107.209 11.615 5.773 621 HA2 GLY 88 1HA GLY 88 109.891 11.915 4.557 622 HA3 GLY 88 2HA GLY 88 108.482 12.875 4.109 623 H LYS 89 H LYS 89 111.283 13.229 5.532 624 HA LYS 89 HA LYS 89 110.312 14.948 7.746 625 HB2 LYS 89 1HB LYS 89 112.969 13.505 7.560 626 HB3 LYS 89 2HB LYS 89 112.391 14.467 8.915 627 HG2 LYS 89 1HG LYS 89 111.031 11.957 7.894 628 HG3 LYS 89 2HG LYS 89 112.122 12.008 9.279 629 HD2 LYS 89 1HD LYS 89 110.601 13.715 10.326 630 HD3 LYS 89 2HD LYS 89 109.474 13.455 8.999 631 HE2 LYS 89 1HE LYS 89 108.744 11.477 9.850 632 HE3 LYS 89 2HE LYS 89 110.358 10.962 10.335 633 HZ1 LYS 89 3HZ LYS 89 110.245 12.326 12.261 634 HZ2 LYS 89 1HZ LYS 89 108.826 11.398 12.208 635 HZ3 LYS 89 2HZ LYS 89 108.786 13.035 11.757 636 H PHE 90 H PHE 90 111.097 17.009 7.842 637 HA PHE 90 HA PHE 90 112.978 17.852 5.716 638 HB2 PHE 90 1HB PHE 90 110.914 19.450 7.236 639 HB3 PHE 90 2HB PHE 90 112.022 20.107 6.047 640 HD1 PHE 90 HD1 PHE 90 109.016 18.065 6.592 641 HD2 PHE 90 HD2 PHE 90 111.718 19.664 3.661 642 HE1 PHE 90 HE1 PHE 90 107.390 17.524 4.799 643 HE2 PHE 90 HE2 PHE 90 110.092 19.123 1.868 644 HZ PHE 90 HZ PHE 90 107.929 18.053 2.437 645 H GLN 91 H GLN 91 114.842 18.904 6.280 646 HA GLN 91 HA GLN 91 115.472 18.930 9.153 647 HB2 GLN 91 1HB GLN 91 117.244 19.082 6.706 648 HB3 GLN 91 2HB GLN 91 117.829 19.136 8.369 649 HG2 GLN 91 1HG GLN 91 116.880 16.928 8.812 650 HG3 GLN 91 2HG GLN 91 116.194 16.872 7.191 651 HE21 GLN 91 1HE2 GLN 91 118.033 14.878 8.100 652 HE22 GLN 91 2HE2 GLN 91 119.470 15.030 7.209 653 H THR 92 H THR 92 115.339 20.773 10.215 654 HA THR 92 HA THR 92 116.345 23.227 8.981 655 HB THR 92 HB THR 92 113.918 23.245 8.559 656 HG1 THR 92 HG1 THR 92 114.374 25.266 8.830 657 HG21 THR 92 3HG2 THR 92 113.685 23.120 11.580 658 HG22 THR 92 1HG2 THR 92 113.209 21.845 10.457 659 HG23 THR 92 2HG2 THR 92 112.351 23.385 10.457 660 H THR 93 H THR 93 116.644 24.977 10.639 661 HA THR 93 HA THR 93 117.401 23.796 13.229 662 HB THR 93 HB THR 93 118.660 25.898 13.563 663 HG1 THR 93 HG1 THR 93 117.488 27.351 12.412 664 HG21 THR 93 3HG2 THR 93 119.197 24.689 10.837 665 HG22 THR 93 1HG2 THR 93 119.657 23.931 12.361 666 HG23 THR 93 2HG2 THR 93 120.367 25.477 11.896 667 H GLU 94 H GLU 94 116.243 24.175 15.006 668 HA GLU 94 HA GLU 94 114.691 26.426 15.629 669 HB2 GLU 94 1HB GLU 94 113.391 25.645 13.601 670 HB3 GLU 94 2HB GLU 94 113.027 24.168 14.487 671 HG2 GLU 94 1HG GLU 94 111.986 25.528 16.284 672 HG3 GLU 94 2HG GLU 94 112.307 26.982 15.350 673 H TYR 95 H TYR 95 113.703 26.192 17.674 674 HA TYR 95 HA TYR 95 114.453 23.833 19.181 675 HB2 TYR 95 1HB TYR 95 112.886 26.316 19.894 676 HB3 TYR 95 2HB TYR 95 113.195 25.015 21.028 677 HD1 TYR 95 HD1 TYR 95 115.611 24.446 21.604 678 HD2 TYR 95 HD2 TYR 95 114.484 28.001 19.472 679 HE1 TYR 95 HE1 TYR 95 117.795 25.478 22.168 680 HE2 TYR 95 HE2 TYR 95 116.667 29.033 20.037 681 HH TYR 95 HH TYR 95 118.798 27.665 22.361 682 HA PRO 96 HA PRO 96 111.110 21.458 18.020 683 HB2 PRO 96 1HB PRO 96 110.427 20.018 20.281 684 HB3 PRO 96 2HB PRO 96 111.825 19.672 19.248 685 HG2 PRO 96 1HG PRO 96 111.707 21.116 21.840 686 HG3 PRO 96 2HG PRO 96 112.933 19.994 21.222 687 HD2 PRO 96 1HD PRO 96 113.318 22.681 21.226 688 HD3 PRO 96 2HD PRO 96 114.006 21.625 19.972 689 H THR 97 H THR 97 109.057 21.817 17.605 690 HA THR 97 HA THR 97 107.288 22.928 19.700 691 HB THR 97 HB THR 97 107.020 23.230 16.697 692 HG1 THR 97 HG1 THR 97 107.989 24.942 18.728 693 HG21 THR 97 3HG2 THR 97 105.480 24.310 19.066 694 HG22 THR 97 1HG2 THR 97 104.865 23.325 17.739 695 HG23 THR 97 2HG2 THR 97 105.351 24.995 17.446 696 H TYR 98 H TYR 98 105.078 22.093 19.696 697 HA TYR 98 HA TYR 98 104.916 19.363 18.600 698 HB2 TYR 98 1HB TYR 98 103.112 20.829 20.532 699 HB3 TYR 98 2HB TYR 98 102.912 19.163 20.024 700 HD1 TYR 98 HD1 TYR 98 104.674 17.463 20.648 701 HD2 TYR 98 HD2 TYR 98 104.616 21.442 22.264 702 HE1 TYR 98 HE1 TYR 98 106.170 16.737 22.488 703 HE2 TYR 98 HE2 TYR 98 106.111 20.717 24.104 704 HH TYR 98 HH TYR 98 107.786 17.767 24.055 705 H LYS 99 H LYS 99 103.908 19.032 16.750 706 HA LYS 99 HA LYS 99 101.928 21.019 15.799 707 HB2 LYS 99 1HB LYS 99 103.779 19.211 14.230 708 HB3 LYS 99 2HB LYS 99 102.544 20.251 13.519 709 HG2 LYS 99 1HG LYS 99 103.634 22.219 14.598 710 HG3 LYS 99 2HG LYS 99 104.914 21.154 15.181 711 HD2 LYS 99 1HD LYS 99 105.390 20.499 12.818 712 HD3 LYS 99 2HD LYS 99 104.196 21.684 12.284 713 HE2 LYS 99 1HE LYS 99 105.472 23.506 13.180 714 HE3 LYS 99 2HE LYS 99 106.554 22.408 14.036 715 HZ1 LYS 99 3HZ LYS 99 107.622 21.811 12.120 716 HZ2 LYS 99 1HZ LYS 99 107.245 23.426 11.760 717 HZ3 LYS 99 2HZ LYS 99 106.294 22.171 11.122 718 H HIS 100 H HIS 100 100.062 20.252 14.720 719 HA HIS 100 HA HIS 100 98.856 17.892 15.628 720 HB2 HIS 100 1HB HIS 100 98.334 19.388 13.054 721 HB3 HIS 100 2HB HIS 100 97.259 18.215 13.789 722 HD1 HIS 100 HD1 HIS 100 96.500 18.945 16.368 723 HD2 HIS 100 HD2 HIS 100 97.780 21.972 13.802 724 HE1 HIS 100 HE1 HIS 100 95.640 21.119 17.340 725 H ASP 101 H ASP 101 100.714 18.548 12.681 726 HA ASP 101 HA ASP 101 101.290 15.681 12.458 727 HB2 ASP 101 1HB ASP 101 99.374 16.137 10.944 728 HB3 ASP 101 2HB ASP 101 100.343 17.361 10.123 729 H THR 102 H THR 102 103.345 16.360 13.277 730 HA THR 102 HA THR 102 104.920 18.414 12.179 731 HB THR 102 HB THR 102 105.897 15.884 13.520 732 HG1 THR 102 HG1 THR 102 105.054 16.672 15.253 733 HG21 THR 102 3HG2 THR 102 107.608 17.324 12.393 734 HG22 THR 102 1HG2 THR 102 107.811 17.244 14.143 735 HG23 THR 102 2HG2 THR 102 107.083 18.671 13.404 736 H SER 103 H SER 103 104.649 14.988 11.347 737 HA SER 103 HA SER 103 106.492 15.440 9.067 738 HB2 SER 103 1HB SER 103 106.008 12.881 10.609 739 HB3 SER 103 2HB SER 103 107.095 13.073 9.238 740 HG SER 103 HG SER 103 107.295 14.030 11.865 741 H ASP 104 H ASP 104 106.031 14.279 7.119 742 HA ASP 104 HA ASP 104 103.126 13.972 6.728 743 HB2 ASP 104 1HB ASP 104 105.389 14.234 4.732 744 HB3 ASP 104 2HB ASP 104 103.686 14.079 4.311 745 H TYR 105 H TYR 105 102.223 12.074 5.868 746 HA TYR 105 HA TYR 105 104.050 9.780 5.527 747 HB2 TYR 105 1HB TYR 105 102.712 8.371 6.910 748 HB3 TYR 105 2HB TYR 105 103.142 9.794 7.835 749 HD1 TYR 105 HD1 TYR 105 100.423 7.936 6.205 750 HD2 TYR 105 HD2 TYR 105 101.440 11.435 8.479 751 HE1 TYR 105 HE1 TYR 105 98.023 8.309 6.705 752 HE2 TYR 105 HE2 TYR 105 99.040 11.808 8.979 753 HH TYR 105 HH TYR 105 96.732 9.556 8.690 754 H GLY 106 H GLY 106 103.271 8.085 4.258 755 HA2 GLY 106 1HA GLY 106 100.655 8.335 2.978 756 HA3 GLY 106 2HA GLY 106 102.056 8.441 1.918 757 H PHE 107 H PHE 107 100.572 6.470 1.206 758 HA PHE 107 HA PHE 107 101.435 4.019 2.647 759 HB2 PHE 107 1HB PHE 107 98.927 4.505 1.039 760 HB3 PHE 107 2HB PHE 107 99.397 2.962 1.726 761 HD1 PHE 107 HD1 PHE 107 99.435 2.656 4.201 762 HD2 PHE 107 HD2 PHE 107 97.950 6.244 2.366 763 HE1 PHE 107 HE1 PHE 107 98.310 3.273 6.322 764 HE2 PHE 107 HE2 PHE 107 96.825 6.863 4.488 765 HZ PHE 107 HZ PHE 107 97.004 5.378 6.466 766 H SER 108 H SER 108 102.152 2.236 1.421 767 HA SER 108 HA SER 108 102.442 2.686 -1.490 768 HB2 SER 108 1HB SER 108 104.735 1.896 -1.417 769 HB3 SER 108 2HB SER 108 104.563 3.268 -0.327 770 HG SER 108 HG SER 108 105.628 1.153 0.389 771 H TYR 109 H TYR 109 102.451 0.840 -2.763 772 HA TYR 109 HA TYR 109 102.290 -1.793 -1.504 773 HB2 TYR 109 1HB TYR 109 99.963 -0.968 -1.541 774 HB3 TYR 109 2HB TYR 109 100.093 -0.698 -3.267 775 HD1 TYR 109 HD1 TYR 109 99.871 -3.236 -0.604 776 HD2 TYR 109 HD2 TYR 109 100.005 -2.547 -4.840 777 HE1 TYR 109 HE1 TYR 109 99.144 -5.574 -1.006 778 HE2 TYR 109 HE2 TYR 109 99.278 -4.883 -5.244 779 HH TYR 109 HH TYR 109 97.910 -6.652 -3.822 780 H GLY 110 H GLY 110 102.684 -3.523 -2.998 781 HA2 GLY 110 1HA GLY 110 102.796 -3.164 -5.811 782 HA3 GLY 110 2HA GLY 110 104.413 -2.986 -5.140 783 H ALA 111 H ALA 111 104.364 -4.943 -6.798 784 HA ALA 111 HA ALA 111 104.463 -7.351 -5.126 785 HB1 ALA 111 1HB ALA 111 102.835 -7.038 -7.641 786 HB2 ALA 111 2HB ALA 111 102.346 -7.720 -6.090 787 HB3 ALA 111 3HB ALA 111 103.448 -8.613 -7.138 788 H GLY 112 H GLY 112 105.805 -9.063 -6.112 789 HA2 GLY 112 1HA GLY 112 107.561 -8.144 -8.275 790 HA3 GLY 112 2HA GLY 112 108.303 -8.430 -6.706 791 H LEU 113 H LEU 113 109.141 -9.808 -8.913 792 HA LEU 113 HA LEU 113 108.174 -12.557 -8.393 793 HB2 LEU 113 1HB LEU 113 109.201 -11.487 -11.036 794 HB3 LEU 113 2HB LEU 113 108.593 -13.110 -10.723 795 HG LEU 113 HG LEU 113 106.963 -10.564 -10.470 796 HD11 LEU 113 1HD1 LEU 113 105.765 -11.571 -12.471 797 HD12 LEU 113 2HD1 LEU 113 107.109 -12.705 -12.607 798 HD13 LEU 113 3HD1 LEU 113 107.391 -10.974 -12.800 799 HD21 LEU 113 3HD2 LEU 113 106.343 -13.500 -10.100 800 HD22 LEU 113 1HD2 LEU 113 105.078 -12.318 -10.439 801 HD23 LEU 113 2HD2 LEU 113 106.049 -12.176 -8.974 802 H GLN 114 H GLN 114 109.761 -14.104 -8.134 803 HA GLN 114 HA GLN 114 112.568 -13.148 -8.195 804 HB2 GLN 114 1HB GLN 114 111.666 -13.615 -5.913 805 HB3 GLN 114 2HB GLN 114 111.385 -15.285 -6.408 806 HG2 GLN 114 1HG GLN 114 113.772 -15.570 -6.891 807 HG3 GLN 114 2HG GLN 114 114.074 -13.890 -6.460 808 HE21 GLN 114 1HE2 GLN 114 115.513 -15.733 -5.030 809 HE22 GLN 114 2HE2 GLN 114 114.894 -15.900 -3.457 810 H PHE 115 H PHE 115 114.008 -14.296 -9.364 811 HA PHE 115 HA PHE 115 113.145 -16.923 -10.446 812 HB2 PHE 115 1HB PHE 115 114.812 -14.793 -11.794 813 HB3 PHE 115 2HB PHE 115 114.473 -16.383 -12.453 814 HD1 PHE 115 HD1 PHE 115 113.113 -13.050 -11.709 815 HD2 PHE 115 HD2 PHE 115 112.255 -16.936 -13.328 816 HE1 PHE 115 HE1 PHE 115 111.034 -12.165 -12.731 817 HE2 PHE 115 HE2 PHE 115 110.176 -16.051 -14.351 818 HZ PHE 115 HZ PHE 115 109.566 -13.665 -14.053 819 H ASN 116 H ASN 116 114.579 -18.572 -10.285 820 HA ASN 116 HA ASN 116 117.262 -17.970 -9.185 821 HB2 ASN 116 1HB ASN 116 115.277 -20.064 -8.293 822 HB3 ASN 116 2HB ASN 116 116.986 -20.118 -7.868 823 HD21 ASN 116 1HD2 ASN 116 114.103 -17.981 -7.627 824 HD22 ASN 116 2HD2 ASN 116 114.615 -17.205 -6.207 825 HA PRO 117 HA PRO 117 117.718 -20.688 -12.897 826 HB2 PRO 117 1HB PRO 117 120.055 -19.596 -13.799 827 HB3 PRO 117 2HB PRO 117 118.458 -18.949 -14.218 828 HG2 PRO 117 1HG PRO 117 120.416 -17.986 -12.201 829 HG3 PRO 117 2HG PRO 117 119.367 -17.063 -13.292 830 HD2 PRO 117 1HD PRO 117 118.790 -17.443 -10.644 831 HD3 PRO 117 2HD PRO 117 117.544 -17.203 -11.888 832 H MET 118 H MET 118 120.169 -21.604 -13.615 833 HA MET 118 HA MET 118 120.846 -23.466 -11.642 834 HB2 MET 118 1HB MET 118 122.546 -22.419 -13.921 835 HB3 MET 118 2HB MET 118 122.869 -23.889 -13.009 836 HG2 MET 118 1HG MET 118 120.390 -23.348 -14.671 837 HG3 MET 118 2HG MET 118 121.725 -24.399 -15.133 838 HE1 MET 118 3HE MET 118 121.707 -27.367 -13.213 839 HE2 MET 118 1HE MET 118 122.155 -26.154 -12.007 840 HE3 MET 118 2HE MET 118 122.683 -25.975 -13.677 841 H GLU 119 H GLU 119 122.214 -20.278 -12.325 842 HA GLU 119 HA GLU 119 124.477 -20.376 -10.693 843 HB2 GLU 119 1HB GLU 119 122.647 -18.035 -11.271 844 HB3 GLU 119 2HB GLU 119 124.263 -17.910 -10.576 845 HG2 GLU 119 1HG GLU 119 125.185 -19.045 -12.590 846 HG3 GLU 119 2HG GLU 119 123.573 -19.065 -13.292 847 H ASN 120 H ASN 120 124.842 -19.551 -8.564 848 HA ASN 120 HA ASN 120 122.791 -20.379 -6.704 849 HB2 ASN 120 1HB ASN 120 125.298 -20.779 -6.470 850 HB3 ASN 120 2HB ASN 120 125.416 -19.084 -5.999 851 HD21 ASN 120 1HD2 ASN 120 126.092 -19.836 -3.810 852 HD22 ASN 120 2HD2 ASN 120 124.923 -20.401 -2.717 853 H VAL 121 H VAL 121 122.772 -17.646 -8.358 854 HA VAL 121 HA VAL 121 121.994 -15.978 -6.036 855 HB VAL 121 HB VAL 121 124.044 -15.148 -7.123 856 HG11 VAL 121 1HG1 VAL 121 122.390 -14.631 -9.593 857 HG12 VAL 121 2HG1 VAL 121 123.338 -16.106 -9.410 858 HG13 VAL 121 3HG1 VAL 121 124.141 -14.536 -9.405 859 HG21 VAL 121 3HG2 VAL 121 122.519 -13.515 -6.136 860 HG22 VAL 121 1HG2 VAL 121 121.564 -13.472 -7.617 861 HG23 VAL 121 2HG2 VAL 121 123.213 -12.846 -7.613 862 H ALA 122 H ALA 122 120.106 -14.822 -6.191 863 HA ALA 122 HA ALA 122 118.341 -15.532 -8.465 864 HB1 ALA 122 1HB ALA 122 117.220 -14.691 -5.830 865 HB2 ALA 122 2HB ALA 122 117.906 -16.309 -5.957 866 HB3 ALA 122 3HB ALA 122 116.580 -15.829 -7.016 867 H LEU 123 H LEU 123 116.847 -13.948 -9.172 868 HA LEU 123 HA LEU 123 117.739 -11.169 -8.642 869 HB2 LEU 123 1HB LEU 123 118.263 -12.131 -10.918 870 HB3 LEU 123 2HB LEU 123 116.529 -12.230 -11.204 871 HG LEU 123 HG LEU 123 117.636 -9.610 -10.254 872 HD11 LEU 123 1HD1 LEU 123 118.003 -9.025 -12.718 873 HD12 LEU 123 2HD1 LEU 123 118.012 -10.762 -13.025 874 HD13 LEU 123 3HD1 LEU 123 119.232 -10.046 -11.972 875 HD21 LEU 123 3HD2 LEU 123 115.345 -10.622 -11.914 876 HD22 LEU 123 1HD2 LEU 123 115.885 -8.958 -12.131 877 HD23 LEU 123 2HD2 LEU 123 115.323 -9.502 -10.554 878 H ASP 124 H ASP 124 116.194 -9.684 -8.109 879 HA ASP 124 HA ASP 124 113.373 -10.612 -8.117 880 HB2 ASP 124 1HB ASP 124 113.058 -9.273 -6.071 881 HB3 ASP 124 2HB ASP 124 114.259 -10.541 -5.836 882 H PHE 125 H PHE 125 111.982 -9.354 -9.177 883 HA PHE 125 HA PHE 125 112.689 -6.520 -9.658 884 HB2 PHE 125 1HB PHE 125 113.098 -7.967 -11.678 885 HB3 PHE 125 2HB PHE 125 111.388 -8.354 -11.675 886 HD1 PHE 125 HD1 PHE 125 109.719 -6.679 -12.321 887 HD2 PHE 125 HD2 PHE 125 113.916 -5.768 -12.319 888 HE1 PHE 125 HE1 PHE 125 109.279 -4.642 -13.665 889 HE2 PHE 125 HE2 PHE 125 113.476 -3.731 -13.663 890 HZ PHE 125 HZ PHE 125 111.156 -3.170 -14.337 891 H SER 126 H SER 126 111.039 -5.136 -9.171 892 HA SER 126 HA SER 126 108.320 -6.220 -8.916 893 HB2 SER 126 1HB SER 126 109.263 -6.562 -6.716 894 HB3 SER 126 2HB SER 126 109.866 -4.910 -6.674 895 HG SER 126 HG SER 126 107.557 -5.746 -5.834 896 H TYR 127 H TYR 127 106.669 -4.656 -8.818 897 HA TYR 127 HA TYR 127 107.464 -1.955 -9.734 898 HB2 TYR 127 1HB TYR 127 104.776 -3.318 -9.967 899 HB3 TYR 127 2HB TYR 127 105.233 -1.780 -10.669 900 HD1 TYR 127 HD1 TYR 127 106.708 -1.686 -12.642 901 HD2 TYR 127 HD2 TYR 127 105.456 -5.425 -10.938 902 HE1 TYR 127 HE1 TYR 127 107.417 -2.866 -14.705 903 HE2 TYR 127 HE2 TYR 127 106.167 -6.603 -13.000 904 HH TYR 127 HH TYR 127 106.581 -5.286 -15.817 905 H GLU 128 H GLU 128 106.997 -0.241 -8.438 906 HA GLU 128 HA GLU 128 105.191 -0.697 -6.128 907 HB2 GLU 128 1HB GLU 128 107.812 0.809 -6.150 908 HB3 GLU 128 2HB GLU 128 106.692 0.742 -4.790 909 HG2 GLU 128 1HG GLU 128 108.251 -0.945 -4.292 910 HG3 GLU 128 2HG GLU 128 106.903 -1.826 -5.001 911 H GLN 129 H GLN 129 103.722 0.829 -5.732 912 HA GLN 129 HA GLN 129 104.096 3.521 -6.887 913 HB2 GLN 129 1HB GLN 129 101.532 1.902 -6.872 914 HB3 GLN 129 2HB GLN 129 101.645 3.605 -7.320 915 HG2 GLN 129 1HG GLN 129 103.165 3.054 -9.154 916 HG3 GLN 129 2HG GLN 129 103.155 1.357 -8.683 917 HE21 GLN 129 1HE2 GLN 129 102.319 2.186 -11.293 918 HE22 GLN 129 2HE2 GLN 129 100.654 1.890 -11.439 919 H SER 130 H SER 130 103.486 5.197 -5.499 920 HA SER 130 HA SER 130 102.163 4.465 -2.980 921 HB2 SER 130 1HB SER 130 104.593 4.252 -2.572 922 HB3 SER 130 2HB SER 130 104.812 5.919 -3.090 923 HG SER 130 HG SER 130 103.544 4.878 -0.806 924 H ARG 131 H ARG 131 101.124 6.123 -1.943 925 HA ARG 131 HA ARG 131 100.918 8.675 -3.431 926 HB2 ARG 131 1HB ARG 131 98.818 7.326 -3.290 927 HB3 ARG 131 2HB ARG 131 98.904 7.442 -1.532 928 HG2 ARG 131 1HG ARG 131 98.865 9.920 -1.715 929 HG3 ARG 131 2HG ARG 131 98.698 9.770 -3.464 930 HD2 ARG 131 1HD ARG 131 96.609 8.450 -3.109 931 HD3 ARG 131 2HD ARG 131 96.757 8.742 -1.377 932 HE ARG 131 HE ARG 131 96.736 11.109 -3.084 933 HH11 ARG 131 1HH1 ARG 131 94.856 8.976 -1.023 934 HH12 ARG 131 2HH1 ARG 131 93.607 10.150 -0.781 935 HH21 ARG 131 1HH2 ARG 131 95.097 12.578 -2.733 936 HH22 ARG 131 2HH2 ARG 131 93.743 12.164 -1.736 937 H ILE 132 H ILE 132 101.650 10.432 -2.441 938 HA ILE 132 HA ILE 132 102.100 10.380 0.478 939 HB ILE 132 HB ILE 132 104.017 11.523 -1.575 940 HG12 ILE 132 1HG1 ILE 132 104.110 9.094 -1.704 941 HG13 ILE 132 2HG1 ILE 132 105.552 9.694 -0.896 942 HG21 ILE 132 1HG2 ILE 132 103.944 12.655 0.636 943 HG22 ILE 132 2HG2 ILE 132 105.495 11.877 0.321 944 HG23 ILE 132 3HG2 ILE 132 104.332 11.117 1.409 945 HD11 ILE 132 3HD1 ILE 132 105.066 8.122 0.668 946 HD12 ILE 132 1HD1 ILE 132 103.393 7.976 0.135 947 HD13 ILE 132 2HD1 ILE 132 103.857 9.271 1.236 948 H ARG 133 H ARG 133 100.473 11.766 0.972 949 HA ARG 133 HA ARG 133 98.680 13.148 0.260 950 HB2 ARG 133 1HB ARG 133 100.971 14.884 1.175 951 HB3 ARG 133 2HB ARG 133 99.283 15.394 1.117 952 HG2 ARG 133 1HG ARG 133 98.695 13.496 2.624 953 HG3 ARG 133 2HG ARG 133 100.409 13.096 2.745 954 HD2 ARG 133 1HD ARG 133 100.816 15.439 3.575 955 HD3 ARG 133 2HD ARG 133 99.070 15.663 3.632 956 HE ARG 133 HE ARG 133 100.686 14.053 5.437 957 HH11 ARG 133 1HH1 ARG 133 97.440 14.737 4.285 958 HH12 ARG 133 2HH1 ARG 133 96.692 14.071 5.699 959 HH21 ARG 133 1HH2 ARG 133 99.666 13.211 7.231 960 HH22 ARG 133 2HH2 ARG 133 97.936 13.218 7.344 961 H SER 134 H SER 134 98.398 12.990 -1.994 962 HA SER 134 HA SER 134 97.692 14.171 -3.824 963 HB2 SER 134 1HB SER 134 97.794 16.476 -3.963 964 HB3 SER 134 2HB SER 134 97.871 16.207 -2.228 965 HG SER 134 HG SER 134 99.878 16.897 -2.220 966 H VAL 135 H VAL 135 100.984 13.535 -3.101 967 HA VAL 135 HA VAL 135 101.758 14.070 -5.899 968 HB VAL 135 HB VAL 135 103.500 13.346 -3.526 969 HG11 VAL 135 1HG1 VAL 135 104.174 14.344 -6.312 970 HG12 VAL 135 2HG1 VAL 135 104.452 12.709 -5.709 971 HG13 VAL 135 3HG1 VAL 135 105.337 14.067 -5.015 972 HG21 VAL 135 3HG2 VAL 135 104.184 15.730 -3.614 973 HG22 VAL 135 1HG2 VAL 135 102.468 15.563 -3.245 974 HG23 VAL 135 2HG2 VAL 135 102.980 16.018 -4.870 975 H ASP 136 H ASP 136 102.162 12.431 -7.276 976 HA ASP 136 HA ASP 136 101.753 9.681 -6.250 977 HB2 ASP 136 1HB ASP 136 101.467 10.804 -9.048 978 HB3 ASP 136 2HB ASP 136 101.231 9.114 -8.609 979 H VAL 137 H VAL 137 103.530 8.408 -6.104 980 HA VAL 137 HA VAL 137 105.876 9.124 -7.778 981 HB VAL 137 HB VAL 137 106.182 9.783 -5.425 982 HG11 VAL 137 1HG1 VAL 137 104.682 8.064 -4.437 983 HG12 VAL 137 2HG1 VAL 137 106.268 8.093 -3.666 984 HG13 VAL 137 3HG1 VAL 137 105.877 6.828 -4.830 985 HG21 VAL 137 3HG2 VAL 137 107.842 7.358 -6.174 986 HG22 VAL 137 1HG2 VAL 137 108.321 8.661 -5.086 987 HG23 VAL 137 2HG2 VAL 137 108.102 8.985 -6.805 988 H GLY 138 H GLY 138 106.898 7.521 -8.823 989 HA2 GLY 138 1HA GLY 138 106.000 4.739 -8.342 990 HA3 GLY 138 2HA GLY 138 106.310 5.376 -9.957 991 H THR 139 H THR 139 107.623 3.287 -7.981 992 HA THR 139 HA THR 139 110.385 4.085 -8.696 993 HB THR 139 HB THR 139 111.199 3.130 -6.607 994 HG1 THR 139 HG1 THR 139 108.547 2.917 -5.716 995 HG21 THR 139 3HG2 THR 139 110.418 4.842 -5.098 996 HG22 THR 139 1HG2 THR 139 108.922 5.036 -6.012 997 HG23 THR 139 2HG2 THR 139 110.458 5.538 -6.719 998 H TRP 140 H TRP 140 111.697 2.493 -9.452 999 HA TRP 140 HA TRP 140 110.486 -0.186 -9.825 1000 HB2 TRP 140 1HB TRP 140 112.660 1.199 -11.409 1001 HB3 TRP 140 2HB TRP 140 112.037 -0.410 -11.723 1002 HD1 TRP 140 HD1 TRP 140 110.643 3.194 -11.477 1003 HE1 TRP 140 HE1 TRP 140 108.838 3.476 -13.294 1004 HE3 TRP 140 HE3 TRP 140 110.645 -1.513 -13.452 1005 HZ2 TRP 140 HZ2 TRP 140 107.562 1.908 -15.325 1006 HZ3 TRP 140 HZ3 TRP 140 109.132 -2.091 -15.323 1007 HH2 TRP 140 HH2 TRP 140 107.592 -0.392 -16.263 1008 H ILE 141 H ILE 141 111.458 -1.857 -8.796 1009 HA ILE 141 HA ILE 141 114.097 -1.335 -7.538 1010 HB ILE 141 HB ILE 141 111.865 -3.108 -6.512 1011 HG12 ILE 141 1HG1 ILE 141 112.828 -0.435 -5.449 1012 HG13 ILE 141 2HG1 ILE 141 111.374 -0.635 -6.429 1013 HG21 ILE 141 1HG2 ILE 141 114.193 -3.779 -5.886 1014 HG22 ILE 141 2HG2 ILE 141 113.232 -3.266 -4.499 1015 HG23 ILE 141 3HG2 ILE 141 114.433 -2.176 -5.192 1016 HD11 ILE 141 3HD1 ILE 141 110.716 -2.432 -4.656 1017 HD12 ILE 141 1HD1 ILE 141 110.532 -0.727 -4.240 1018 HD13 ILE 141 2HD1 ILE 141 111.921 -1.635 -3.642 1019 H ALA 142 H ALA 142 115.698 -2.568 -8.246 1020 HA ALA 142 HA ALA 142 115.119 -5.400 -8.863 1021 HB1 ALA 142 1HB ALA 142 115.343 -4.382 -11.031 1022 HB2 ALA 142 2HB ALA 142 116.846 -5.242 -10.698 1023 HB3 ALA 142 3HB ALA 142 116.776 -3.488 -10.522 1024 H GLY 143 H GLY 143 116.598 -6.823 -8.015 1025 HA2 GLY 143 1HA GLY 143 119.233 -5.926 -7.196 1026 HA3 GLY 143 2HA GLY 143 118.137 -6.229 -5.855 1027 H VAL 144 H VAL 144 120.100 -7.762 -5.557 1028 HA VAL 144 HA VAL 144 119.370 -10.392 -6.670 1029 HB VAL 144 HB VAL 144 121.768 -10.944 -6.940 1030 HG11 VAL 144 1HG1 VAL 144 120.622 -10.240 -8.926 1031 HG12 VAL 144 2HG1 VAL 144 122.164 -9.386 -8.914 1032 HG13 VAL 144 3HG1 VAL 144 120.688 -8.546 -8.440 1033 HG21 VAL 144 3HG2 VAL 144 122.772 -9.405 -5.365 1034 HG22 VAL 144 1HG2 VAL 144 122.107 -8.015 -6.224 1035 HG23 VAL 144 2HG2 VAL 144 123.373 -8.990 -6.971 1036 H GLY 145 H GLY 145 119.881 -12.160 -5.306 1037 HA2 GLY 145 1HA GLY 145 120.882 -11.510 -2.617 1038 HA3 GLY 145 2HA GLY 145 119.271 -12.197 -2.763 1039 H TYR 146 H TYR 146 121.057 -13.494 -1.255 1040 HA TYR 146 HA TYR 146 121.585 -15.935 -2.814 1041 HB2 TYR 146 1HB TYR 146 123.699 -16.267 -1.720 1042 HB3 TYR 146 2HB TYR 146 123.707 -14.694 -2.490 1043 HD1 TYR 146 HD1 TYR 146 123.523 -12.627 -1.110 1044 HD2 TYR 146 HD2 TYR 146 123.890 -16.525 0.656 1045 HE1 TYR 146 HE1 TYR 146 124.156 -11.588 1.051 1046 HE2 TYR 146 HE2 TYR 146 124.522 -15.486 2.817 1047 HH TYR 146 HH TYR 146 124.015 -12.314 3.550 1048 H ARG 147 H ARG 147 121.193 -17.850 -1.702 1049 HA ARG 147 HA ARG 147 119.797 -17.509 0.887 1050 HB2 ARG 147 1HB ARG 147 118.612 -19.592 0.316 1051 HB3 ARG 147 2HB ARG 147 118.363 -18.345 -0.905 1052 HG2 ARG 147 1HG ARG 147 120.128 -19.362 -2.304 1053 HG3 ARG 147 2HG ARG 147 120.363 -20.618 -1.088 1054 HD2 ARG 147 1HD ARG 147 118.911 -21.541 -2.763 1055 HD3 ARG 147 2HD ARG 147 117.915 -21.196 -1.351 1056 HE ARG 147 HE ARG 147 118.051 -19.096 -3.372 1057 HH11 ARG 147 1HH1 ARG 147 116.233 -21.821 -2.107 1058 HH12 ARG 147 2HH1 ARG 147 114.759 -21.315 -2.862 1059 HH21 ARG 147 1HH2 ARG 147 116.122 -18.496 -4.319 1060 HH22 ARG 147 2HH2 ARG 147 114.698 -19.456 -4.098 1061 H PHE 148 H PHE 148 120.284 -18.789 2.604 1062 HA PHE 148 HA PHE 148 122.295 -20.900 2.321 1063 HB2 PHE 148 1HB PHE 148 123.550 -18.813 2.762 1064 HB3 PHE 148 2HB PHE 148 122.611 -18.575 4.223 1065 HD1 PHE 148 HD1 PHE 148 125.189 -20.654 2.582 1066 HD2 PHE 148 HD2 PHE 148 123.074 -19.837 6.230 1067 HE1 PHE 148 HE1 PHE 148 126.826 -22.029 3.838 1068 HE2 PHE 148 HE2 PHE 148 124.711 -21.214 7.487 1069 HZ PHE 148 HZ PHE 148 126.586 -22.310 6.290 Start of MODEL 8 1 H1 ALA 1 3H ALA 1 115.587 -25.084 9.258 2 H2 ALA 1 2H ALA 1 117.019 -24.177 9.129 3 H3 ALA 1 HT3 ALA 1 116.608 -25.298 7.920 4 HA ALA 1 HA ALA 1 114.630 -23.972 7.379 5 HB1 ALA 1 2HB ALA 1 115.901 -21.994 9.296 6 HB2 ALA 1 3HB ALA 1 114.436 -22.920 9.627 7 HB3 ALA 1 1HB ALA 1 114.451 -21.722 8.332 8 H THR 2 H THR 2 114.905 -21.794 6.123 9 HA THR 2 HA THR 2 117.654 -21.663 5.017 10 HB THR 2 HB THR 2 115.068 -21.376 3.468 11 HG1 THR 2 HG1 THR 2 116.935 -23.467 3.236 12 HG21 THR 2 3HG2 THR 2 117.997 -21.357 2.723 13 HG22 THR 2 1HG2 THR 2 116.789 -20.113 2.405 14 HG23 THR 2 2HG2 THR 2 116.723 -21.647 1.539 15 H SER 3 H SER 3 118.466 -19.645 4.615 16 HA SER 3 HA SER 3 116.715 -17.336 5.255 17 HB2 SER 3 1HB SER 3 118.669 -16.225 6.199 18 HB3 SER 3 2HB SER 3 118.419 -17.769 7.007 19 HG SER 3 HG SER 3 120.313 -17.064 5.022 20 H THR 4 H THR 4 116.945 -15.502 3.995 21 HA THR 4 HA THR 4 118.686 -15.731 1.612 22 HB THR 4 HB THR 4 115.845 -14.682 1.623 23 HG1 THR 4 HG1 THR 4 116.956 -17.120 0.696 24 HG21 THR 4 3HG2 THR 4 117.430 -13.690 -0.043 25 HG22 THR 4 1HG2 THR 4 116.121 -14.605 -0.790 26 HG23 THR 4 2HG2 THR 4 117.732 -15.313 -0.663 27 H VAL 5 H VAL 5 119.840 -13.946 1.152 28 HA VAL 5 HA VAL 5 119.095 -11.412 2.511 29 HB VAL 5 HB VAL 5 121.091 -12.418 3.555 30 HG11 VAL 5 1HG1 VAL 5 123.041 -12.975 2.364 31 HG12 VAL 5 2HG1 VAL 5 122.547 -12.053 0.943 32 HG13 VAL 5 3HG1 VAL 5 121.748 -13.578 1.326 33 HG21 VAL 5 3HG2 VAL 5 120.949 -9.981 3.445 34 HG22 VAL 5 1HG2 VAL 5 121.654 -9.989 1.829 35 HG23 VAL 5 2HG2 VAL 5 122.624 -10.484 3.216 36 H THR 6 H THR 6 118.897 -9.683 1.187 37 HA THR 6 HA THR 6 120.006 -9.858 -1.538 38 HB THR 6 HB THR 6 117.946 -9.308 -2.599 39 HG1 THR 6 HG1 THR 6 116.977 -7.939 -1.248 40 HG21 THR 6 3HG2 THR 6 118.280 -11.742 -1.392 41 HG22 THR 6 1HG2 THR 6 116.947 -11.346 -2.477 42 HG23 THR 6 2HG2 THR 6 116.724 -11.241 -0.732 43 H GLY 7 H GLY 7 119.869 -7.806 -2.699 44 HA2 GLY 7 1HA GLY 7 119.200 -5.417 -1.162 45 HA3 GLY 7 2HA GLY 7 120.882 -5.552 -1.681 46 H GLY 8 H GLY 8 118.808 -3.604 -2.542 47 HA2 GLY 8 1HA GLY 8 119.229 -3.946 -5.415 48 HA3 GLY 8 2HA GLY 8 117.555 -3.910 -4.879 49 H TYR 9 H TYR 9 118.378 -2.082 -6.648 50 HA TYR 9 HA TYR 9 118.506 0.435 -5.088 51 HB2 TYR 9 1HB TYR 9 120.581 -0.034 -6.397 52 HB3 TYR 9 2HB TYR 9 119.612 -0.060 -7.857 53 HD1 TYR 9 HD1 TYR 9 120.914 2.062 -5.122 54 HD2 TYR 9 HD2 TYR 9 118.843 1.982 -8.885 55 HE1 TYR 9 HE1 TYR 9 121.190 4.518 -5.326 56 HE2 TYR 9 HE2 TYR 9 119.119 4.439 -9.088 57 HH TYR 9 HH TYR 9 121.266 6.195 -7.358 58 H ALA 10 H ALA 10 117.075 2.052 -5.706 59 HA ALA 10 HA ALA 10 115.303 1.506 -7.994 60 HB1 ALA 10 1HB ALA 10 114.013 2.540 -5.520 61 HB2 ALA 10 2HB ALA 10 114.465 0.838 -5.538 62 HB3 ALA 10 3HB ALA 10 113.375 1.472 -6.771 63 H GLN 11 H GLN 11 114.542 3.291 -9.036 64 HA GLN 11 HA GLN 11 115.158 5.948 -7.877 65 HB2 GLN 11 1HB GLN 11 115.122 5.102 -10.788 66 HB3 GLN 11 2HB GLN 11 115.300 6.765 -10.226 67 HG2 GLN 11 1HG GLN 11 117.349 6.176 -9.029 68 HG3 GLN 11 2HG GLN 11 117.160 4.487 -9.492 69 HE21 GLN 11 1HE2 GLN 11 119.496 5.991 -10.204 70 HE22 GLN 11 2HE2 GLN 11 119.511 6.177 -11.891 71 H SER 12 H SER 12 113.479 7.477 -7.943 72 HA SER 12 HA SER 12 110.849 6.390 -8.798 73 HB2 SER 12 1HB SER 12 109.851 7.395 -6.820 74 HB3 SER 12 2HB SER 12 111.137 6.293 -6.338 75 HG SER 12 HG SER 12 111.056 9.103 -6.337 76 H ASP 13 H ASP 13 109.390 7.800 -9.643 77 HA ASP 13 HA ASP 13 110.295 10.584 -10.106 78 HB2 ASP 13 1HB ASP 13 110.368 9.182 -12.174 79 HB3 ASP 13 2HB ASP 13 108.645 8.867 -11.979 80 H ALA 14 H ALA 14 108.858 12.126 -9.514 81 HA ALA 14 HA ALA 14 106.241 11.196 -8.491 82 HB1 ALA 14 1HB ALA 14 106.458 13.252 -6.989 83 HB2 ALA 14 2HB ALA 14 108.153 13.296 -7.476 84 HB3 ALA 14 3HB ALA 14 107.518 11.890 -6.622 85 H GLN 15 H GLN 15 104.813 11.697 -9.982 86 HA GLN 15 HA GLN 15 104.902 14.004 -11.661 87 HB2 GLN 15 1HB GLN 15 103.642 11.906 -12.202 88 HB3 GLN 15 2HB GLN 15 102.491 12.322 -10.932 89 HG2 GLN 15 1HG GLN 15 101.525 13.162 -12.934 90 HG3 GLN 15 2HG GLN 15 102.216 14.571 -12.131 91 HE21 GLN 15 1HE2 GLN 15 103.474 15.857 -13.477 92 HE22 GLN 15 2HE2 GLN 15 104.282 15.313 -14.868 93 H GLY 16 H GLY 16 104.426 16.001 -11.171 94 HA2 GLY 16 1HA GLY 16 103.195 17.767 -10.170 95 HA3 GLY 16 2HA GLY 16 102.665 16.656 -8.915 96 H GLN 17 H GLN 17 105.672 15.766 -8.804 97 HA GLN 17 HA GLN 17 106.720 18.114 -7.338 98 HB2 GLN 17 1HB GLN 17 106.266 16.009 -5.990 99 HB3 GLN 17 2HB GLN 17 107.533 15.231 -6.934 100 HG2 GLN 17 1HG GLN 17 108.597 16.019 -4.953 101 HG3 GLN 17 2HG GLN 17 109.063 17.146 -6.222 102 HE21 GLN 17 1HE2 GLN 17 108.803 19.309 -5.660 103 HE22 GLN 17 2HE2 GLN 17 107.709 19.886 -4.498 104 H MET 18 H MET 18 108.898 18.694 -7.724 105 HA MET 18 HA MET 18 109.892 17.856 -10.336 106 HB2 MET 18 1HB MET 18 110.852 19.983 -8.408 107 HB3 MET 18 2HB MET 18 111.539 19.688 -10.005 108 HG2 MET 18 1HG MET 18 109.251 20.060 -10.983 109 HG3 MET 18 2HG MET 18 108.702 20.545 -9.378 110 HE1 MET 18 3HE MET 18 110.753 21.137 -12.417 111 HE2 MET 18 1HE MET 18 112.152 21.218 -11.339 112 HE3 MET 18 2HE MET 18 111.612 22.659 -12.195 113 H ASN 19 H ASN 19 112.123 17.279 -10.662 114 HA ASN 19 HA ASN 19 114.082 16.185 -10.256 115 HB2 ASN 19 1HB ASN 19 113.597 16.895 -7.356 116 HB3 ASN 19 2HB ASN 19 115.118 16.360 -8.063 117 HD21 ASN 19 1HD2 ASN 19 113.978 19.088 -6.887 118 HD22 ASN 19 2HD2 ASN 19 114.548 20.220 -8.016 119 H LYS 20 H LYS 20 114.740 14.134 -9.939 120 HA LYS 20 HA LYS 20 112.746 12.228 -8.961 121 HB2 LYS 20 1HB LYS 20 115.366 11.838 -10.430 122 HB3 LYS 20 2HB LYS 20 114.267 10.537 -9.974 123 HG2 LYS 20 1HG LYS 20 112.463 11.647 -11.292 124 HG3 LYS 20 2HG LYS 20 113.632 12.859 -11.819 125 HD2 LYS 20 1HD LYS 20 115.042 11.023 -12.765 126 HD3 LYS 20 2HD LYS 20 113.770 9.876 -12.343 127 HE2 LYS 20 1HE LYS 20 112.188 11.358 -13.710 128 HE3 LYS 20 2HE LYS 20 113.637 12.149 -14.330 129 HZ1 LYS 20 3HZ LYS 20 114.404 9.775 -14.841 130 HZ2 LYS 20 1HZ LYS 20 113.238 10.473 -15.855 131 HZ3 LYS 20 2HZ LYS 20 112.769 9.351 -14.669 132 H MET 21 H MET 21 113.532 10.360 -7.630 133 HA MET 21 HA MET 21 115.555 11.267 -5.651 134 HB2 MET 21 1HB MET 21 112.949 9.813 -5.133 135 HB3 MET 21 2HB MET 21 114.184 10.148 -3.918 136 HG2 MET 21 1HG MET 21 113.952 12.595 -4.464 137 HG3 MET 21 2HG MET 21 112.581 12.180 -5.494 138 HE1 MET 21 3HE MET 21 113.341 12.627 -1.290 139 HE2 MET 21 1HE MET 21 114.320 11.635 -2.378 140 HE3 MET 21 2HE MET 21 113.165 10.875 -1.288 141 H GLY 22 H GLY 22 116.579 9.481 -4.443 142 HA2 GLY 22 1HA GLY 22 116.582 6.924 -5.936 143 HA3 GLY 22 2HA GLY 22 118.099 7.767 -5.634 144 H GLY 23 H GLY 23 116.932 5.117 -4.669 145 HA2 GLY 23 1HA GLY 23 117.782 5.428 -1.901 146 HA3 GLY 23 2HA GLY 23 116.107 4.935 -2.126 147 H PHE 24 H PHE 24 117.738 3.299 -0.752 148 HA PHE 24 HA PHE 24 118.125 1.023 -2.610 149 HB2 PHE 24 1HB PHE 24 120.038 0.294 -1.285 150 HB3 PHE 24 2HB PHE 24 120.318 1.883 -1.970 151 HD1 PHE 24 HD1 PHE 24 120.341 3.887 -0.531 152 HD2 PHE 24 HD2 PHE 24 119.831 -0.055 1.099 153 HE1 PHE 24 HE1 PHE 24 120.858 4.756 1.733 154 HE2 PHE 24 HE2 PHE 24 120.347 0.815 3.363 155 HZ PHE 24 HZ PHE 24 120.861 3.220 3.680 156 H ASN 25 H ASN 25 117.839 -1.077 -1.613 157 HA ASN 25 HA ASN 25 116.239 -1.014 0.876 158 HB2 ASN 25 1HB ASN 25 115.497 -2.506 -1.651 159 HB3 ASN 25 2HB ASN 25 114.606 -2.524 -0.130 160 HD21 ASN 25 1HD2 ASN 25 114.022 -1.385 -2.998 161 HD22 ASN 25 2HD2 ASN 25 113.453 0.180 -2.669 162 H LEU 26 H LEU 26 116.546 -2.701 2.229 163 HA LEU 26 HA LEU 26 118.090 -5.033 1.246 164 HB2 LEU 26 1HB LEU 26 118.135 -3.854 4.039 165 HB3 LEU 26 2HB LEU 26 119.061 -5.245 3.478 166 HG LEU 26 HG LEU 26 119.310 -2.438 2.355 167 HD11 LEU 26 1HD1 LEU 26 120.207 -2.468 4.596 168 HD12 LEU 26 2HD1 LEU 26 121.572 -2.555 3.482 169 HD13 LEU 26 3HD1 LEU 26 121.014 -4.010 4.308 170 HD21 LEU 26 3HD2 LEU 26 120.690 -5.069 1.801 171 HD22 LEU 26 1HD2 LEU 26 121.464 -3.529 1.427 172 HD23 LEU 26 2HD2 LEU 26 119.942 -3.963 0.649 173 H LYS 27 H LYS 27 117.214 -7.034 1.720 174 HA LYS 27 HA LYS 27 114.630 -7.003 3.188 175 HB2 LYS 27 1HB LYS 27 115.284 -8.572 0.685 176 HB3 LYS 27 2HB LYS 27 113.754 -8.591 1.559 177 HG2 LYS 27 1HG LYS 27 113.596 -6.100 1.166 178 HG3 LYS 27 2HG LYS 27 114.997 -6.242 0.105 179 HD2 LYS 27 1HD LYS 27 112.404 -7.771 -0.251 180 HD3 LYS 27 2HD LYS 27 112.845 -6.320 -1.148 181 HE2 LYS 27 1HE LYS 27 113.562 -7.972 -2.619 182 HE3 LYS 27 2HE LYS 27 115.036 -7.692 -1.691 183 HZ1 LYS 27 3HZ LYS 27 113.747 -10.081 -2.000 184 HZ2 LYS 27 1HZ LYS 27 113.315 -9.592 -0.434 185 HZ3 LYS 27 2HZ LYS 27 114.956 -9.732 -0.856 186 H TYR 28 H TYR 28 114.246 -8.605 4.578 187 HA TYR 28 HA TYR 28 116.167 -10.860 4.719 188 HB2 TYR 28 1HB TYR 28 114.693 -9.558 7.013 189 HB3 TYR 28 2HB TYR 28 115.835 -10.883 7.129 190 HD1 TYR 28 HD1 TYR 28 118.264 -10.464 6.504 191 HD2 TYR 28 HD2 TYR 28 115.398 -7.303 7.002 192 HE1 TYR 28 HE1 TYR 28 120.112 -8.828 6.752 193 HE2 TYR 28 HE2 TYR 28 117.246 -5.668 7.251 194 HH TYR 28 HH TYR 28 119.676 -5.519 6.532 195 H ARG 29 H ARG 29 115.293 -12.909 4.924 196 HA ARG 29 HA ARG 29 112.338 -13.092 4.962 197 HB2 ARG 29 1HB ARG 29 113.256 -13.334 2.658 198 HB3 ARG 29 2HB ARG 29 114.186 -14.725 3.214 199 HG2 ARG 29 1HG ARG 29 112.055 -15.813 3.930 200 HG3 ARG 29 2HG ARG 29 111.166 -14.456 3.238 201 HD2 ARG 29 1HD ARG 29 113.039 -16.284 1.710 202 HD3 ARG 29 2HD ARG 29 111.280 -16.351 1.658 203 HE ARG 29 HE ARG 29 111.862 -13.766 0.981 204 HH11 ARG 29 1HH1 ARG 29 112.882 -16.871 -0.298 205 HH12 ARG 29 2HH1 ARG 29 113.102 -16.252 -1.901 206 HH21 ARG 29 1HH2 ARG 29 112.163 -13.025 -1.102 207 HH22 ARG 29 2HH2 ARG 29 112.699 -14.102 -2.349 208 H TYR 30 H TYR 30 111.455 -14.710 6.125 209 HA TYR 30 HA TYR 30 113.265 -16.718 7.336 210 HB2 TYR 30 1HB TYR 30 110.894 -15.376 8.646 211 HB3 TYR 30 2HB TYR 30 111.894 -16.626 9.361 212 HD1 TYR 30 HD2 TYR 30 114.151 -16.127 10.165 213 HD2 TYR 30 HD1 TYR 30 111.683 -13.083 8.405 214 HE1 TYR 30 HE2 TYR 30 115.671 -14.381 11.054 215 HE2 TYR 30 HE1 TYR 30 113.204 -11.337 9.294 216 HH TYR 30 HH TYR 30 115.181 -11.649 11.655 217 H GLU 31 H GLU 31 112.520 -18.817 7.359 218 HA GLU 31 HA GLU 31 109.761 -19.317 6.453 219 HB2 GLU 31 1HB GLU 31 112.238 -20.525 5.204 220 HB3 GLU 31 2HB GLU 31 110.579 -21.010 4.847 221 HG2 GLU 31 1HG GLU 31 110.079 -18.674 4.149 222 HG3 GLU 31 2HG GLU 31 111.763 -18.253 4.424 223 H GLU 32 H GLU 32 108.874 -21.269 7.117 224 HA GLU 32 HA GLU 32 110.226 -22.551 9.363 225 HB2 GLU 32 1HB GLU 32 107.451 -22.938 8.218 226 HB3 GLU 32 2HB GLU 32 108.062 -23.711 9.681 227 HG2 GLU 32 1HG GLU 32 108.488 -21.461 10.656 228 HG3 GLU 32 2HG GLU 32 107.783 -20.728 9.222 229 H ASP 33 H ASP 33 110.655 -24.777 9.485 230 HA ASP 33 HA ASP 33 111.745 -25.801 7.066 231 HB2 ASP 33 1HB ASP 33 112.375 -27.754 8.469 232 HB3 ASP 33 2HB ASP 33 112.865 -26.207 9.156 233 H ASN 34 H ASN 34 108.922 -26.834 9.026 234 HA ASN 34 HA ASN 34 108.373 -28.899 6.989 235 HB2 ASN 34 1HB ASN 34 107.278 -28.514 9.775 236 HB3 ASN 34 2HB ASN 34 106.758 -29.782 8.668 237 HD21 ASN 34 1HD2 ASN 34 109.245 -30.548 7.533 238 HD22 ASN 34 2HD2 ASN 34 110.232 -31.185 8.757 239 H SER 35 H SER 35 107.223 -25.794 7.915 240 HA SER 35 HA SER 35 105.054 -26.085 5.975 241 HB2 SER 35 1HB SER 35 103.410 -25.035 7.499 242 HB3 SER 35 2HB SER 35 103.969 -26.589 8.111 243 HG SER 35 HG SER 35 104.399 -24.012 9.052 244 HA PRO 36 HA PRO 36 107.614 -22.228 5.981 245 HB2 PRO 36 1HB PRO 36 108.253 -22.101 3.343 246 HB3 PRO 36 2HB PRO 36 109.137 -23.116 4.500 247 HG2 PRO 36 1HG PRO 36 107.069 -23.883 2.510 248 HG3 PRO 36 2HG PRO 36 108.537 -24.743 3.010 249 HD2 PRO 36 1HD PRO 36 106.010 -25.368 3.922 250 HD3 PRO 36 2HD PRO 36 107.507 -25.732 4.808 251 H LEU 37 H LEU 37 106.767 -20.296 5.915 252 HA LEU 37 HA LEU 37 104.948 -19.521 3.716 253 HB2 LEU 37 1HB LEU 37 104.908 -18.488 6.571 254 HB3 LEU 37 2HB LEU 37 103.831 -17.988 5.267 255 HG LEU 37 HG LEU 37 104.033 -20.821 6.331 256 HD11 LEU 37 1HD1 LEU 37 103.065 -19.274 7.995 257 HD12 LEU 37 2HD1 LEU 37 101.831 -20.354 7.348 258 HD13 LEU 37 3HD1 LEU 37 101.925 -18.686 6.786 259 HD21 LEU 37 3HD2 LEU 37 101.879 -21.049 5.031 260 HD22 LEU 37 1HD2 LEU 37 103.299 -20.784 4.022 261 HD23 LEU 37 2HD2 LEU 37 102.189 -19.453 4.347 262 H GLY 38 H GLY 38 105.539 -17.520 2.692 263 HA2 GLY 38 1HA GLY 38 108.333 -16.843 3.318 264 HA3 GLY 38 2HA GLY 38 107.491 -16.487 1.809 265 H VAL 39 H VAL 39 108.646 -15.145 4.613 266 HA VAL 39 HA VAL 39 106.851 -12.798 4.310 267 HB VAL 39 HB VAL 39 108.299 -13.691 6.820 268 HG11 VAL 39 1HG1 VAL 39 107.049 -11.897 7.896 269 HG12 VAL 39 2HG1 VAL 39 106.224 -11.522 6.382 270 HG13 VAL 39 3HG1 VAL 39 107.956 -11.228 6.540 271 HG21 VAL 39 3HG2 VAL 39 106.431 -15.199 6.290 272 HG22 VAL 39 1HG2 VAL 39 105.360 -13.814 6.068 273 HG23 VAL 39 2HG2 VAL 39 106.013 -14.178 7.667 274 H ILE 40 H ILE 40 107.830 -10.992 3.726 275 HA ILE 40 HA ILE 40 110.782 -10.818 3.974 276 HB ILE 40 HB ILE 40 109.055 -9.727 1.734 277 HG12 ILE 40 1HG1 ILE 40 111.053 -12.009 1.684 278 HG13 ILE 40 2HG1 ILE 40 109.305 -12.236 1.763 279 HG21 ILE 40 1HG2 ILE 40 112.065 -9.838 2.107 280 HG22 ILE 40 2HG2 ILE 40 111.071 -8.384 2.204 281 HG23 ILE 40 3HG2 ILE 40 111.232 -9.242 0.672 282 HD11 ILE 40 3HD1 ILE 40 109.059 -10.965 -0.353 283 HD12 ILE 40 1HD1 ILE 40 110.069 -12.396 -0.563 284 HD13 ILE 40 2HD1 ILE 40 110.813 -10.801 -0.444 285 H GLY 41 H GLY 41 111.497 -9.129 5.057 286 HA2 GLY 41 1HA GLY 41 109.735 -6.759 5.375 287 HA3 GLY 41 2HA GLY 41 110.917 -7.278 6.579 288 H SER 42 H SER 42 110.500 -4.877 4.549 289 HA SER 42 HA SER 42 113.326 -4.797 3.658 290 HB2 SER 42 1HB SER 42 111.764 -5.266 1.768 291 HB3 SER 42 2HB SER 42 110.945 -3.747 2.117 292 HG SER 42 HG SER 42 112.787 -3.853 0.495 293 H PHE 43 H PHE 43 114.408 -2.969 4.064 294 HA PHE 43 HA PHE 43 112.898 -0.662 5.151 295 HB2 PHE 43 1HB PHE 43 115.800 -1.440 5.494 296 HB3 PHE 43 2HB PHE 43 115.064 0.014 6.141 297 HD1 PHE 43 HD1 PHE 43 113.376 -0.142 7.964 298 HD2 PHE 43 HD2 PHE 43 115.501 -3.586 6.524 299 HE1 PHE 43 HE1 PHE 43 112.714 -1.400 9.996 300 HE2 PHE 43 HE2 PHE 43 114.840 -4.843 8.556 301 HZ PHE 43 HZ PHE 43 113.447 -3.751 10.292 302 H THR 44 H THR 44 112.860 1.161 3.958 303 HA THR 44 HA THR 44 114.672 1.301 1.612 304 HB THR 44 HB THR 44 111.933 2.545 1.951 305 HG1 THR 44 HG1 THR 44 112.677 0.371 0.309 306 HG21 THR 44 3HG2 THR 44 114.018 2.546 -0.201 307 HG22 THR 44 1HG2 THR 44 112.962 3.852 0.337 308 HG23 THR 44 2HG2 THR 44 112.318 2.556 -0.669 309 H TYR 45 H TYR 45 116.035 2.932 1.505 310 HA TYR 45 HA TYR 45 115.524 5.357 3.140 311 HB2 TYR 45 1HB TYR 45 117.401 3.963 3.986 312 HB3 TYR 45 2HB TYR 45 118.180 4.101 2.422 313 HD1 TYR 45 HD1 TYR 45 117.106 5.970 5.438 314 HD2 TYR 45 HD2 TYR 45 119.433 6.053 1.829 315 HE1 TYR 45 HE1 TYR 45 118.211 8.053 6.201 316 HE2 TYR 45 HE2 TYR 45 120.538 8.138 2.590 317 HH TYR 45 HH TYR 45 119.610 10.134 4.464 318 H THR 46 H THR 46 115.217 7.109 1.902 319 HA THR 46 HA THR 46 116.428 7.175 -0.802 320 HB THR 46 HB THR 46 113.618 8.062 -0.118 321 HG1 THR 46 HG1 THR 46 113.305 5.984 -0.230 322 HG21 THR 46 3HG2 THR 46 115.066 7.734 -2.762 323 HG22 THR 46 1HG2 THR 46 114.702 9.274 -1.983 324 HG23 THR 46 2HG2 THR 46 113.391 8.246 -2.559 325 H GLU 47 H GLU 47 117.000 9.178 -1.597 326 HA GLU 47 HA GLU 47 116.653 11.505 0.177 327 HB2 GLU 47 1HB GLU 47 119.268 10.606 -1.057 328 HB3 GLU 47 2HB GLU 47 119.014 12.148 -0.241 329 HG2 GLU 47 1HG GLU 47 118.350 10.914 1.817 330 HG3 GLU 47 2HG GLU 47 118.709 9.399 0.998 331 H LYS 48 H LYS 48 116.992 13.546 -0.914 332 HA LYS 48 HA LYS 48 116.876 13.418 -3.867 333 HB2 LYS 48 1HB LYS 48 114.611 13.839 -2.905 334 HB3 LYS 48 2HB LYS 48 115.250 15.282 -2.118 335 HG2 LYS 48 1HG LYS 48 115.842 16.248 -4.282 336 HG3 LYS 48 2HG LYS 48 115.313 14.782 -5.108 337 HD2 LYS 48 1HD LYS 48 113.525 16.399 -5.270 338 HD3 LYS 48 2HD LYS 48 113.019 15.149 -4.132 339 HE2 LYS 48 1HE LYS 48 113.491 16.538 -2.246 340 HE3 LYS 48 2HE LYS 48 114.359 17.709 -3.239 341 HZ1 LYS 48 3HZ LYS 48 112.458 18.629 -3.984 342 HZ2 LYS 48 1HZ LYS 48 111.826 18.007 -2.538 343 HZ3 LYS 48 2HZ LYS 48 111.605 17.159 -3.994 344 H SER 49 H SER 49 118.317 14.731 -4.837 345 HA SER 49 HA SER 49 119.708 16.740 -3.151 346 HB2 SER 49 1HB SER 49 121.103 14.780 -3.777 347 HB3 SER 49 2HB SER 49 120.826 15.157 -5.474 348 HG SER 49 HG SER 49 122.351 16.584 -5.297 349 H ARG 50 H ARG 50 119.879 18.763 -3.879 350 HA ARG 50 HA ARG 50 119.260 19.342 -6.703 351 HB2 ARG 50 1HB ARG 50 118.123 20.785 -4.296 352 HB3 ARG 50 2HB ARG 50 117.974 21.340 -5.964 353 HG2 ARG 50 1HG ARG 50 116.826 19.224 -6.553 354 HG3 ARG 50 2HG ARG 50 116.931 18.712 -4.868 355 HD2 ARG 50 1HD ARG 50 114.742 19.671 -5.193 356 HD3 ARG 50 2HD ARG 50 115.686 20.806 -4.233 357 HE ARG 50 HE ARG 50 116.081 21.569 -6.855 358 HH11 ARG 50 1HH1 ARG 50 113.268 21.210 -4.787 359 HH12 ARG 50 2HH1 ARG 50 112.380 22.447 -5.611 360 HH21 ARG 50 1HH2 ARG 50 114.891 23.153 -7.876 361 HH22 ARG 50 2HH2 ARG 50 113.288 23.533 -7.340 362 H THR 51 H THR 51 120.206 21.300 -7.490 363 HA THR 51 HA THR 51 122.367 22.393 -5.772 364 HB THR 51 HB THR 51 123.693 22.715 -7.796 365 HG1 THR 51 HG1 THR 51 122.026 22.991 -9.272 366 HG21 THR 51 3HG2 THR 51 124.217 20.403 -8.256 367 HG22 THR 51 1HG2 THR 51 122.613 19.887 -7.734 368 HG23 THR 51 2HG2 THR 51 123.762 20.525 -6.556 369 H ALA 52 H ALA 52 122.604 24.578 -5.696 370 HA ALA 52 HA ALA 52 120.807 26.229 -7.372 371 HB1 ALA 52 1HB ALA 52 119.685 26.354 -5.338 372 HB2 ALA 52 2HB ALA 52 120.777 27.735 -5.228 373 HB3 ALA 52 3HB ALA 52 121.170 26.231 -4.394 374 H SER 53 H SER 53 121.599 28.276 -7.933 375 HA SER 53 HA SER 53 124.392 28.535 -8.243 376 HB2 SER 53 1HB SER 53 123.923 30.758 -9.076 377 HB3 SER 53 2HB SER 53 122.673 29.663 -9.659 378 HG SER 53 HG SER 53 122.415 31.862 -8.177 379 H SER 54 H SER 54 122.159 29.820 -5.815 380 HA SER 54 HA SER 54 123.943 31.553 -4.498 381 HB2 SER 54 1HB SER 54 121.667 29.967 -3.290 382 HB3 SER 54 2HB SER 54 122.412 31.410 -2.611 383 HG SER 54 HG SER 54 121.221 32.559 -3.905 384 H GLY 55 H GLY 55 123.427 28.073 -4.209 385 HA2 GLY 55 1HA GLY 55 125.172 26.599 -3.501 386 HA3 GLY 55 2HA GLY 55 125.850 27.906 -2.545 387 H ASP 56 H ASP 56 122.688 28.184 -1.812 388 HA ASP 56 HA ASP 56 122.951 26.457 0.551 389 HB2 ASP 56 1HB ASP 56 121.077 27.782 1.452 390 HB3 ASP 56 2HB ASP 56 122.421 28.812 0.962 391 H TYR 57 H TYR 57 121.872 24.592 0.685 392 HA TYR 57 HA TYR 57 119.363 24.270 -0.816 393 HB2 TYR 57 1HB TYR 57 120.039 22.161 -1.734 394 HB3 TYR 57 2HB TYR 57 121.213 23.377 -2.195 395 HD1 TYR 57 HD1 TYR 57 120.594 20.365 -0.181 396 HD2 TYR 57 HD2 TYR 57 123.485 23.341 -1.290 397 HE1 TYR 57 HE1 TYR 57 122.406 18.954 0.756 398 HE2 TYR 57 HE2 TYR 57 125.297 21.930 -0.354 399 HH TYR 57 HH TYR 57 125.525 19.265 0.055 400 H ASN 58 H ASN 58 117.966 22.664 -0.009 401 HA ASN 58 HA ASN 58 118.531 21.876 2.788 402 HB2 ASN 58 1HB ASN 58 115.910 22.370 1.362 403 HB3 ASN 58 2HB ASN 58 116.048 21.763 3.010 404 HD21 ASN 58 1HD2 ASN 58 114.793 24.302 2.311 405 HD22 ASN 58 2HD2 ASN 58 115.720 25.532 3.024 406 H LYS 59 H LYS 59 118.102 19.769 3.450 407 HA LYS 59 HA LYS 59 117.931 17.811 1.250 408 HB2 LYS 59 1HB LYS 59 118.915 17.534 4.098 409 HB3 LYS 59 2HB LYS 59 118.846 16.218 2.926 410 HG2 LYS 59 1HG LYS 59 120.322 17.539 1.409 411 HG3 LYS 59 2HG LYS 59 120.458 18.773 2.665 412 HD2 LYS 59 1HD LYS 59 121.356 17.033 4.218 413 HD3 LYS 59 2HD LYS 59 121.330 15.878 2.886 414 HE2 LYS 59 1HE LYS 59 122.967 17.093 1.658 415 HE3 LYS 59 2HE LYS 59 122.788 18.516 2.685 416 HZ1 LYS 59 3HZ LYS 59 123.745 17.338 4.513 417 HZ2 LYS 59 1HZ LYS 59 124.788 17.184 3.183 418 HZ3 LYS 59 2HZ LYS 59 123.786 15.886 3.631 419 H ASN 60 H ASN 60 116.278 16.431 1.072 420 HA ASN 60 HA ASN 60 114.304 16.276 3.277 421 HB2 ASN 60 1HB ASN 60 113.571 17.219 1.004 422 HB3 ASN 60 2HB ASN 60 113.778 15.581 0.388 423 HD21 ASN 60 1HD2 ASN 60 111.384 15.565 0.013 424 HD22 ASN 60 2HD2 ASN 60 110.340 15.277 1.319 425 H GLN 61 H GLN 61 113.937 14.291 4.176 426 HA GLN 61 HA GLN 61 115.386 11.997 2.954 427 HB2 GLN 61 1HB GLN 61 116.503 12.937 4.971 428 HB3 GLN 61 2HB GLN 61 115.041 12.607 5.898 429 HG2 GLN 61 1HG GLN 61 115.244 10.195 5.262 430 HG3 GLN 61 2HG GLN 61 116.786 10.570 4.491 431 HE21 GLN 61 1HE2 GLN 61 118.482 10.013 5.853 432 HE22 GLN 61 2HE2 GLN 61 118.485 10.211 7.539 433 H TYR 62 H TYR 62 114.371 10.022 2.965 434 HA TYR 62 HA TYR 62 111.670 9.885 4.173 435 HB2 TYR 62 1HB TYR 62 112.542 9.016 1.424 436 HB3 TYR 62 2HB TYR 62 111.051 8.478 2.172 437 HD1 TYR 62 HD1 TYR 62 109.176 10.016 2.485 438 HD2 TYR 62 HD2 TYR 62 112.837 11.306 0.646 439 HE1 TYR 62 HE1 TYR 62 108.035 12.052 1.646 440 HE2 TYR 62 HE2 TYR 62 111.698 13.344 -0.191 441 HH TYR 62 HH TYR 62 109.759 14.414 -0.390 442 H TYR 63 H TYR 63 111.200 8.078 5.262 443 HA TYR 63 HA TYR 63 112.950 5.705 4.933 444 HB2 TYR 63 1HB TYR 63 111.592 6.720 7.437 445 HB3 TYR 63 2HB TYR 63 112.372 5.158 7.299 446 HD1 TYR 63 HD1 TYR 63 114.888 5.121 6.753 447 HD2 TYR 63 HD2 TYR 63 112.788 8.640 8.039 448 HE1 TYR 63 HE1 TYR 63 117.035 6.148 7.449 449 HE2 TYR 63 HE2 TYR 63 114.936 9.669 8.731 450 HH TYR 63 HH TYR 63 117.518 8.238 9.412 451 H GLY 64 H GLY 64 111.864 3.782 4.544 452 HA2 GLY 64 1HA GLY 64 108.910 3.810 4.853 453 HA3 GLY 64 2HA GLY 64 109.667 3.242 3.368 454 H ILE 65 H ILE 65 108.053 2.040 5.765 455 HA ILE 65 HA ILE 65 109.776 -0.357 6.077 456 HB ILE 65 HB ILE 65 109.338 0.769 8.223 457 HG12 ILE 65 1HG1 ILE 65 107.628 -1.719 8.095 458 HG13 ILE 65 2HG1 ILE 65 109.385 -1.787 7.944 459 HG21 ILE 65 1HG2 ILE 65 107.122 1.077 9.081 460 HG22 ILE 65 2HG2 ILE 65 106.410 0.185 7.737 461 HG23 ILE 65 3HG2 ILE 65 107.135 1.769 7.459 462 HD11 ILE 65 3HD1 ILE 65 109.658 -0.725 10.121 463 HD12 ILE 65 1HD1 ILE 65 108.606 -2.131 10.294 464 HD13 ILE 65 2HD1 ILE 65 107.913 -0.509 10.267 465 H THR 66 H THR 66 109.036 -2.148 5.092 466 HA THR 66 HA THR 66 106.158 -2.308 4.420 467 HB THR 66 HB THR 66 106.760 -3.244 2.226 468 HG1 THR 66 HG1 THR 66 108.732 -3.797 1.872 469 HG21 THR 66 3HG2 THR 66 107.978 -1.051 1.384 470 HG22 THR 66 1HG2 THR 66 107.638 -0.493 3.021 471 HG23 THR 66 2HG2 THR 66 106.315 -0.986 1.967 472 H ALA 67 H ALA 67 105.369 -4.437 4.028 473 HA ALA 67 HA ALA 67 107.117 -6.710 4.605 474 HB1 ALA 67 1HB ALA 67 105.434 -7.642 6.215 475 HB2 ALA 67 2HB ALA 67 104.617 -6.080 6.197 476 HB3 ALA 67 3HB ALA 67 106.264 -6.207 6.817 477 H GLY 68 H GLY 68 106.357 -8.642 3.651 478 HA2 GLY 68 1HA GLY 68 103.767 -8.550 2.292 479 HA3 GLY 68 2HA GLY 68 105.193 -8.675 1.285 480 HA PRO 69 HA PRO 69 104.318 -13.054 2.902 481 HB2 PRO 69 1HB PRO 69 101.947 -13.588 1.311 482 HB3 PRO 69 2HB PRO 69 102.177 -13.762 3.057 483 HG2 PRO 69 1HG PRO 69 100.565 -11.903 1.875 484 HG3 PRO 69 2HG PRO 69 101.250 -11.764 3.502 485 HD2 PRO 69 1HD PRO 69 102.134 -10.439 0.970 486 HD3 PRO 69 2HD PRO 69 102.151 -9.826 2.641 487 H ALA 70 H ALA 70 104.664 -14.988 1.434 488 HA ALA 70 HA ALA 70 104.989 -14.283 -1.401 489 HB1 ALA 70 1HB ALA 70 107.163 -14.054 0.136 490 HB2 ALA 70 2HB ALA 70 107.246 -14.670 -1.514 491 HB3 ALA 70 3HB ALA 70 107.236 -15.791 -0.154 492 H TYR 71 H TYR 71 104.815 -16.032 -2.809 493 HA TYR 71 HA TYR 71 104.028 -18.600 -1.560 494 HB2 TYR 71 1HB TYR 71 102.092 -17.293 -2.426 495 HB3 TYR 71 2HB TYR 71 102.824 -17.328 -4.019 496 HD1 TYR 71 HD1 TYR 71 101.286 -19.387 -1.353 497 HD2 TYR 71 HD2 TYR 71 102.692 -19.285 -5.410 498 HE1 TYR 71 HE1 TYR 71 100.190 -21.568 -1.786 499 HE2 TYR 71 HE2 TYR 71 101.596 -21.468 -5.844 500 HH TYR 71 HH TYR 71 100.864 -23.458 -4.482 501 H ARG 72 H ARG 72 105.126 -20.331 -2.291 502 HA ARG 72 HA ARG 72 106.827 -20.009 -4.659 503 HB2 ARG 72 1HB ARG 72 106.682 -22.182 -2.559 504 HB3 ARG 72 2HB ARG 72 107.764 -22.222 -3.951 505 HG2 ARG 72 1HG ARG 72 108.731 -20.043 -3.215 506 HG3 ARG 72 2HG ARG 72 107.719 -20.116 -1.772 507 HD2 ARG 72 1HD ARG 72 108.766 -22.321 -1.216 508 HD3 ARG 72 2HD ARG 72 109.858 -22.103 -2.577 509 HE ARG 72 HE ARG 72 109.909 -20.657 -0.042 510 HH11 ARG 72 1HH1 ARG 72 111.145 -20.850 -3.326 511 HH12 ARG 72 2HH1 ARG 72 112.534 -19.882 -2.963 512 HH21 ARG 72 1HH2 ARG 72 111.720 -19.416 0.358 513 HH22 ARG 72 2HH2 ARG 72 112.853 -19.080 -0.908 514 H ILE 73 H ILE 73 106.234 -20.738 -6.571 515 HA ILE 73 HA ILE 73 104.364 -23.006 -6.754 516 HB ILE 73 HB ILE 73 103.065 -20.926 -7.001 517 HG12 ILE 73 1HG1 ILE 73 103.358 -22.221 -9.715 518 HG13 ILE 73 2HG1 ILE 73 102.631 -23.069 -8.350 519 HG21 ILE 73 1HG2 ILE 73 104.895 -19.503 -7.873 520 HG22 ILE 73 2HG2 ILE 73 103.469 -19.439 -8.909 521 HG23 ILE 73 3HG2 ILE 73 104.864 -20.408 -9.387 522 HD11 ILE 73 3HD1 ILE 73 100.765 -22.090 -9.368 523 HD12 ILE 73 1HD1 ILE 73 101.644 -20.622 -9.789 524 HD13 ILE 73 2HD1 ILE 73 101.166 -20.914 -8.117 525 H ASN 74 H ASN 74 104.481 -24.175 -8.743 526 HA ASN 74 HA ASN 74 105.614 -25.204 -10.451 527 HB2 ASN 74 1HB ASN 74 106.616 -22.385 -10.903 528 HB3 ASN 74 2HB ASN 74 106.813 -23.718 -12.037 529 HD21 ASN 74 1HD2 ASN 74 105.301 -21.282 -12.606 530 HD22 ASN 74 2HD2 ASN 74 103.685 -21.746 -12.846 531 H ASP 75 H ASP 75 107.865 -25.638 -11.342 532 HA ASP 75 HA ASP 75 109.530 -26.491 -9.272 533 HB2 ASP 75 1HB ASP 75 109.515 -27.330 -11.648 534 HB3 ASP 75 2HB ASP 75 110.421 -25.888 -12.096 535 H TRP 76 H TRP 76 109.652 -23.523 -11.208 536 HA TRP 76 HA TRP 76 111.352 -22.310 -9.166 537 HB2 TRP 76 1HB TRP 76 112.174 -22.679 -12.036 538 HB3 TRP 76 2HB TRP 76 112.838 -21.399 -11.040 539 HD1 TRP 76 HD1 TRP 76 113.537 -22.700 -8.415 540 HE1 TRP 76 HE1 TRP 76 115.245 -24.620 -8.229 541 HE3 TRP 76 HE3 TRP 76 113.435 -24.437 -13.215 542 HZ2 TRP 76 HZ2 TRP 76 116.416 -26.631 -9.899 543 HZ3 TRP 76 HZ3 TRP 76 114.853 -26.350 -13.890 544 HH2 TRP 76 HH2 TRP 76 116.342 -27.450 -12.242 545 H ALA 77 H ALA 77 109.622 -20.938 -8.713 546 HA ALA 77 HA ALA 77 109.552 -18.490 -10.063 547 HB1 ALA 77 1HB ALA 77 107.106 -18.694 -10.883 548 HB2 ALA 77 2HB ALA 77 107.395 -20.434 -10.868 549 HB3 ALA 77 3HB ALA 77 108.375 -19.386 -11.894 550 H SER 78 H SER 78 109.266 -17.278 -8.292 551 HA SER 78 HA SER 78 107.052 -17.982 -6.444 552 HB2 SER 78 1HB SER 78 108.396 -17.097 -4.612 553 HB3 SER 78 2HB SER 78 109.287 -18.372 -5.436 554 HG SER 78 HG SER 78 110.680 -16.932 -6.146 555 H ILE 79 H ILE 79 105.918 -16.211 -5.512 556 HA ILE 79 HA ILE 79 106.428 -13.578 -6.761 557 HB ILE 79 HB ILE 79 104.648 -14.693 -8.050 558 HG12 ILE 79 1HG1 ILE 79 103.392 -12.583 -6.285 559 HG13 ILE 79 2HG1 ILE 79 104.618 -12.193 -7.491 560 HG21 ILE 79 1HG2 ILE 79 103.077 -14.735 -5.461 561 HG22 ILE 79 2HG2 ILE 79 103.874 -16.150 -6.148 562 HG23 ILE 79 3HG2 ILE 79 102.567 -15.360 -7.029 563 HD11 ILE 79 3HD1 ILE 79 102.441 -11.888 -8.511 564 HD12 ILE 79 1HD1 ILE 79 101.929 -13.495 -7.992 565 HD13 ILE 79 2HD1 ILE 79 103.185 -13.322 -9.219 566 H TYR 80 H TYR 80 105.732 -11.793 -5.503 567 HA TYR 80 HA TYR 80 104.562 -12.368 -2.885 568 HB2 TYR 80 1HB TYR 80 106.299 -11.270 -1.646 569 HB3 TYR 80 2HB TYR 80 107.011 -12.562 -2.591 570 HD1 TYR 80 HD1 TYR 80 106.741 -8.924 -2.134 571 HD2 TYR 80 HD2 TYR 80 108.500 -12.070 -4.472 572 HE1 TYR 80 HE1 TYR 80 108.346 -7.303 -3.108 573 HE2 TYR 80 HE2 TYR 80 110.104 -10.449 -5.447 574 HH TYR 80 HH TYR 80 110.896 -7.689 -4.224 575 H GLY 81 H GLY 81 103.815 -10.467 -1.781 576 HA2 GLY 81 1HA GLY 81 103.769 -7.990 -3.398 577 HA3 GLY 81 2HA GLY 81 102.250 -8.651 -2.791 578 H VAL 82 H VAL 82 103.618 -6.086 -2.152 579 HA VAL 82 HA VAL 82 103.901 -6.439 0.764 580 HB VAL 82 HB VAL 82 105.836 -4.884 0.740 581 HG11 VAL 82 1HG1 VAL 82 107.421 -6.568 -0.484 582 HG12 VAL 82 2HG1 VAL 82 105.963 -7.539 -0.667 583 HG13 VAL 82 3HG1 VAL 82 106.536 -7.101 0.943 584 HG21 VAL 82 3HG2 VAL 82 105.706 -5.309 -2.261 585 HG22 VAL 82 1HG2 VAL 82 106.988 -4.460 -1.399 586 HG23 VAL 82 2HG2 VAL 82 105.354 -3.798 -1.423 587 H VAL 83 H VAL 83 103.402 -4.668 2.003 588 HA VAL 83 HA VAL 83 102.685 -2.153 0.658 589 HB VAL 83 HB VAL 83 100.566 -3.349 1.067 590 HG11 VAL 83 1HG1 VAL 83 101.458 -4.696 3.009 591 HG12 VAL 83 2HG1 VAL 83 99.869 -3.981 3.287 592 HG13 VAL 83 3HG1 VAL 83 101.305 -3.247 4.002 593 HG21 VAL 83 3HG2 VAL 83 100.914 -1.121 3.090 594 HG22 VAL 83 1HG2 VAL 83 99.438 -1.571 2.234 595 HG23 VAL 83 2HG2 VAL 83 100.781 -0.841 1.353 596 H GLY 84 H GLY 84 102.953 -0.282 2.081 597 HA2 GLY 84 1HA GLY 84 103.940 -0.652 4.760 598 HA3 GLY 84 2HA GLY 84 105.226 -0.288 3.619 599 H VAL 85 H VAL 85 105.251 1.510 5.336 600 HA VAL 85 HA VAL 85 103.595 3.777 4.387 601 HB VAL 85 HB VAL 85 104.424 3.248 7.255 602 HG11 VAL 85 1HG1 VAL 85 104.280 5.626 6.773 603 HG12 VAL 85 2HG1 VAL 85 102.852 5.156 7.694 604 HG13 VAL 85 3HG1 VAL 85 102.735 5.403 5.952 605 HG21 VAL 85 3HG2 VAL 85 101.970 2.938 7.617 606 HG22 VAL 85 1HG2 VAL 85 102.664 1.694 6.578 607 HG23 VAL 85 2HG2 VAL 85 101.734 3.014 5.871 608 H GLY 86 H GLY 86 104.683 5.665 4.059 609 HA2 GLY 86 1HA GLY 86 107.591 5.668 4.656 610 HA3 GLY 86 2HA GLY 86 106.918 6.303 3.159 611 H TYR 87 H TYR 87 108.413 7.478 5.588 612 HA TYR 87 HA TYR 87 106.589 9.778 5.998 613 HB2 TYR 87 1HB TYR 87 108.627 8.628 7.910 614 HB3 TYR 87 2HB TYR 87 107.739 10.118 8.166 615 HD1 TYR 87 HD1 TYR 87 105.253 10.040 8.492 616 HD2 TYR 87 HD2 TYR 87 107.664 6.489 8.345 617 HE1 TYR 87 HE1 TYR 87 103.413 8.749 9.541 618 HE2 TYR 87 HE2 TYR 87 105.826 5.197 9.394 619 HH TYR 87 HH TYR 87 103.389 6.465 11.027 620 H GLY 88 H GLY 88 107.423 11.765 5.610 621 HA2 GLY 88 1HA GLY 88 110.263 11.922 4.775 622 HA3 GLY 88 2HA GLY 88 108.966 12.735 3.906 623 H LYS 89 H LYS 89 111.425 13.652 5.442 624 HA LYS 89 HA LYS 89 110.061 15.741 7.028 625 HB2 LYS 89 1HB LYS 89 111.078 14.023 8.529 626 HB3 LYS 89 2HB LYS 89 112.648 14.369 7.803 627 HG2 LYS 89 1HG LYS 89 112.410 16.749 8.494 628 HG3 LYS 89 2HG LYS 89 110.892 16.340 9.297 629 HD2 LYS 89 1HD LYS 89 112.140 14.654 10.673 630 HD3 LYS 89 2HD LYS 89 113.640 15.244 9.955 631 HE2 LYS 89 1HE LYS 89 113.462 17.342 10.991 632 HE3 LYS 89 2HE LYS 89 111.729 17.164 11.268 633 HZ1 LYS 89 3HZ LYS 89 112.866 16.841 13.325 634 HZ2 LYS 89 1HZ LYS 89 113.913 15.696 12.638 635 HZ3 LYS 89 2HZ LYS 89 112.263 15.335 12.820 636 H PHE 90 H PHE 90 110.753 17.769 6.605 637 HA PHE 90 HA PHE 90 112.988 18.063 4.689 638 HB2 PHE 90 1HB PHE 90 110.686 18.813 4.010 639 HB3 PHE 90 2HB PHE 90 110.762 20.009 5.289 640 HD1 PHE 90 HD1 PHE 90 112.234 21.961 5.102 641 HD2 PHE 90 HD2 PHE 90 112.026 19.006 1.992 642 HE1 PHE 90 HE1 PHE 90 113.386 23.515 3.547 643 HE2 PHE 90 HE2 PHE 90 113.177 20.559 0.438 644 HZ PHE 90 HZ PHE 90 113.856 22.813 1.216 645 H GLN 91 H GLN 91 114.735 19.253 5.218 646 HA GLN 91 HA GLN 91 114.805 20.426 7.919 647 HB2 GLN 91 1HB GLN 91 116.523 18.731 7.296 648 HB3 GLN 91 2HB GLN 91 117.096 19.822 6.035 649 HG2 GLN 91 1HG GLN 91 117.598 21.537 7.715 650 HG3 GLN 91 2HG GLN 91 116.979 20.490 8.989 651 HE21 GLN 91 1HE2 GLN 91 119.573 21.315 9.316 652 HE22 GLN 91 2HE2 GLN 91 120.660 20.057 8.973 653 H THR 92 H THR 92 114.609 22.553 8.124 654 HA THR 92 HA THR 92 115.786 24.318 6.107 655 HB THR 92 HB THR 92 113.438 24.003 5.428 656 HG1 THR 92 HG1 THR 92 114.055 25.963 4.884 657 HG21 THR 92 3HG2 THR 92 111.613 24.423 6.810 658 HG22 THR 92 1HG2 THR 92 112.550 25.432 7.911 659 HG23 THR 92 2HG2 THR 92 112.745 23.679 7.940 660 H THR 93 H THR 93 115.887 26.598 6.854 661 HA THR 93 HA THR 93 116.291 26.707 9.769 662 HB THR 93 HB THR 93 117.119 28.695 7.638 663 HG1 THR 93 HG1 THR 93 118.636 26.723 8.996 664 HG21 THR 93 3HG2 THR 93 117.911 28.363 10.547 665 HG22 THR 93 1HG2 THR 93 116.911 29.657 9.888 666 HG23 THR 93 2HG2 THR 93 118.608 29.535 9.427 667 H GLU 94 H GLU 94 114.925 27.787 11.044 668 HA GLU 94 HA GLU 94 113.359 30.026 10.388 669 HB2 GLU 94 1HB GLU 94 112.299 28.355 8.815 670 HB3 GLU 94 2HB GLU 94 111.804 27.432 10.232 671 HG2 GLU 94 1HG GLU 94 110.586 29.426 11.076 672 HG3 GLU 94 2HG GLU 94 111.035 30.297 9.617 673 H TYR 95 H TYR 95 112.119 30.711 12.184 674 HA TYR 95 HA TYR 95 112.718 29.370 14.682 675 HB2 TYR 95 1HB TYR 95 111.331 31.216 15.663 676 HB3 TYR 95 2HB TYR 95 112.711 31.762 14.728 677 HD1 TYR 95 HD1 TYR 95 109.032 31.445 14.802 678 HD2 TYR 95 HD2 TYR 95 112.422 33.001 12.671 679 HE1 TYR 95 HE1 TYR 95 107.521 32.844 13.419 680 HE2 TYR 95 HE2 TYR 95 110.912 34.400 11.288 681 HH TYR 95 HH TYR 95 107.377 34.335 11.786 682 HA PRO 96 HA PRO 96 109.522 26.586 14.454 683 HB2 PRO 96 1HB PRO 96 108.733 26.166 17.050 684 HB3 PRO 96 2HB PRO 96 110.258 25.573 16.368 685 HG2 PRO 96 1HG PRO 96 109.753 27.952 18.075 686 HG3 PRO 96 2HG PRO 96 111.106 26.806 18.101 687 HD2 PRO 96 1HD PRO 96 111.303 29.276 16.962 688 HD3 PRO 96 2HD PRO 96 112.231 27.874 16.386 689 H THR 97 H THR 97 107.508 26.603 13.806 690 HA THR 97 HA THR 97 105.507 28.287 15.188 691 HB THR 97 HB THR 97 105.436 27.309 12.320 692 HG1 THR 97 HG1 THR 97 105.634 29.741 12.100 693 HG21 THR 97 3HG2 THR 97 103.212 27.645 12.932 694 HG22 THR 97 1HG2 THR 97 103.657 29.244 12.337 695 HG23 THR 97 2HG2 THR 97 103.615 28.930 14.071 696 H TYR 98 H TYR 98 103.348 27.277 15.392 697 HA TYR 98 HA TYR 98 103.598 24.357 15.671 698 HB2 TYR 98 1HB TYR 98 101.725 24.461 17.135 699 HB3 TYR 98 2HB TYR 98 102.829 25.738 17.596 700 HD1 TYR 98 HD2 TYR 98 102.235 28.092 17.273 701 HD2 TYR 98 HD1 TYR 98 99.546 24.935 16.154 702 HE1 TYR 98 HE2 TYR 98 100.381 29.730 17.104 703 HE2 TYR 98 HE1 TYR 98 97.691 26.573 15.986 704 HH TYR 98 HH TYR 98 97.290 29.019 17.180 705 H LYS 99 H LYS 99 102.828 23.074 14.194 706 HA LYS 99 HA LYS 99 100.704 24.031 12.371 707 HB2 LYS 99 1HB LYS 99 102.928 22.036 11.891 708 HB3 LYS 99 2HB LYS 99 101.629 22.383 10.750 709 HG2 LYS 99 1HG LYS 99 102.313 24.783 10.758 710 HG3 LYS 99 2HG LYS 99 103.674 24.360 11.797 711 HD2 LYS 99 1HD LYS 99 104.463 22.763 10.047 712 HD3 LYS 99 2HD LYS 99 103.159 23.319 8.997 713 HE2 LYS 99 1HE LYS 99 104.943 24.664 8.305 714 HE3 LYS 99 2HE LYS 99 104.136 25.700 9.482 715 HZ1 LYS 99 3HZ LYS 99 106.543 25.598 9.822 716 HZ2 LYS 99 1HZ LYS 99 106.441 23.923 10.073 717 HZ3 LYS 99 2HZ LYS 99 105.690 24.991 11.161 718 H HIS 100 H HIS 100 99.114 22.497 11.694 719 HA HIS 100 HA HIS 100 98.033 20.811 13.635 720 HB2 HIS 100 1HB HIS 100 96.847 21.648 11.616 721 HB3 HIS 100 2HB HIS 100 97.776 20.527 10.639 722 HD1 HIS 100 HD1 HIS 100 97.190 17.987 10.860 723 HD2 HIS 100 HD2 HIS 100 94.715 20.508 13.075 724 HE1 HIS 100 HE1 HIS 100 95.201 16.593 11.571 725 H ASP 101 H ASP 101 100.302 20.079 11.013 726 HA ASP 101 HA ASP 101 100.969 17.558 12.401 727 HB2 ASP 101 1HB ASP 101 101.280 16.442 10.256 728 HB3 ASP 101 2HB ASP 101 99.629 17.036 10.391 729 H THR 102 H THR 102 103.169 16.742 11.677 730 HA THR 102 HA THR 102 105.000 19.038 11.248 731 HB THR 102 HB THR 102 105.105 18.290 13.568 732 HG1 THR 102 HG1 THR 102 107.234 18.245 13.568 733 HG21 THR 102 3HG2 THR 102 105.668 16.020 14.163 734 HG22 THR 102 1HG2 THR 102 105.893 15.581 12.469 735 HG23 THR 102 2HG2 THR 102 104.280 15.958 13.076 736 H SER 103 H SER 103 104.422 15.589 10.730 737 HA SER 103 HA SER 103 106.532 15.605 8.643 738 HB2 SER 103 1HB SER 103 105.589 13.279 10.338 739 HB3 SER 103 2HB SER 103 106.816 13.209 9.079 740 HG SER 103 HG SER 103 107.214 13.730 11.576 741 H ASP 104 H ASP 104 106.101 14.469 6.716 742 HA ASP 104 HA ASP 104 103.219 14.214 6.135 743 HB2 ASP 104 1HB ASP 104 105.612 14.399 4.289 744 HB3 ASP 104 2HB ASP 104 103.938 14.250 3.759 745 H TYR 105 H TYR 105 102.362 12.304 5.246 746 HA TYR 105 HA TYR 105 104.173 9.975 5.151 747 HB2 TYR 105 1HB TYR 105 102.687 8.644 6.467 748 HB3 TYR 105 2HB TYR 105 103.082 10.092 7.370 749 HD1 TYR 105 HD2 TYR 105 101.384 11.803 7.807 750 HD2 TYR 105 HD1 TYR 105 100.448 8.241 5.596 751 HE1 TYR 105 HE2 TYR 105 98.963 12.262 8.092 752 HE2 TYR 105 HE1 TYR 105 98.028 8.701 5.880 753 HH TYR 105 HH TYR 105 96.864 11.150 8.033 754 H GLY 106 H GLY 106 103.462 8.227 3.891 755 HA2 GLY 106 1HA GLY 106 100.980 8.507 2.364 756 HA3 GLY 106 2HA GLY 106 102.481 8.502 1.441 757 H PHE 107 H PHE 107 100.725 6.547 0.871 758 HA PHE 107 HA PHE 107 101.687 4.141 2.323 759 HB2 PHE 107 1HB PHE 107 99.090 4.600 0.852 760 HB3 PHE 107 2HB PHE 107 99.604 3.058 1.509 761 HD1 PHE 107 HD2 PHE 107 99.612 2.657 3.921 762 HD2 PHE 107 HD1 PHE 107 98.362 6.429 2.290 763 HE1 PHE 107 HE2 PHE 107 98.609 3.268 6.105 764 HE2 PHE 107 HE1 PHE 107 97.358 7.040 4.475 765 HZ PHE 107 HZ PHE 107 97.482 5.460 6.382 766 H SER 108 H SER 108 102.479 2.406 1.125 767 HA SER 108 HA SER 108 102.526 2.732 -1.818 768 HB2 SER 108 1HB SER 108 104.874 2.117 -1.882 769 HB3 SER 108 2HB SER 108 104.675 3.526 -0.846 770 HG SER 108 HG SER 108 105.280 2.365 0.811 771 H TYR 109 H TYR 109 102.563 0.823 -2.998 772 HA TYR 109 HA TYR 109 102.857 -1.729 -1.650 773 HB2 TYR 109 1HB TYR 109 100.683 -2.584 -2.181 774 HB3 TYR 109 2HB TYR 109 100.489 -1.114 -1.250 775 HD1 TYR 109 HD1 TYR 109 100.055 -2.712 -4.530 776 HD2 TYR 109 HD2 TYR 109 99.569 0.912 -2.275 777 HE1 TYR 109 HE1 TYR 109 98.585 -1.802 -6.308 778 HE2 TYR 109 HE2 TYR 109 98.099 1.821 -4.053 779 HH TYR 109 HH TYR 109 96.677 0.994 -5.862 780 H GLY 110 H GLY 110 102.848 -3.549 -3.178 781 HA2 GLY 110 1HA GLY 110 102.550 -3.289 -5.959 782 HA3 GLY 110 2HA GLY 110 104.244 -2.998 -5.575 783 H ALA 111 H ALA 111 104.068 -5.044 -7.111 784 HA ALA 111 HA ALA 111 104.485 -7.360 -5.355 785 HB1 ALA 111 1HB ALA 111 102.141 -7.443 -6.301 786 HB2 ALA 111 2HB ALA 111 103.155 -8.827 -6.711 787 HB3 ALA 111 3HB ALA 111 102.868 -7.560 -7.904 788 H GLY 112 H GLY 112 105.759 -9.073 -6.413 789 HA2 GLY 112 1HA GLY 112 107.106 -8.379 -8.897 790 HA3 GLY 112 2HA GLY 112 108.118 -8.296 -7.461 791 H LEU 113 H LEU 113 108.997 -9.968 -9.243 792 HA LEU 113 HA LEU 113 108.229 -12.664 -8.288 793 HB2 LEU 113 1HB LEU 113 109.046 -11.928 -11.110 794 HB3 LEU 113 2HB LEU 113 108.648 -13.544 -10.530 795 HG LEU 113 HG LEU 113 106.739 -11.188 -10.498 796 HD11 LEU 113 1HD1 LEU 113 107.266 -11.949 -12.795 797 HD12 LEU 113 2HD1 LEU 113 105.610 -12.360 -12.350 798 HD13 LEU 113 3HD1 LEU 113 106.861 -13.602 -12.333 799 HD21 LEU 113 3HD2 LEU 113 106.452 -14.134 -9.844 800 HD22 LEU 113 1HD2 LEU 113 105.075 -13.063 -10.098 801 HD23 LEU 113 2HD2 LEU 113 106.186 -12.768 -8.761 802 H GLN 114 H GLN 114 109.915 -14.122 -8.004 803 HA GLN 114 HA GLN 114 112.659 -13.062 -8.370 804 HB2 GLN 114 1HB GLN 114 111.953 -13.079 -5.973 805 HB3 GLN 114 2HB GLN 114 111.700 -14.820 -6.098 806 HG2 GLN 114 1HG GLN 114 114.089 -15.056 -6.826 807 HG3 GLN 114 2HG GLN 114 114.311 -13.337 -6.501 808 HE21 GLN 114 1HE2 GLN 114 115.236 -13.003 -4.485 809 HE22 GLN 114 2HE2 GLN 114 114.950 -13.956 -3.109 810 H PHE 115 H PHE 115 113.960 -14.345 -9.554 811 HA PHE 115 HA PHE 115 113.246 -17.201 -9.844 812 HB2 PHE 115 1HB PHE 115 113.631 -17.099 -12.232 813 HB3 PHE 115 2HB PHE 115 112.360 -15.977 -11.786 814 HD1 PHE 115 HD2 PHE 115 112.709 -13.557 -11.925 815 HD2 PHE 115 HD1 PHE 115 115.805 -16.330 -13.013 816 HE1 PHE 115 HE2 PHE 115 113.953 -11.728 -13.046 817 HE2 PHE 115 HE1 PHE 115 117.049 -14.500 -14.133 818 HZ PHE 115 HZ PHE 115 116.124 -12.200 -14.149 819 H ASN 116 H ASN 116 115.051 -18.538 -10.573 820 HA ASN 116 HA ASN 116 117.691 -17.265 -10.356 821 HB2 ASN 116 1HB ASN 116 118.467 -19.113 -8.885 822 HB3 ASN 116 2HB ASN 116 117.239 -18.102 -8.127 823 HD21 ASN 116 1HD2 ASN 116 118.052 -21.332 -8.833 824 HD22 ASN 116 2HD2 ASN 116 116.525 -22.024 -8.564 825 HA PRO 117 HA PRO 117 118.270 -20.464 -13.525 826 HB2 PRO 117 1HB PRO 117 120.645 -19.695 -14.507 827 HB3 PRO 117 2HB PRO 117 119.224 -18.648 -14.677 828 HG2 PRO 117 1HG PRO 117 121.540 -18.395 -12.864 829 HG3 PRO 117 2HG PRO 117 120.538 -17.139 -13.608 830 HD2 PRO 117 1HD PRO 117 120.297 -18.182 -10.961 831 HD3 PRO 117 2HD PRO 117 119.217 -17.025 -11.768 832 H MET 118 H MET 118 120.759 -21.603 -14.182 833 HA MET 118 HA MET 118 121.242 -23.545 -12.245 834 HB2 MET 118 1HB MET 118 123.095 -22.449 -14.370 835 HB3 MET 118 2HB MET 118 123.393 -23.926 -13.452 836 HG2 MET 118 1HG MET 118 121.178 -24.797 -14.261 837 HG3 MET 118 2HG MET 118 121.057 -23.380 -15.304 838 HE1 MET 118 3HE MET 118 124.498 -23.257 -16.338 839 HE2 MET 118 1HE MET 118 122.893 -22.548 -16.562 840 HE3 MET 118 2HE MET 118 123.613 -23.527 -17.838 841 H GLU 119 H GLU 119 122.762 -20.378 -12.694 842 HA GLU 119 HA GLU 119 124.768 -20.605 -10.727 843 HB2 GLU 119 1HB GLU 119 123.242 -18.160 -11.657 844 HB3 GLU 119 2HB GLU 119 124.726 -18.128 -10.706 845 HG2 GLU 119 1HG GLU 119 125.878 -19.390 -12.513 846 HG3 GLU 119 2HG GLU 119 124.407 -19.321 -13.473 847 H ASN 120 H ASN 120 124.818 -19.767 -8.577 848 HA ASN 120 HA ASN 120 122.411 -20.395 -7.106 849 HB2 ASN 120 1HB ASN 120 125.135 -19.476 -6.181 850 HB3 ASN 120 2HB ASN 120 123.833 -20.004 -5.118 851 HD21 ASN 120 1HD2 ASN 120 126.423 -21.348 -5.364 852 HD22 ASN 120 2HD2 ASN 120 126.116 -22.905 -5.966 853 H VAL 121 H VAL 121 122.901 -17.689 -8.740 854 HA VAL 121 HA VAL 121 122.090 -15.869 -6.548 855 HB VAL 121 HB VAL 121 123.211 -15.167 -9.274 856 HG11 VAL 121 1HG1 VAL 121 122.671 -13.490 -6.804 857 HG12 VAL 121 2HG1 VAL 121 121.751 -13.432 -8.307 858 HG13 VAL 121 3HG1 VAL 121 123.436 -12.912 -8.284 859 HG21 VAL 121 3HG2 VAL 121 124.475 -15.432 -6.542 860 HG22 VAL 121 1HG2 VAL 121 125.183 -14.413 -7.794 861 HG23 VAL 121 2HG2 VAL 121 125.006 -16.147 -8.064 862 H ALA 122 H ALA 122 120.156 -14.860 -6.633 863 HA ALA 122 HA ALA 122 118.407 -15.462 -8.953 864 HB1 ALA 122 1HB ALA 122 116.535 -15.471 -7.430 865 HB2 ALA 122 2HB ALA 122 117.559 -14.944 -6.094 866 HB3 ALA 122 3HB ALA 122 117.769 -16.553 -6.785 867 H LEU 123 H LEU 123 116.813 -13.833 -9.485 868 HA LEU 123 HA LEU 123 117.669 -11.090 -8.752 869 HB2 LEU 123 1HB LEU 123 116.744 -12.104 -11.455 870 HB3 LEU 123 2HB LEU 123 117.049 -10.412 -11.056 871 HG LEU 123 HG LEU 123 119.398 -11.337 -10.275 872 HD11 LEU 123 1HD1 LEU 123 119.986 -13.180 -12.060 873 HD12 LEU 123 2HD1 LEU 123 118.254 -13.511 -12.006 874 HD13 LEU 123 3HD1 LEU 123 119.224 -13.651 -10.541 875 HD21 LEU 123 3HD2 LEU 123 120.295 -10.732 -12.414 876 HD22 LEU 123 1HD2 LEU 123 118.835 -9.765 -12.206 877 HD23 LEU 123 2HD2 LEU 123 118.807 -11.193 -13.242 878 H ASP 124 H ASP 124 116.001 -9.567 -8.489 879 HA ASP 124 HA ASP 124 113.241 -10.622 -8.663 880 HB2 ASP 124 1HB ASP 124 112.708 -9.648 -6.498 881 HB3 ASP 124 2HB ASP 124 114.018 -10.810 -6.327 882 H PHE 125 H PHE 125 111.750 -9.224 -9.380 883 HA PHE 125 HA PHE 125 112.434 -6.361 -9.546 884 HB2 PHE 125 1HB PHE 125 111.637 -6.239 -11.838 885 HB3 PHE 125 2HB PHE 125 112.980 -7.361 -11.723 886 HD1 PHE 125 HD1 PHE 125 112.576 -9.815 -11.863 887 HD2 PHE 125 HD2 PHE 125 109.437 -6.947 -12.481 888 HE1 PHE 125 HE1 PHE 125 111.182 -11.569 -12.927 889 HE2 PHE 125 HE2 PHE 125 108.044 -8.701 -13.545 890 HZ PHE 125 HZ PHE 125 108.916 -11.011 -13.769 891 H SER 126 H SER 126 110.671 -4.990 -9.346 892 HA SER 126 HA SER 126 108.004 -6.200 -9.114 893 HB2 SER 126 1HB SER 126 109.142 -4.443 -6.936 894 HB3 SER 126 2HB SER 126 107.607 -5.303 -6.931 895 HG SER 126 HG SER 126 108.673 -6.939 -6.167 896 H TYR 127 H TYR 127 106.278 -4.678 -9.207 897 HA TYR 127 HA TYR 127 107.034 -2.016 -10.257 898 HB2 TYR 127 1HB TYR 127 104.374 -3.440 -10.444 899 HB3 TYR 127 2HB TYR 127 104.816 -1.940 -11.234 900 HD1 TYR 127 HD1 TYR 127 106.586 -1.980 -13.047 901 HD2 TYR 127 HD2 TYR 127 104.865 -5.551 -11.394 902 HE1 TYR 127 HE1 TYR 127 107.384 -3.272 -15.007 903 HE2 TYR 127 HE2 TYR 127 105.664 -6.845 -13.354 904 HH TYR 127 HH TYR 127 106.266 -6.314 -15.782 905 H GLU 128 H GLU 128 106.705 -0.310 -8.942 906 HA GLU 128 HA GLU 128 104.991 -0.718 -6.552 907 HB2 GLU 128 1HB GLU 128 107.547 0.879 -6.807 908 HB3 GLU 128 2HB GLU 128 106.546 0.772 -5.359 909 HG2 GLU 128 1HG GLU 128 107.867 -1.577 -6.744 910 HG3 GLU 128 2HG GLU 128 108.458 -0.804 -5.278 911 H GLN 129 H GLN 129 103.518 0.763 -6.070 912 HA GLN 129 HA GLN 129 103.645 3.413 -7.366 913 HB2 GLN 129 1HB GLN 129 101.930 1.982 -8.486 914 HB3 GLN 129 2HB GLN 129 101.116 1.801 -6.930 915 HG2 GLN 129 1HG GLN 129 100.804 4.229 -6.786 916 HG3 GLN 129 2HG GLN 129 101.662 4.444 -8.308 917 HE21 GLN 129 1HE2 GLN 129 99.118 5.461 -8.260 918 HE22 GLN 129 2HE2 GLN 129 98.050 4.474 -9.135 919 H SER 130 H SER 130 103.164 5.119 -6.007 920 HA SER 130 HA SER 130 102.187 4.471 -3.296 921 HB2 SER 130 1HB SER 130 104.666 4.621 -3.244 922 HB3 SER 130 2HB SER 130 104.559 6.250 -3.901 923 HG SER 130 HG SER 130 103.386 5.320 -1.480 924 H ARG 131 H ARG 131 100.993 6.050 -2.309 925 HA ARG 131 HA ARG 131 100.341 8.437 -3.944 926 HB2 ARG 131 1HB ARG 131 98.584 6.842 -2.060 927 HB3 ARG 131 2HB ARG 131 98.113 8.355 -2.833 928 HG2 ARG 131 1HG ARG 131 98.525 7.301 -5.059 929 HG3 ARG 131 2HG ARG 131 98.857 5.774 -4.239 930 HD2 ARG 131 1HD ARG 131 96.257 7.327 -4.128 931 HD3 ARG 131 2HD ARG 131 96.530 5.824 -5.002 932 HE ARG 131 HE ARG 131 97.222 5.232 -2.418 933 HH11 ARG 131 1HH1 ARG 131 94.316 6.529 -3.902 934 HH12 ARG 131 2HH1 ARG 131 93.277 5.849 -2.696 935 HH21 ARG 131 1HH2 ARG 131 95.834 4.384 -0.893 936 HH22 ARG 131 2HH2 ARG 131 94.127 4.650 -1.012 937 H ILE 132 H ILE 132 100.907 10.300 -3.049 938 HA ILE 132 HA ILE 132 101.144 10.489 -0.108 939 HB ILE 132 HB ILE 132 103.079 11.686 -2.121 940 HG12 ILE 132 1HG1 ILE 132 103.539 9.489 -0.080 941 HG13 ILE 132 2HG1 ILE 132 103.297 9.203 -1.804 942 HG21 ILE 132 1HG2 ILE 132 103.197 11.621 0.908 943 HG22 ILE 132 2HG2 ILE 132 102.626 13.005 -0.022 944 HG23 ILE 132 3HG2 ILE 132 104.298 12.466 -0.181 945 HD11 ILE 132 3HD1 ILE 132 105.527 10.834 -0.555 946 HD12 ILE 132 1HD1 ILE 132 105.258 10.661 -2.289 947 HD13 ILE 132 2HD1 ILE 132 105.691 9.253 -1.320 948 H ARG 133 H ARG 133 99.324 11.673 0.186 949 HA ARG 133 HA ARG 133 97.423 12.749 -0.762 950 HB2 ARG 133 1HB ARG 133 99.379 14.789 0.289 951 HB3 ARG 133 2HB ARG 133 97.664 15.103 0.020 952 HG2 ARG 133 1HG ARG 133 97.123 13.192 1.540 953 HG3 ARG 133 2HG ARG 133 98.845 13.022 1.882 954 HD2 ARG 133 1HD ARG 133 97.153 15.476 2.422 955 HD3 ARG 133 2HD ARG 133 97.777 14.359 3.632 956 HE ARG 133 HE ARG 133 100.047 15.135 2.464 957 HH11 ARG 133 1HH1 ARG 133 97.317 17.091 3.496 958 HH12 ARG 133 2HH1 ARG 133 98.300 18.488 3.781 959 HH21 ARG 133 1HH2 ARG 133 101.258 16.968 2.850 960 HH22 ARG 133 2HH2 ARG 133 100.502 18.418 3.421 961 H SER 134 H SER 134 97.363 12.481 -3.022 962 HA SER 134 HA SER 134 96.727 13.476 -4.988 963 HB2 SER 134 1HB SER 134 97.880 16.064 -3.947 964 HB3 SER 134 2HB SER 134 96.794 15.855 -5.317 965 HG SER 134 HG SER 134 96.180 15.017 -2.676 966 H VAL 135 H VAL 135 99.952 13.271 -3.903 967 HA VAL 135 HA VAL 135 100.985 13.913 -6.586 968 HB VAL 135 HB VAL 135 102.499 13.291 -4.035 969 HG11 VAL 135 1HG1 VAL 135 103.406 14.414 -6.704 970 HG12 VAL 135 2HG1 VAL 135 103.736 12.785 -6.115 971 HG13 VAL 135 3HG1 VAL 135 104.429 14.180 -5.286 972 HG21 VAL 135 3HG2 VAL 135 101.218 15.412 -3.896 973 HG22 VAL 135 1HG2 VAL 135 101.956 15.946 -5.407 974 HG23 VAL 135 2HG2 VAL 135 102.954 15.711 -3.972 975 H ASP 136 H ASP 136 101.790 12.346 -7.903 976 HA ASP 136 HA ASP 136 101.285 9.563 -7.022 977 HB2 ASP 136 1HB ASP 136 99.983 10.391 -8.973 978 HB3 ASP 136 2HB ASP 136 101.497 10.657 -9.835 979 H VAL 137 H VAL 137 103.030 8.313 -6.628 980 HA VAL 137 HA VAL 137 105.591 9.053 -7.943 981 HB VAL 137 HB VAL 137 105.207 7.729 -5.245 982 HG11 VAL 137 1HG1 VAL 137 107.301 7.152 -6.501 983 HG12 VAL 137 2HG1 VAL 137 107.607 8.035 -5.005 984 HG13 VAL 137 3HG1 VAL 137 107.692 8.870 -6.556 985 HG21 VAL 137 3HG2 VAL 137 104.505 10.056 -5.119 986 HG22 VAL 137 1HG2 VAL 137 105.941 10.573 -6.005 987 HG23 VAL 137 2HG2 VAL 137 106.100 9.910 -4.379 988 H GLY 138 H GLY 138 106.573 7.531 -9.120 989 HA2 GLY 138 1HA GLY 138 105.625 4.728 -8.894 990 HA3 GLY 138 2HA GLY 138 106.055 5.478 -10.432 991 H THR 139 H THR 139 107.189 3.267 -8.430 992 HA THR 139 HA THR 139 110.018 4.112 -8.733 993 HB THR 139 HB THR 139 108.873 2.476 -6.460 994 HG1 THR 139 HG1 THR 139 108.784 4.294 -5.350 995 HG21 THR 139 3HG2 THR 139 111.575 3.811 -6.750 996 HG22 THR 139 1HG2 THR 139 111.285 2.115 -7.141 997 HG23 THR 139 2HG2 THR 139 111.063 2.690 -5.488 998 H TRP 140 H TRP 140 111.312 2.729 -9.734 999 HA TRP 140 HA TRP 140 110.354 -0.024 -10.237 1000 HB2 TRP 140 1HB TRP 140 112.406 1.675 -11.665 1001 HB3 TRP 140 2HB TRP 140 112.114 -0.016 -12.021 1002 HD1 TRP 140 HD1 TRP 140 110.189 3.333 -11.975 1003 HE1 TRP 140 HE1 TRP 140 108.427 3.268 -13.855 1004 HE3 TRP 140 HE3 TRP 140 110.879 -1.436 -13.663 1005 HZ2 TRP 140 HZ2 TRP 140 107.440 1.431 -15.820 1006 HZ3 TRP 140 HZ3 TRP 140 109.521 -2.316 -15.536 1007 HH2 TRP 140 HH2 TRP 140 107.804 -0.893 -16.616 1008 H ILE 141 H ILE 141 111.459 -1.705 -9.361 1009 HA ILE 141 HA ILE 141 114.018 -1.092 -7.987 1010 HB ILE 141 HB ILE 141 113.352 -2.640 -6.213 1011 HG12 ILE 141 1HG1 ILE 141 110.679 -3.048 -6.304 1012 HG13 ILE 141 2HG1 ILE 141 111.014 -3.050 -8.029 1013 HG21 ILE 141 1HG2 ILE 141 111.238 -1.205 -5.481 1014 HG22 ILE 141 2HG2 ILE 141 111.725 -0.214 -6.855 1015 HG23 ILE 141 3HG2 ILE 141 112.851 -0.500 -5.530 1016 HD11 ILE 141 3HD1 ILE 141 111.267 -5.217 -6.341 1017 HD12 ILE 141 1HD1 ILE 141 112.935 -4.673 -6.488 1018 HD13 ILE 141 2HD1 ILE 141 112.008 -5.081 -7.930 1019 H ALA 142 H ALA 142 115.660 -2.461 -8.301 1020 HA ALA 142 HA ALA 142 115.082 -5.210 -9.181 1021 HB1 ALA 142 1HB ALA 142 116.517 -5.153 -11.024 1022 HB2 ALA 142 2HB ALA 142 117.350 -3.706 -10.456 1023 HB3 ALA 142 3HB ALA 142 115.723 -3.581 -11.126 1024 H GLY 143 H GLY 143 116.408 -6.716 -8.215 1025 HA2 GLY 143 1HA GLY 143 118.936 -5.875 -7.028 1026 HA3 GLY 143 2HA GLY 143 117.682 -6.323 -5.878 1027 H VAL 144 H VAL 144 119.723 -7.804 -5.551 1028 HA VAL 144 HA VAL 144 119.141 -10.362 -6.909 1029 HB VAL 144 HB VAL 144 121.565 -10.867 -6.917 1030 HG11 VAL 144 1HG1 VAL 144 120.566 -8.411 -8.364 1031 HG12 VAL 144 2HG1 VAL 144 120.738 -10.053 -8.987 1032 HG13 VAL 144 3HG1 VAL 144 122.171 -9.076 -8.669 1033 HG21 VAL 144 3HG2 VAL 144 121.789 -7.983 -5.999 1034 HG22 VAL 144 1HG2 VAL 144 123.145 -8.959 -6.561 1035 HG23 VAL 144 2HG2 VAL 144 122.284 -9.411 -5.091 1036 H GLY 145 H GLY 145 119.709 -12.242 -5.631 1037 HA2 GLY 145 1HA GLY 145 120.146 -11.723 -2.764 1038 HA3 GLY 145 2HA GLY 145 118.704 -12.602 -3.259 1039 H TYR 146 H TYR 146 120.747 -13.592 -1.550 1040 HA TYR 146 HA TYR 146 121.594 -15.937 -3.137 1041 HB2 TYR 146 1HB TYR 146 123.528 -14.436 -2.664 1042 HB3 TYR 146 2HB TYR 146 123.206 -14.613 -0.950 1043 HD1 TYR 146 HD1 TYR 146 124.322 -16.351 -4.018 1044 HD2 TYR 146 HD2 TYR 146 123.842 -16.610 0.243 1045 HE1 TYR 146 HE1 TYR 146 125.723 -18.397 -3.984 1046 HE2 TYR 146 HE2 TYR 146 125.244 -18.656 0.276 1047 HH TYR 146 HH TYR 146 125.973 -20.427 -2.450 1048 H ARG 147 H ARG 147 121.393 -17.906 -2.081 1049 HA ARG 147 HA ARG 147 119.860 -17.809 0.452 1050 HB2 ARG 147 1HB ARG 147 119.927 -19.916 -1.722 1051 HB3 ARG 147 2HB ARG 147 118.981 -20.015 -0.237 1052 HG2 ARG 147 1HG ARG 147 117.817 -17.908 -0.870 1053 HG3 ARG 147 2HG ARG 147 118.709 -17.900 -2.392 1054 HD2 ARG 147 1HD ARG 147 117.761 -20.188 -2.864 1055 HD3 ARG 147 2HD ARG 147 116.738 -19.995 -1.444 1056 HE ARG 147 HE ARG 147 116.126 -17.777 -2.797 1057 HH11 ARG 147 1HH1 ARG 147 116.433 -21.069 -3.981 1058 HH12 ARG 147 2HH1 ARG 147 115.287 -20.821 -5.257 1059 HH21 ARG 147 1HH2 ARG 147 114.661 -17.521 -4.457 1060 HH22 ARG 147 2HH2 ARG 147 114.297 -18.838 -5.521 1061 H PHE 148 H PHE 148 120.488 -19.020 2.180 1062 HA PHE 148 HA PHE 148 122.703 -20.911 1.903 1063 HB2 PHE 148 1HB PHE 148 123.728 -18.678 2.296 1064 HB3 PHE 148 2HB PHE 148 122.830 -18.563 3.797 1065 HD1 PHE 148 HD1 PHE 148 123.443 -19.922 5.739 1066 HD2 PHE 148 HD2 PHE 148 125.625 -20.185 2.048 1067 HE1 PHE 148 HE1 PHE 148 125.275 -21.117 6.907 1068 HE2 PHE 148 HE2 PHE 148 127.457 -21.382 3.216 1069 HZ PHE 148 HZ PHE 148 127.282 -21.847 5.646 Start of MODEL 9 1 H1 ALA 1 3H ALA 1 115.096 -21.794 8.375 2 H2 ALA 1 2H ALA 1 116.253 -21.523 9.590 3 H3 ALA 1 HT3 ALA 1 115.040 -22.691 9.814 4 HA ALA 1 HA ALA 1 117.238 -23.648 9.255 5 HB1 ALA 1 2HB ALA 1 114.771 -24.043 7.587 6 HB2 ALA 1 3HB ALA 1 115.481 -25.116 8.793 7 HB3 ALA 1 1HB ALA 1 116.231 -24.954 7.206 8 H THR 2 H THR 2 115.696 -21.742 6.681 9 HA THR 2 HA THR 2 118.352 -21.440 5.395 10 HB THR 2 HB THR 2 115.657 -21.453 4.015 11 HG1 THR 2 HG1 THR 2 115.919 -23.517 3.821 12 HG21 THR 2 3HG2 THR 2 117.360 -21.834 2.043 13 HG22 THR 2 1HG2 THR 2 118.506 -21.079 3.150 14 HG23 THR 2 2HG2 THR 2 117.062 -20.202 2.642 15 H SER 3 H SER 3 118.953 -19.401 4.780 16 HA SER 3 HA SER 3 117.059 -17.194 5.339 17 HB2 SER 3 1HB SER 3 118.695 -17.444 7.201 18 HB3 SER 3 2HB SER 3 120.004 -17.230 6.043 19 HG SER 3 HG SER 3 119.638 -15.209 6.704 20 H THR 4 H THR 4 117.183 -15.442 3.970 21 HA THR 4 HA THR 4 119.137 -15.605 1.750 22 HB THR 4 HB THR 4 117.394 -14.867 0.207 23 HG1 THR 4 HG1 THR 4 116.127 -13.743 1.724 24 HG21 THR 4 3HG2 THR 4 116.433 -17.240 1.827 25 HG22 THR 4 1HG2 THR 4 117.738 -17.309 0.642 26 HG23 THR 4 2HG2 THR 4 116.097 -16.918 0.126 27 H VAL 5 H VAL 5 120.170 -13.754 1.287 28 HA VAL 5 HA VAL 5 119.229 -11.269 2.620 29 HB VAL 5 HB VAL 5 122.072 -12.027 1.880 30 HG11 VAL 5 1HG1 VAL 5 122.630 -10.021 3.239 31 HG12 VAL 5 2HG1 VAL 5 120.908 -9.687 3.422 32 HG13 VAL 5 3HG1 VAL 5 121.657 -9.609 1.827 33 HG21 VAL 5 3HG2 VAL 5 121.266 -13.390 3.751 34 HG22 VAL 5 1HG2 VAL 5 120.659 -11.949 4.566 35 HG23 VAL 5 2HG2 VAL 5 122.394 -12.173 4.348 36 H THR 6 H THR 6 118.742 -9.612 1.292 37 HA THR 6 HA THR 6 119.650 -9.740 -1.519 38 HB THR 6 HB THR 6 116.816 -9.118 -0.671 39 HG1 THR 6 HG1 THR 6 118.097 -11.493 -1.430 40 HG21 THR 6 3HG2 THR 6 118.079 -9.663 -3.370 41 HG22 THR 6 1HG2 THR 6 117.555 -8.086 -2.782 42 HG23 THR 6 2HG2 THR 6 116.368 -9.354 -3.081 43 H GLY 7 H GLY 7 119.874 -7.764 -2.560 44 HA2 GLY 7 1HA GLY 7 119.042 -5.337 -1.119 45 HA3 GLY 7 2HA GLY 7 120.733 -5.482 -1.601 46 H GLY 8 H GLY 8 118.699 -3.536 -2.527 47 HA2 GLY 8 1HA GLY 8 119.175 -3.873 -5.378 48 HA3 GLY 8 2HA GLY 8 117.485 -3.921 -4.895 49 H TYR 9 H TYR 9 118.188 -2.051 -6.625 50 HA TYR 9 HA TYR 9 118.181 0.461 -5.068 51 HB2 TYR 9 1HB TYR 9 119.492 1.535 -6.765 52 HB3 TYR 9 2HB TYR 9 120.345 0.102 -6.230 53 HD1 TYR 9 HD1 TYR 9 120.455 -1.908 -7.703 54 HD2 TYR 9 HD2 TYR 9 118.704 1.788 -9.015 55 HE1 TYR 9 HE1 TYR 9 120.604 -2.673 -10.056 56 HE2 TYR 9 HE2 TYR 9 118.853 1.022 -11.369 57 HH TYR 9 HH TYR 9 120.749 -1.304 -12.427 58 H ALA 10 H ALA 10 116.752 2.036 -5.749 59 HA ALA 10 HA ALA 10 115.119 1.471 -8.136 60 HB1 ALA 10 1HB ALA 10 113.736 2.461 -5.679 61 HB2 ALA 10 2HB ALA 10 114.115 0.743 -5.794 62 HB3 ALA 10 3HB ALA 10 113.102 1.505 -7.020 63 H GLN 11 H GLN 11 114.385 3.251 -9.206 64 HA GLN 11 HA GLN 11 115.091 5.909 -8.102 65 HB2 GLN 11 1HB GLN 11 114.938 4.990 -10.987 66 HB3 GLN 11 2HB GLN 11 115.220 6.654 -10.473 67 HG2 GLN 11 1HG GLN 11 117.265 5.987 -9.315 68 HG3 GLN 11 2HG GLN 11 116.973 4.298 -9.723 69 HE21 GLN 11 1HE2 GLN 11 119.367 5.646 -10.539 70 HE22 GLN 11 2HE2 GLN 11 119.347 5.786 -12.230 71 H SER 12 H SER 12 113.494 7.524 -8.179 72 HA SER 12 HA SER 12 110.782 6.520 -8.867 73 HB2 SER 12 1HB SER 12 111.563 8.346 -6.584 74 HB3 SER 12 2HB SER 12 109.940 7.783 -6.962 75 HG SER 12 HG SER 12 112.164 6.109 -6.385 76 H ASP 13 H ASP 13 109.463 7.825 -9.967 77 HA ASP 13 HA ASP 13 110.456 10.505 -10.729 78 HB2 ASP 13 1HB ASP 13 108.548 8.645 -12.174 79 HB3 ASP 13 2HB ASP 13 108.988 10.264 -12.714 80 H ALA 14 H ALA 14 109.095 12.254 -10.462 81 HA ALA 14 HA ALA 14 106.774 11.757 -8.720 82 HB1 ALA 14 1HB ALA 14 107.260 13.704 -7.613 83 HB2 ALA 14 2HB ALA 14 107.932 14.484 -9.046 84 HB3 ALA 14 3HB ALA 14 108.885 13.295 -8.159 85 H GLN 15 H GLN 15 105.036 11.617 -9.932 86 HA GLN 15 HA GLN 15 104.584 13.314 -12.239 87 HB2 GLN 15 1HB GLN 15 102.820 11.294 -10.836 88 HB3 GLN 15 2HB GLN 15 102.365 12.161 -12.303 89 HG2 GLN 15 1HG GLN 15 104.276 11.213 -13.495 90 HG3 GLN 15 2HG GLN 15 104.819 10.404 -12.028 91 HE21 GLN 15 1HE2 GLN 15 104.203 8.933 -14.407 92 HE22 GLN 15 2HE2 GLN 15 102.825 7.987 -14.105 93 H GLY 16 H GLY 16 103.743 15.236 -12.174 94 HA2 GLY 16 1HA GLY 16 102.370 17.011 -11.526 95 HA3 GLY 16 2HA GLY 16 101.887 16.099 -10.103 96 H GLN 17 H GLN 17 104.951 15.639 -9.654 97 HA GLN 17 HA GLN 17 105.640 18.357 -8.708 98 HB2 GLN 17 1HB GLN 17 105.368 16.673 -6.891 99 HB3 GLN 17 2HB GLN 17 106.644 15.710 -7.635 100 HG2 GLN 17 1HG GLN 17 108.228 17.563 -7.377 101 HG3 GLN 17 2HG GLN 17 106.960 18.570 -6.684 102 HE21 GLN 17 1HE2 GLN 17 109.168 18.225 -5.096 103 HE22 GLN 17 2HE2 GLN 17 108.842 17.147 -3.826 104 H MET 18 H MET 18 107.768 19.107 -9.139 105 HA MET 18 HA MET 18 109.148 17.645 -11.289 106 HB2 MET 18 1HB MET 18 109.518 20.448 -10.208 107 HB3 MET 18 2HB MET 18 110.460 19.749 -11.526 108 HG2 MET 18 1HG MET 18 108.302 19.327 -12.751 109 HG3 MET 18 2HG MET 18 107.468 20.230 -11.486 110 HE1 MET 18 3HE MET 18 108.924 23.750 -11.668 111 HE2 MET 18 1HE MET 18 109.793 22.474 -10.807 112 HE3 MET 18 2HE MET 18 108.033 22.534 -10.756 113 H ASN 19 H ASN 19 110.305 16.039 -10.294 114 HA ASN 19 HA ASN 19 112.762 16.647 -9.060 115 HB2 ASN 19 1HB ASN 19 111.306 17.262 -7.134 116 HB3 ASN 19 2HB ASN 19 110.666 15.622 -7.131 117 HD21 ASN 19 1HD2 ASN 19 113.816 17.366 -6.928 118 HD22 ASN 19 2HD2 ASN 19 114.539 16.227 -5.897 119 H LYS 20 H LYS 20 113.990 14.778 -8.533 120 HA LYS 20 HA LYS 20 112.739 12.167 -9.132 121 HB2 LYS 20 1HB LYS 20 115.484 13.121 -9.994 122 HB3 LYS 20 2HB LYS 20 114.888 11.470 -10.171 123 HG2 LYS 20 1HG LYS 20 112.993 12.339 -11.540 124 HG3 LYS 20 2HG LYS 20 113.698 13.953 -11.440 125 HD2 LYS 20 1HD LYS 20 115.789 13.058 -12.475 126 HD3 LYS 20 2HD LYS 20 114.982 11.503 -12.679 127 HE2 LYS 20 1HE LYS 20 114.857 12.849 -14.748 128 HE3 LYS 20 2HE LYS 20 113.253 12.570 -14.070 129 HZ1 LYS 20 3HZ LYS 20 113.058 14.727 -13.391 130 HZ2 LYS 20 1HZ LYS 20 113.992 14.948 -14.791 131 HZ3 LYS 20 2HZ LYS 20 114.734 14.969 -13.263 132 H MET 21 H MET 21 113.542 10.409 -7.864 133 HA MET 21 HA MET 21 115.303 11.209 -5.613 134 HB2 MET 21 1HB MET 21 112.697 9.683 -5.429 135 HB3 MET 21 2HB MET 21 113.833 9.902 -4.097 136 HG2 MET 21 1HG MET 21 113.614 12.389 -4.413 137 HG3 MET 21 2HG MET 21 112.334 12.076 -5.584 138 HE1 MET 21 3HE MET 21 109.495 10.613 -3.890 139 HE2 MET 21 1HE MET 21 110.754 9.373 -3.845 140 HE3 MET 21 2HE MET 21 110.626 10.452 -5.232 141 H GLY 22 H GLY 22 116.343 9.419 -4.525 142 HA2 GLY 22 1HA GLY 22 116.354 6.877 -6.026 143 HA3 GLY 22 2HA GLY 22 117.881 7.723 -5.773 144 H GLY 23 H GLY 23 116.628 5.093 -4.726 145 HA2 GLY 23 1HA GLY 23 117.600 5.455 -1.990 146 HA3 GLY 23 2HA GLY 23 115.937 4.913 -2.171 147 H PHE 24 H PHE 24 117.736 3.394 -0.817 148 HA PHE 24 HA PHE 24 118.090 1.057 -2.604 149 HB2 PHE 24 1HB PHE 24 119.909 1.923 -0.349 150 HB3 PHE 24 2HB PHE 24 120.053 0.424 -1.246 151 HD1 PHE 24 HD2 PHE 24 120.884 0.408 -3.548 152 HD2 PHE 24 HD1 PHE 24 120.517 4.068 -1.330 153 HE1 PHE 24 HE2 PHE 24 122.299 1.566 -5.225 154 HE2 PHE 24 HE1 PHE 24 121.931 5.226 -3.006 155 HZ PHE 24 HZ PHE 24 122.822 3.975 -4.954 156 H ASN 25 H ASN 25 117.792 -1.014 -1.535 157 HA ASN 25 HA ASN 25 116.576 -0.893 1.134 158 HB2 ASN 25 1HB ASN 25 114.625 -2.225 0.351 159 HB3 ASN 25 2HB ASN 25 114.675 -0.594 -0.314 160 HD21 ASN 25 1HD2 ASN 25 113.293 -1.500 -2.105 161 HD22 ASN 25 2HD2 ASN 25 114.042 -2.347 -3.370 162 H LEU 26 H LEU 26 116.557 -2.815 2.271 163 HA LEU 26 HA LEU 26 117.934 -5.118 1.013 164 HB2 LEU 26 1HB LEU 26 118.142 -4.224 3.901 165 HB3 LEU 26 2HB LEU 26 118.956 -5.610 3.177 166 HG LEU 26 HG LEU 26 119.349 -2.730 2.307 167 HD11 LEU 26 1HD1 LEU 26 121.009 -4.573 4.048 168 HD12 LEU 26 2HD1 LEU 26 120.311 -3.019 4.502 169 HD13 LEU 26 3HD1 LEU 26 121.632 -3.085 3.336 170 HD21 LEU 26 3HD2 LEU 26 120.521 -5.382 1.460 171 HD22 LEU 26 1HD2 LEU 26 121.408 -3.877 1.219 172 HD23 LEU 26 2HD2 LEU 26 119.840 -4.109 0.445 173 H LYS 27 H LYS 27 116.966 -7.097 1.313 174 HA LYS 27 HA LYS 27 114.435 -7.096 2.863 175 HB2 LYS 27 1HB LYS 27 115.036 -8.553 0.280 176 HB3 LYS 27 2HB LYS 27 113.518 -8.608 1.174 177 HG2 LYS 27 1HG LYS 27 113.375 -6.100 0.920 178 HG3 LYS 27 2HG LYS 27 114.758 -6.195 -0.170 179 HD2 LYS 27 1HD LYS 27 112.147 -7.685 -0.561 180 HD3 LYS 27 2HD LYS 27 112.589 -6.197 -1.394 181 HE2 LYS 27 1HE LYS 27 114.789 -7.715 -1.941 182 HE3 LYS 27 2HE LYS 27 113.550 -8.967 -1.834 183 HZ1 LYS 27 3HZ LYS 27 113.460 -8.298 -4.029 184 HZ2 LYS 27 1HZ LYS 27 113.694 -6.658 -3.660 185 HZ3 LYS 27 2HZ LYS 27 112.203 -7.400 -3.321 186 H TYR 28 H TYR 28 114.044 -8.745 4.195 187 HA TYR 28 HA TYR 28 115.930 -11.035 4.220 188 HB2 TYR 28 1HB TYR 28 114.520 -9.753 6.566 189 HB3 TYR 28 2HB TYR 28 115.571 -11.155 6.643 190 HD1 TYR 28 HD1 TYR 28 118.022 -10.890 6.095 191 HD2 TYR 28 HD2 TYR 28 115.375 -7.539 6.561 192 HE1 TYR 28 HE1 TYR 28 119.974 -9.390 6.397 193 HE2 TYR 28 HE2 TYR 28 117.327 -6.040 6.864 194 HH TYR 28 HH TYR 28 120.521 -7.253 7.333 195 H ARG 29 H ARG 29 115.043 -13.070 4.354 196 HA ARG 29 HA ARG 29 112.098 -13.259 4.513 197 HB2 ARG 29 1HB ARG 29 112.860 -13.287 2.136 198 HB3 ARG 29 2HB ARG 29 113.813 -14.726 2.501 199 HG2 ARG 29 1HG ARG 29 111.791 -15.937 3.161 200 HG3 ARG 29 2HG ARG 29 110.814 -14.494 2.884 201 HD2 ARG 29 1HD ARG 29 110.604 -15.888 0.929 202 HD3 ARG 29 2HD ARG 29 111.609 -14.508 0.494 203 HE ARG 29 HE ARG 29 113.297 -16.574 1.374 204 HH11 ARG 29 1HH1 ARG 29 111.145 -15.928 -1.324 205 HH12 ARG 29 2HH1 ARG 29 112.038 -16.942 -2.408 206 HH21 ARG 29 1HH2 ARG 29 114.404 -17.865 -0.068 207 HH22 ARG 29 2HH2 ARG 29 113.861 -18.024 -1.704 208 H TYR 30 H TYR 30 111.294 -15.004 5.564 209 HA TYR 30 HA TYR 30 113.235 -16.993 6.600 210 HB2 TYR 30 1HB TYR 30 110.727 -15.962 7.930 211 HB3 TYR 30 2HB TYR 30 111.813 -17.174 8.583 212 HD1 TYR 30 HD1 TYR 30 114.162 -16.513 9.222 213 HD2 TYR 30 HD2 TYR 30 111.156 -13.636 8.152 214 HE1 TYR 30 HE1 TYR 30 115.503 -14.717 10.285 215 HE2 TYR 30 HE2 TYR 30 112.497 -11.841 9.214 216 HH TYR 30 HH TYR 30 115.758 -12.334 10.223 217 H GLU 31 H GLU 31 112.653 -19.143 6.522 218 HA GLU 31 HA GLU 31 110.034 -19.796 5.309 219 HB2 GLU 31 1HB GLU 31 111.854 -19.795 3.591 220 HB3 GLU 31 2HB GLU 31 112.666 -21.059 4.515 221 HG2 GLU 31 1HG GLU 31 110.627 -22.472 4.318 222 HG3 GLU 31 2HG GLU 31 109.887 -21.229 3.318 223 H GLU 32 H GLU 32 109.100 -21.704 5.967 224 HA GLU 32 HA GLU 32 110.380 -23.059 8.246 225 HB2 GLU 32 1HB GLU 32 108.055 -22.147 8.499 226 HB3 GLU 32 2HB GLU 32 107.528 -23.300 7.272 227 HG2 GLU 32 1HG GLU 32 108.417 -25.154 8.676 228 HG3 GLU 32 2HG GLU 32 108.838 -23.983 9.918 229 H ASP 33 H ASP 33 110.763 -25.267 8.243 230 HA ASP 33 HA ASP 33 111.476 -26.322 5.709 231 HB2 ASP 33 1HB ASP 33 111.333 -27.665 8.412 232 HB3 ASP 33 2HB ASP 33 112.117 -28.338 6.984 233 H ASN 34 H ASN 34 108.813 -27.179 7.951 234 HA ASN 34 HA ASN 34 107.887 -29.150 5.953 235 HB2 ASN 34 1HB ASN 34 106.644 -30.178 7.752 236 HB3 ASN 34 2HB ASN 34 108.325 -29.971 8.232 237 HD21 ASN 34 1HD2 ASN 34 106.242 -30.245 10.178 238 HD22 ASN 34 2HD2 ASN 34 106.093 -28.772 11.009 239 H SER 35 H SER 35 107.043 -26.047 7.167 240 HA SER 35 HA SER 35 104.608 -26.143 5.553 241 HB2 SER 35 1HB SER 35 104.636 -25.387 8.483 242 HB3 SER 35 2HB SER 35 103.316 -24.999 7.386 243 HG SER 35 HG SER 35 102.657 -26.971 7.650 244 HA PRO 36 HA PRO 36 107.354 -22.422 5.368 245 HB2 PRO 36 1HB PRO 36 107.609 -22.175 2.674 246 HB3 PRO 36 2HB PRO 36 108.590 -23.299 3.634 247 HG2 PRO 36 1HG PRO 36 106.214 -23.841 1.936 248 HG3 PRO 36 2HG PRO 36 107.684 -24.806 2.169 249 HD2 PRO 36 1HD PRO 36 105.283 -25.349 3.412 250 HD3 PRO 36 2HD PRO 36 106.866 -25.842 4.049 251 H LEU 37 H LEU 37 106.622 -20.439 5.517 252 HA LEU 37 HA LEU 37 104.522 -19.481 3.668 253 HB2 LEU 37 1HB LEU 37 103.688 -19.680 6.025 254 HB3 LEU 37 2HB LEU 37 104.959 -18.564 6.528 255 HG LEU 37 HG LEU 37 104.037 -16.931 4.804 256 HD11 LEU 37 1HD1 LEU 37 101.552 -17.389 4.324 257 HD12 LEU 37 2HD1 LEU 37 101.893 -19.059 4.775 258 HD13 LEU 37 3HD1 LEU 37 102.723 -18.330 3.401 259 HD21 LEU 37 3HD2 LEU 37 103.560 -16.441 7.072 260 HD22 LEU 37 1HD2 LEU 37 102.487 -17.832 7.234 261 HD23 LEU 37 2HD2 LEU 37 101.979 -16.430 6.292 262 H GLY 38 H GLY 38 105.033 -17.497 2.634 263 HA2 GLY 38 1HA GLY 38 107.880 -16.828 2.899 264 HA3 GLY 38 2HA GLY 38 106.836 -16.409 1.544 265 H VAL 39 H VAL 39 108.377 -15.192 4.220 266 HA VAL 39 HA VAL 39 106.591 -12.816 4.237 267 HB VAL 39 HB VAL 39 108.357 -13.808 6.496 268 HG11 VAL 39 1HG1 VAL 39 107.000 -12.069 7.764 269 HG12 VAL 39 2HG1 VAL 39 106.429 -11.491 6.199 270 HG13 VAL 39 3HG1 VAL 39 108.146 -11.418 6.592 271 HG21 VAL 39 3HG2 VAL 39 105.979 -14.037 7.568 272 HG22 VAL 39 1HG2 VAL 39 106.555 -15.314 6.497 273 HG23 VAL 39 2HG2 VAL 39 105.420 -14.105 5.897 274 H ILE 40 H ILE 40 107.510 -11.008 3.552 275 HA ILE 40 HA ILE 40 110.474 -10.833 3.516 276 HB ILE 40 HB ILE 40 108.542 -9.652 1.502 277 HG12 ILE 40 1HG1 ILE 40 110.518 -11.930 1.169 278 HG13 ILE 40 2HG1 ILE 40 108.783 -12.154 1.391 279 HG21 ILE 40 1HG2 ILE 40 110.660 -8.371 1.916 280 HG22 ILE 40 2HG2 ILE 40 110.549 -9.020 0.280 281 HG23 ILE 40 3HG2 ILE 40 111.571 -9.816 1.477 282 HD11 ILE 40 3HD1 ILE 40 110.241 -10.931 -0.940 283 HD12 ILE 40 1HD1 ILE 40 108.557 -10.513 -0.624 284 HD13 ILE 40 2HD1 ILE 40 109.005 -12.188 -0.944 285 H GLY 41 H GLY 41 111.285 -9.188 4.608 286 HA2 GLY 41 1HA GLY 41 109.584 -6.802 5.097 287 HA3 GLY 41 2HA GLY 41 110.740 -7.420 6.280 288 H SER 42 H SER 42 110.408 -4.910 4.365 289 HA SER 42 HA SER 42 113.248 -4.857 3.520 290 HB2 SER 42 1HB SER 42 111.625 -5.171 1.609 291 HB3 SER 42 2HB SER 42 110.962 -3.591 2.007 292 HG SER 42 HG SER 42 112.522 -3.102 0.597 293 H PHE 43 H PHE 43 114.375 -3.087 4.061 294 HA PHE 43 HA PHE 43 112.898 -0.750 5.135 295 HB2 PHE 43 1HB PHE 43 114.425 -1.903 6.733 296 HB3 PHE 43 2HB PHE 43 115.760 -1.586 5.641 297 HD1 PHE 43 HD1 PHE 43 116.666 0.672 5.381 298 HD2 PHE 43 HD2 PHE 43 113.397 -0.129 8.049 299 HE1 PHE 43 HE1 PHE 43 117.001 2.882 6.455 300 HE2 PHE 43 HE2 PHE 43 113.730 2.081 9.123 301 HZ PHE 43 HZ PHE 43 115.533 3.587 8.325 302 H THR 44 H THR 44 112.974 1.051 3.891 303 HA THR 44 HA THR 44 115.039 1.149 1.755 304 HB THR 44 HB THR 44 112.229 2.264 1.647 305 HG1 THR 44 HG1 THR 44 112.004 0.102 1.559 306 HG21 THR 44 3HG2 THR 44 114.023 3.353 0.243 307 HG22 THR 44 1HG2 THR 44 112.707 2.636 -0.687 308 HG23 THR 44 2HG2 THR 44 114.253 1.798 -0.557 309 H TYR 45 H TYR 45 116.218 2.929 1.554 310 HA TYR 45 HA TYR 45 115.457 5.341 3.102 311 HB2 TYR 45 1HB TYR 45 117.478 4.230 3.986 312 HB3 TYR 45 2HB TYR 45 118.219 4.325 2.401 313 HD1 TYR 45 HD1 TYR 45 119.044 6.459 1.524 314 HD2 TYR 45 HD2 TYR 45 117.226 6.186 5.403 315 HE1 TYR 45 HE1 TYR 45 119.934 8.702 2.098 316 HE2 TYR 45 HE2 TYR 45 118.114 8.430 5.980 317 HH TYR 45 HH TYR 45 120.438 10.051 3.983 318 H THR 46 H THR 46 115.002 7.052 1.831 319 HA THR 46 HA THR 46 116.155 7.121 -0.902 320 HB THR 46 HB THR 46 113.364 7.955 -0.104 321 HG1 THR 46 HG1 THR 46 113.070 5.878 -0.210 322 HG21 THR 46 3HG2 THR 46 113.976 9.226 -1.992 323 HG22 THR 46 1HG2 THR 46 113.151 7.831 -2.686 324 HG23 THR 46 2HG2 THR 46 114.913 7.904 -2.688 325 H GLU 47 H GLU 47 116.731 9.103 -1.697 326 HA GLU 47 HA GLU 47 116.532 11.410 0.144 327 HB2 GLU 47 1HB GLU 47 118.794 10.316 0.213 328 HB3 GLU 47 2HB GLU 47 118.965 10.680 -1.504 329 HG2 GLU 47 1HG GLU 47 118.629 13.093 -0.996 330 HG3 GLU 47 2HG GLU 47 118.550 12.702 0.716 331 H LYS 48 H LYS 48 116.413 13.429 -0.847 332 HA LYS 48 HA LYS 48 115.278 13.374 -3.527 333 HB2 LYS 48 1HB LYS 48 114.225 14.654 -1.658 334 HB3 LYS 48 2HB LYS 48 115.640 15.707 -1.633 335 HG2 LYS 48 1HG LYS 48 115.225 16.272 -4.023 336 HG3 LYS 48 2HG LYS 48 113.759 15.292 -3.973 337 HD2 LYS 48 1HD LYS 48 112.930 16.722 -2.089 338 HD3 LYS 48 2HD LYS 48 114.338 17.760 -2.314 339 HE2 LYS 48 1HE LYS 48 113.649 18.187 -4.648 340 HE3 LYS 48 2HE LYS 48 112.232 17.164 -4.412 341 HZ1 LYS 48 3HZ LYS 48 111.705 18.699 -2.481 342 HZ2 LYS 48 1HZ LYS 48 111.480 19.326 -4.040 343 HZ3 LYS 48 2HZ LYS 48 112.855 19.760 -3.142 344 H SER 49 H SER 49 116.184 14.234 -5.329 345 HA SER 49 HA SER 49 119.012 14.934 -5.200 346 HB2 SER 49 1HB SER 49 119.001 14.712 -7.587 347 HB3 SER 49 2HB SER 49 118.043 13.382 -6.945 348 HG SER 49 HG SER 49 117.234 14.913 -8.755 349 H ARG 50 H ARG 50 119.876 16.881 -6.017 350 HA ARG 50 HA ARG 50 118.013 19.155 -5.796 351 HB2 ARG 50 1HB ARG 50 119.990 19.064 -4.272 352 HB3 ARG 50 2HB ARG 50 121.037 19.158 -5.689 353 HG2 ARG 50 1HG ARG 50 120.056 21.312 -6.311 354 HG3 ARG 50 2HG ARG 50 118.938 21.218 -4.950 355 HD2 ARG 50 1HD ARG 50 120.772 22.629 -4.277 356 HD3 ARG 50 2HD ARG 50 120.935 21.099 -3.419 357 HE ARG 50 HE ARG 50 122.385 21.190 -5.917 358 HH11 ARG 50 1HH1 ARG 50 122.574 21.929 -2.491 359 HH12 ARG 50 2HH1 ARG 50 124.306 21.865 -2.471 360 HH21 ARG 50 1HH2 ARG 50 124.612 21.122 -5.831 361 HH22 ARG 50 2HH2 ARG 50 125.443 21.414 -4.340 362 H THR 51 H THR 51 117.694 20.559 -7.427 363 HA THR 51 HA THR 51 119.410 20.393 -9.815 364 HB THR 51 HB THR 51 117.416 19.013 -10.240 365 HG1 THR 51 HG1 THR 51 117.534 21.501 -11.584 366 HG21 THR 51 3HG2 THR 51 115.196 19.964 -10.245 367 HG22 THR 51 1HG2 THR 51 115.830 21.563 -9.859 368 HG23 THR 51 2HG2 THR 51 115.914 20.271 -8.664 369 H ALA 52 H ALA 52 119.577 22.312 -11.005 370 HA ALA 52 HA ALA 52 118.910 24.706 -9.460 371 HB1 ALA 52 1HB ALA 52 120.298 25.770 -11.398 372 HB2 ALA 52 2HB ALA 52 120.766 24.105 -11.741 373 HB3 ALA 52 3HB ALA 52 121.129 24.816 -10.169 374 H SER 53 H SER 53 117.196 25.914 -9.902 375 HA SER 53 HA SER 53 116.393 26.660 -12.507 376 HB2 SER 53 1HB SER 53 115.587 24.197 -12.305 377 HB3 SER 53 2HB SER 53 114.366 24.848 -11.220 378 HG SER 53 HG SER 53 113.857 24.742 -13.557 379 H SER 54 H SER 54 114.552 25.839 -9.557 380 HA SER 54 HA SER 54 113.105 28.269 -9.516 381 HB2 SER 54 1HB SER 54 112.360 27.574 -7.315 382 HB3 SER 54 2HB SER 54 112.395 26.174 -8.382 383 HG SER 54 HG SER 54 113.795 25.325 -7.073 384 H GLY 55 H GLY 55 116.182 27.327 -8.073 385 HA2 GLY 55 1HA GLY 55 117.873 28.916 -7.549 386 HA3 GLY 55 2HA GLY 55 116.628 30.135 -7.336 387 H ASP 56 H ASP 56 115.339 27.635 -5.690 388 HA ASP 56 HA ASP 56 116.609 28.472 -3.158 389 HB2 ASP 56 1HB ASP 56 114.545 27.655 -2.085 390 HB3 ASP 56 2HB ASP 56 114.220 28.915 -3.268 391 H TYR 57 H TYR 57 116.673 26.759 -1.445 392 HA TYR 57 HA TYR 57 117.453 24.150 -2.623 393 HB2 TYR 57 1HB TYR 57 118.507 25.519 -0.146 394 HB3 TYR 57 2HB TYR 57 118.994 23.936 -0.719 395 HD1 TYR 57 HD2 TYR 57 120.433 23.696 -2.684 396 HD2 TYR 57 HD1 TYR 57 119.226 27.564 -1.259 397 HE1 TYR 57 HE2 TYR 57 122.180 24.757 -4.087 398 HE2 TYR 57 HE1 TYR 57 120.973 28.627 -2.662 399 HH TYR 57 HH TYR 57 123.149 27.970 -3.696 400 H ASN 58 H ASN 58 116.351 22.421 -1.967 401 HA ASN 58 HA ASN 58 115.097 22.406 0.682 402 HB2 ASN 58 1HB ASN 58 113.436 23.242 -1.064 403 HB3 ASN 58 2HB ASN 58 113.517 21.629 -1.770 404 HD21 ASN 58 1HD2 ASN 58 111.218 21.302 -1.166 405 HD22 ASN 58 2HD2 ASN 58 110.803 20.958 0.444 406 H LYS 59 H LYS 59 115.848 20.616 1.617 407 HA LYS 59 HA LYS 59 116.400 18.244 -0.051 408 HB2 LYS 59 1HB LYS 59 117.283 18.961 2.755 409 HB3 LYS 59 2HB LYS 59 117.684 17.455 1.929 410 HG2 LYS 59 1HG LYS 59 118.746 18.784 0.103 411 HG3 LYS 59 2HG LYS 59 118.433 20.253 1.028 412 HD2 LYS 59 1HD LYS 59 119.754 19.293 2.919 413 HD3 LYS 59 2HD LYS 59 120.152 17.911 1.897 414 HE2 LYS 59 1HE LYS 59 121.110 19.533 0.218 415 HE3 LYS 59 2HE LYS 59 120.884 20.810 1.414 416 HZ1 LYS 59 3HZ LYS 59 122.513 18.353 1.778 417 HZ2 LYS 59 1HZ LYS 59 122.281 19.560 2.946 418 HZ3 LYS 59 2HZ LYS 59 123.117 19.918 1.513 419 H ASN 60 H ASN 60 115.097 16.531 0.046 420 HA ASN 60 HA ASN 60 113.306 16.221 2.388 421 HB2 ASN 60 1HB ASN 60 112.169 17.017 0.255 422 HB3 ASN 60 2HB ASN 60 112.593 15.458 -0.445 423 HD21 ASN 60 1HD2 ASN 60 109.891 16.046 -0.236 424 HD22 ASN 60 2HD2 ASN 60 109.181 15.121 0.997 425 H GLN 61 H GLN 61 113.508 14.321 3.401 426 HA GLN 61 HA GLN 61 114.535 11.999 1.874 427 HB2 GLN 61 1HB GLN 61 115.457 12.891 4.619 428 HB3 GLN 61 2HB GLN 61 115.906 11.371 3.842 429 HG2 GLN 61 1HG GLN 61 116.834 12.690 1.928 430 HG3 GLN 61 2HG GLN 61 116.503 14.161 2.825 431 HE21 GLN 61 1HE2 GLN 61 117.494 11.993 5.219 432 HE22 GLN 61 2HE2 GLN 61 119.156 12.328 5.177 433 H TYR 62 H TYR 62 113.796 9.954 2.648 434 HA TYR 62 HA TYR 62 111.963 9.953 4.904 435 HB2 TYR 62 1HB TYR 62 110.049 9.145 3.720 436 HB3 TYR 62 2HB TYR 62 110.555 10.668 3.023 437 HD1 TYR 62 HD1 TYR 62 110.389 7.007 2.529 438 HD2 TYR 62 HD2 TYR 62 111.297 10.803 0.734 439 HE1 TYR 62 HE1 TYR 62 110.376 5.950 0.286 440 HE2 TYR 62 HE2 TYR 62 111.291 9.744 -1.508 441 HH TYR 62 HH TYR 62 109.924 6.935 -2.208 442 H TYR 63 H TYR 63 111.258 7.887 5.561 443 HA TYR 63 HA TYR 63 112.968 5.651 4.621 444 HB2 TYR 63 1HB TYR 63 111.934 6.006 7.435 445 HB3 TYR 63 2HB TYR 63 113.124 4.854 6.868 446 HD1 TYR 63 HD1 TYR 63 112.487 8.367 7.768 447 HD2 TYR 63 HD2 TYR 63 115.452 5.506 6.555 448 HE1 TYR 63 HE1 TYR 63 114.280 9.961 8.394 449 HE2 TYR 63 HE2 TYR 63 117.245 7.102 7.180 450 HH TYR 63 HH TYR 63 117.553 9.036 8.653 451 H GLY 64 H GLY 64 111.892 3.664 4.345 452 HA2 GLY 64 1HA GLY 64 108.958 3.714 4.824 453 HA3 GLY 64 2HA GLY 64 109.647 3.145 3.309 454 H ILE 65 H ILE 65 108.088 1.936 5.710 455 HA ILE 65 HA ILE 65 109.794 -0.473 5.998 456 HB ILE 65 HB ILE 65 107.568 0.429 7.839 457 HG12 ILE 65 1HG1 ILE 65 109.462 1.982 8.014 458 HG13 ILE 65 2HG1 ILE 65 109.363 0.974 9.453 459 HG21 ILE 65 1HG2 ILE 65 108.617 -1.310 9.335 460 HG22 ILE 65 2HG2 ILE 65 109.610 -1.800 7.962 461 HG23 ILE 65 3HG2 ILE 65 107.855 -1.958 7.883 462 HD11 ILE 65 3HD1 ILE 65 111.691 1.156 8.704 463 HD12 ILE 65 1HD1 ILE 65 111.245 0.551 7.110 464 HD13 ILE 65 2HD1 ILE 65 111.130 -0.504 8.519 465 H THR 66 H THR 66 109.015 -2.270 5.040 466 HA THR 66 HA THR 66 106.137 -2.350 4.336 467 HB THR 66 HB THR 66 106.713 -3.306 2.168 468 HG1 THR 66 HG1 THR 66 108.998 -3.189 1.598 469 HG21 THR 66 3HG2 THR 66 107.924 -1.295 1.197 470 HG22 THR 66 1HG2 THR 66 108.084 -0.695 2.847 471 HG23 THR 66 2HG2 THR 66 106.484 -0.924 2.143 472 H ALA 67 H ALA 67 105.249 -4.442 4.049 473 HA ALA 67 HA ALA 67 106.879 -6.781 4.639 474 HB1 ALA 67 1HB ALA 67 106.078 -5.874 6.872 475 HB2 ALA 67 2HB ALA 67 105.590 -7.531 6.515 476 HB3 ALA 67 3HB ALA 67 104.435 -6.212 6.327 477 H GLY 68 H GLY 68 105.966 -8.668 3.743 478 HA2 GLY 68 1HA GLY 68 103.215 -8.566 2.809 479 HA3 GLY 68 2HA GLY 68 104.432 -8.563 1.550 480 HA PRO 69 HA PRO 69 103.814 -13.063 3.014 481 HB2 PRO 69 1HB PRO 69 101.591 -13.928 1.732 482 HB3 PRO 69 2HB PRO 69 101.538 -13.256 3.374 483 HG2 PRO 69 1HG PRO 69 100.841 -11.974 0.787 484 HG3 PRO 69 2HG PRO 69 100.047 -11.839 2.366 485 HD2 PRO 69 1HD PRO 69 101.771 -9.942 1.361 486 HD3 PRO 69 2HD PRO 69 101.469 -10.190 3.092 487 H ALA 70 H ALA 70 104.124 -14.946 1.510 488 HA ALA 70 HA ALA 70 104.426 -14.196 -1.315 489 HB1 ALA 70 1HB ALA 70 106.682 -15.834 -0.463 490 HB2 ALA 70 2HB ALA 70 106.626 -14.305 0.410 491 HB3 ALA 70 3HB ALA 70 106.661 -14.314 -1.350 492 H TYR 71 H TYR 71 104.528 -16.019 -2.753 493 HA TYR 71 HA TYR 71 103.478 -18.528 -1.577 494 HB2 TYR 71 1HB TYR 71 101.746 -17.247 -2.813 495 HB3 TYR 71 2HB TYR 71 102.759 -17.295 -4.242 496 HD1 TYR 71 HD1 TYR 71 100.715 -19.314 -1.911 497 HD2 TYR 71 HD2 TYR 71 102.905 -19.275 -5.605 498 HE1 TYR 71 HE1 TYR 71 99.708 -21.495 -2.531 499 HE2 TYR 71 HE2 TYR 71 101.900 -21.456 -6.225 500 HH TYR 71 HH TYR 71 99.454 -23.003 -4.159 501 H ARG 72 H ARG 72 104.592 -20.323 -2.108 502 HA ARG 72 HA ARG 72 106.745 -20.044 -4.126 503 HB2 ARG 72 1HB ARG 72 107.488 -20.328 -1.762 504 HB3 ARG 72 2HB ARG 72 106.659 -21.884 -1.726 505 HG2 ARG 72 1HG ARG 72 108.045 -22.620 -3.670 506 HG3 ARG 72 2HG ARG 72 108.934 -21.100 -3.570 507 HD2 ARG 72 1HD ARG 72 108.720 -23.153 -1.351 508 HD3 ARG 72 2HD ARG 72 110.125 -22.912 -2.385 509 HE ARG 72 HE ARG 72 109.231 -21.180 -0.215 510 HH11 ARG 72 1HH1 ARG 72 111.371 -21.537 -2.975 511 HH12 ARG 72 2HH1 ARG 72 112.438 -20.282 -2.436 512 HH21 ARG 72 1HH2 ARG 72 110.639 -19.576 0.427 513 HH22 ARG 72 2HH2 ARG 72 112.028 -19.188 -0.533 514 H ILE 73 H ILE 73 106.741 -21.363 -5.808 515 HA ILE 73 HA ILE 73 105.220 -23.894 -5.663 516 HB ILE 73 HB ILE 73 103.992 -22.301 -7.050 517 HG12 ILE 73 1HG1 ILE 73 105.384 -24.250 -8.896 518 HG13 ILE 73 2HG1 ILE 73 104.218 -24.771 -7.678 519 HG21 ILE 73 1HG2 ILE 73 106.678 -21.950 -8.347 520 HG22 ILE 73 2HG2 ILE 73 105.508 -20.730 -7.846 521 HG23 ILE 73 3HG2 ILE 73 105.209 -21.697 -9.288 522 HD11 ILE 73 3HD1 ILE 73 102.462 -23.488 -8.675 523 HD12 ILE 73 1HD1 ILE 73 103.258 -24.340 -9.998 524 HD13 ILE 73 2HD1 ILE 73 103.592 -22.631 -9.722 525 H ASN 74 H ASN 74 106.166 -25.671 -6.677 526 HA ASN 74 HA ASN 74 109.051 -25.541 -6.674 527 HB2 ASN 74 1HB ASN 74 107.197 -27.863 -7.240 528 HB3 ASN 74 2HB ASN 74 108.932 -27.974 -6.955 529 HD21 ASN 74 1HD2 ASN 74 109.254 -26.197 -4.791 530 HD22 ASN 74 2HD2 ASN 74 108.383 -26.779 -3.456 531 H ASP 75 H ASP 75 110.425 -25.706 -8.349 532 HA ASP 75 HA ASP 75 111.224 -25.722 -10.491 533 HB2 ASP 75 1HB ASP 75 108.763 -27.420 -10.955 534 HB3 ASP 75 2HB ASP 75 110.123 -27.273 -12.065 535 H TRP 76 H TRP 76 109.876 -23.409 -9.832 536 HA TRP 76 HA TRP 76 109.241 -22.482 -12.480 537 HB2 TRP 76 1HB TRP 76 107.073 -23.409 -11.765 538 HB3 TRP 76 2HB TRP 76 107.086 -22.348 -10.371 539 HD1 TRP 76 HD1 TRP 76 106.082 -20.015 -10.678 540 HE1 TRP 76 HE1 TRP 76 105.194 -18.668 -12.686 541 HE3 TRP 76 HE3 TRP 76 107.547 -23.065 -14.503 542 HZ2 TRP 76 HZ2 TRP 76 105.114 -18.856 -15.544 543 HZ3 TRP 76 HZ3 TRP 76 107.054 -22.460 -16.852 544 HH2 TRP 76 HH2 TRP 76 105.841 -20.364 -17.379 545 H ALA 77 H ALA 77 108.176 -21.102 -9.355 546 HA ALA 77 HA ALA 77 110.365 -19.426 -8.889 547 HB1 ALA 77 1HB ALA 77 110.033 -18.276 -10.931 548 HB2 ALA 77 2HB ALA 77 109.287 -17.246 -9.710 549 HB3 ALA 77 3HB ALA 77 108.281 -18.267 -10.736 550 H SER 78 H SER 78 109.569 -17.329 -7.658 551 HA SER 78 HA SER 78 107.199 -18.036 -6.022 552 HB2 SER 78 1HB SER 78 109.773 -16.747 -5.076 553 HB3 SER 78 2HB SER 78 108.353 -17.067 -4.086 554 HG SER 78 HG SER 78 110.073 -18.692 -4.030 555 H ILE 79 H ILE 79 105.934 -16.272 -5.278 556 HA ILE 79 HA ILE 79 106.558 -13.653 -6.515 557 HB ILE 79 HB ILE 79 104.204 -13.388 -7.132 558 HG12 ILE 79 1HG1 ILE 79 103.870 -16.284 -6.288 559 HG13 ILE 79 2HG1 ILE 79 103.302 -14.909 -5.339 560 HG21 ILE 79 1HG2 ILE 79 104.992 -16.060 -8.254 561 HG22 ILE 79 2HG2 ILE 79 106.012 -14.657 -8.565 562 HG23 ILE 79 3HG2 ILE 79 104.327 -14.654 -9.084 563 HD11 ILE 79 3HD1 ILE 79 102.340 -15.868 -8.026 564 HD12 ILE 79 1HD1 ILE 79 102.094 -14.191 -7.534 565 HD13 ILE 79 2HD1 ILE 79 101.399 -15.502 -6.580 566 H TYR 80 H TYR 80 105.735 -11.822 -5.371 567 HA TYR 80 HA TYR 80 104.389 -12.358 -2.827 568 HB2 TYR 80 1HB TYR 80 106.022 -11.236 -1.490 569 HB3 TYR 80 2HB TYR 80 106.826 -12.504 -2.390 570 HD1 TYR 80 HD1 TYR 80 108.313 -11.932 -4.304 571 HD2 TYR 80 HD2 TYR 80 106.549 -8.916 -1.804 572 HE1 TYR 80 HE1 TYR 80 109.940 -10.269 -5.162 573 HE2 TYR 80 HE2 TYR 80 108.176 -7.253 -2.662 574 HH TYR 80 HH TYR 80 110.937 -8.136 -4.446 575 H GLY 81 H GLY 81 103.512 -10.473 -1.816 576 HA2 GLY 81 1HA GLY 81 103.669 -7.969 -3.382 577 HA3 GLY 81 2HA GLY 81 102.082 -8.600 -2.933 578 H VAL 82 H VAL 82 103.425 -6.082 -2.084 579 HA VAL 82 HA VAL 82 103.517 -6.547 0.826 580 HB VAL 82 HB VAL 82 105.517 -5.081 0.983 581 HG11 VAL 82 1HG1 VAL 82 105.639 -7.686 -0.520 582 HG12 VAL 82 2HG1 VAL 82 106.089 -7.344 1.149 583 HG13 VAL 82 3HG1 VAL 82 107.113 -6.787 -0.172 584 HG21 VAL 82 3HG2 VAL 82 105.162 -3.952 -1.223 585 HG22 VAL 82 1HG2 VAL 82 105.655 -5.443 -2.024 586 HG23 VAL 82 2HG2 VAL 82 106.803 -4.563 -1.016 587 H VAL 83 H VAL 83 103.166 -4.717 2.105 588 HA VAL 83 HA VAL 83 102.475 -2.194 0.752 589 HB VAL 83 HB VAL 83 100.826 -3.453 2.968 590 HG11 VAL 83 1HG1 VAL 83 100.855 -1.028 3.122 591 HG12 VAL 83 2HG1 VAL 83 99.300 -1.526 2.453 592 HG13 VAL 83 3HG1 VAL 83 100.551 -0.877 1.392 593 HG21 VAL 83 3HG2 VAL 83 100.047 -2.929 0.085 594 HG22 VAL 83 1HG2 VAL 83 99.106 -3.782 1.308 595 HG23 VAL 83 2HG2 VAL 83 100.585 -4.502 0.673 596 H GLY 84 H GLY 84 102.832 -0.319 2.161 597 HA2 GLY 84 1HA GLY 84 103.867 -0.723 4.821 598 HA3 GLY 84 2HA GLY 84 105.131 -0.370 3.650 599 H VAL 85 H VAL 85 105.256 1.437 5.337 600 HA VAL 85 HA VAL 85 103.666 3.735 4.374 601 HB VAL 85 HB VAL 85 103.521 4.573 6.698 602 HG11 VAL 85 1HG1 VAL 85 101.733 3.109 7.398 603 HG12 VAL 85 2HG1 VAL 85 102.393 1.771 6.457 604 HG13 VAL 85 3HG1 VAL 85 101.708 3.173 5.636 605 HG21 VAL 85 3HG2 VAL 85 104.020 3.008 8.556 606 HG22 VAL 85 1HG2 VAL 85 105.470 3.377 7.622 607 HG23 VAL 85 2HG2 VAL 85 104.642 1.837 7.392 608 H GLY 86 H GLY 86 104.763 5.717 4.425 609 HA2 GLY 86 1HA GLY 86 107.656 5.564 5.054 610 HA3 GLY 86 2HA GLY 86 107.067 6.291 3.562 611 H TYR 87 H TYR 87 108.521 7.298 6.059 612 HA TYR 87 HA TYR 87 106.753 9.628 6.570 613 HB2 TYR 87 1HB TYR 87 109.017 8.638 8.308 614 HB3 TYR 87 2HB TYR 87 107.859 9.898 8.690 615 HD1 TYR 87 HD1 TYR 87 108.433 6.279 8.430 616 HD2 TYR 87 HD2 TYR 87 105.575 9.341 9.379 617 HE1 TYR 87 HE1 TYR 87 106.972 4.584 9.497 618 HE2 TYR 87 HE2 TYR 87 104.112 7.645 10.445 619 HH TYR 87 HH TYR 87 104.157 4.603 9.938 620 H GLY 88 H GLY 88 107.523 11.559 5.903 621 HA2 GLY 88 1HA GLY 88 110.378 11.736 5.114 622 HA3 GLY 88 2HA GLY 88 109.086 12.325 4.074 623 H LYS 89 H LYS 89 111.334 13.766 5.211 624 HA LYS 89 HA LYS 89 109.838 15.937 6.480 625 HB2 LYS 89 1HB LYS 89 111.453 16.224 8.254 626 HB3 LYS 89 2HB LYS 89 110.837 14.576 8.307 627 HG2 LYS 89 1HG LYS 89 112.864 13.831 7.036 628 HG3 LYS 89 2HG LYS 89 113.491 15.476 7.145 629 HD2 LYS 89 1HD LYS 89 113.213 15.278 9.673 630 HD3 LYS 89 2HD LYS 89 112.937 13.555 9.415 631 HE2 LYS 89 1HE LYS 89 115.394 15.050 8.459 632 HE3 LYS 89 2HE LYS 89 115.324 14.089 9.936 633 HZ1 LYS 89 3HZ LYS 89 114.306 12.630 7.725 634 HZ2 LYS 89 1HZ LYS 89 115.581 12.236 8.774 635 HZ3 LYS 89 2HZ LYS 89 115.878 13.185 7.397 636 H PHE 90 H PHE 90 110.528 17.953 5.922 637 HA PHE 90 HA PHE 90 113.020 18.176 4.344 638 HB2 PHE 90 1HB PHE 90 111.885 19.801 2.891 639 HB3 PHE 90 2HB PHE 90 111.161 18.207 2.789 640 HD1 PHE 90 HD1 PHE 90 110.709 21.681 3.907 641 HD2 PHE 90 HD2 PHE 90 108.921 17.781 3.669 642 HE1 PHE 90 HE1 PHE 90 108.494 22.662 4.439 643 HE2 PHE 90 HE2 PHE 90 106.707 18.764 4.201 644 HZ PHE 90 HZ PHE 90 106.493 21.204 4.586 645 H GLN 91 H GLN 91 113.990 20.313 4.388 646 HA GLN 91 HA GLN 91 113.399 21.679 6.946 647 HB2 GLN 91 1HB GLN 91 115.950 21.509 5.332 648 HB3 GLN 91 2HB GLN 91 115.755 22.469 6.799 649 HG2 GLN 91 1HG GLN 91 115.216 20.459 8.083 650 HG3 GLN 91 2HG GLN 91 115.308 19.475 6.624 651 HE21 GLN 91 1HE2 GLN 91 116.983 18.955 8.890 652 HE22 GLN 91 2HE2 GLN 91 118.588 19.288 8.452 653 H THR 92 H THR 92 112.396 23.536 6.785 654 HA THR 92 HA THR 92 113.378 25.533 4.887 655 HB THR 92 HB THR 92 111.441 24.574 3.752 656 HG1 THR 92 HG1 THR 92 111.698 26.773 3.544 657 HG21 THR 92 3HG2 THR 92 110.208 24.868 6.455 658 HG22 THR 92 1HG2 THR 92 109.994 23.605 5.246 659 HG23 THR 92 2HG2 THR 92 109.179 25.155 5.055 660 H THR 93 H THR 93 112.605 27.771 5.535 661 HA THR 93 HA THR 93 112.330 27.908 8.470 662 HB THR 93 HB THR 93 112.888 30.136 6.493 663 HG1 THR 93 HG1 THR 93 114.880 29.520 6.584 664 HG21 THR 93 3HG2 THR 93 112.846 29.915 9.501 665 HG22 THR 93 1HG2 THR 93 112.046 31.106 8.474 666 HG23 THR 93 2HG2 THR 93 113.796 31.160 8.688 667 H GLU 94 H GLU 94 110.475 28.389 9.372 668 HA GLU 94 HA GLU 94 108.405 29.998 8.199 669 HB2 GLU 94 1HB GLU 94 107.954 27.008 8.424 670 HB3 GLU 94 2HB GLU 94 106.674 28.193 8.213 671 HG2 GLU 94 1HG GLU 94 107.767 28.899 6.065 672 HG3 GLU 94 2HG GLU 94 108.919 27.587 6.270 673 H TYR 95 H TYR 95 106.871 30.591 9.794 674 HA TYR 95 HA TYR 95 107.383 29.711 12.498 675 HB2 TYR 95 1HB TYR 95 105.232 31.031 12.967 676 HB3 TYR 95 2HB TYR 95 106.644 31.919 12.442 677 HD1 TYR 95 HD1 TYR 95 103.263 30.780 11.547 678 HD2 TYR 95 HD2 TYR 95 106.713 32.979 10.237 679 HE1 TYR 95 HE1 TYR 95 101.928 31.788 9.716 680 HE2 TYR 95 HE2 TYR 95 105.379 33.984 8.405 681 HH TYR 95 HH TYR 95 103.429 33.953 7.324 682 HA PRO 96 HA PRO 96 105.098 26.137 11.268 683 HB2 PRO 96 1HB PRO 96 105.155 24.613 13.504 684 HB3 PRO 96 2HB PRO 96 106.603 24.929 12.525 685 HG2 PRO 96 1HG PRO 96 105.754 26.155 15.093 686 HG3 PRO 96 2HG PRO 96 107.374 25.705 14.534 687 HD2 PRO 96 1HD PRO 96 106.379 28.286 14.485 688 HD3 PRO 96 2HD PRO 96 107.695 27.697 13.449 689 H THR 97 H THR 97 102.996 25.775 10.973 690 HA THR 97 HA THR 97 101.180 25.922 13.311 691 HB THR 97 HB THR 97 100.441 26.120 10.377 692 HG1 THR 97 HG1 THR 97 100.891 28.040 12.392 693 HG21 THR 97 3HG2 THR 97 98.234 26.627 11.170 694 HG22 THR 97 1HG2 THR 97 98.793 26.733 12.839 695 HG23 THR 97 2HG2 THR 97 98.754 25.172 12.019 696 H TYR 98 H TYR 98 100.587 23.941 14.028 697 HA TYR 98 HA TYR 98 100.062 21.804 12.130 698 HB2 TYR 98 1HB TYR 98 102.260 21.551 14.182 699 HB3 TYR 98 2HB TYR 98 101.615 20.229 13.230 700 HD1 TYR 98 HD1 TYR 98 101.866 20.316 10.696 701 HD2 TYR 98 HD2 TYR 98 103.954 22.970 13.350 702 HE1 TYR 98 HE1 TYR 98 103.492 20.836 8.897 703 HE2 TYR 98 HE2 TYR 98 105.580 23.489 11.551 704 HH TYR 98 HH TYR 98 106.264 21.851 9.163 705 H LYS 99 H LYS 99 98.371 20.670 12.807 706 HA LYS 99 HA LYS 99 97.851 20.473 15.720 707 HB2 LYS 99 1HB LYS 99 96.075 21.609 14.378 708 HB3 LYS 99 2HB LYS 99 95.891 20.126 13.440 709 HG2 LYS 99 1HG LYS 99 95.277 18.882 15.446 710 HG3 LYS 99 2HG LYS 99 95.564 20.304 16.449 711 HD2 LYS 99 1HD LYS 99 93.187 20.155 16.072 712 HD3 LYS 99 2HD LYS 99 93.793 21.504 15.112 713 HE2 LYS 99 1HE LYS 99 92.217 20.064 13.831 714 HE3 LYS 99 2HE LYS 99 93.821 20.110 13.104 715 HZ1 LYS 99 3HZ LYS 99 92.442 17.867 13.780 716 HZ2 LYS 99 1HZ LYS 99 93.540 18.036 15.062 717 HZ3 LYS 99 2HZ LYS 99 94.110 17.948 13.463 718 H HIS 100 H HIS 100 98.276 18.540 16.563 719 HA HIS 100 HA HIS 100 98.786 16.303 16.731 720 HB2 HIS 100 1HB HIS 100 96.403 16.106 14.894 721 HB3 HIS 100 2HB HIS 100 97.036 14.821 15.906 722 HD1 HIS 100 HD1 HIS 100 94.135 15.686 16.272 723 HD2 HIS 100 HD2 HIS 100 97.289 17.361 18.425 724 HE1 HIS 100 HE1 HIS 100 93.125 16.664 18.378 725 H ASP 101 H ASP 101 100.141 17.707 14.486 726 HA ASP 101 HA ASP 101 100.893 15.309 12.977 727 HB2 ASP 101 1HB ASP 101 99.134 16.487 11.650 728 HB3 ASP 101 2HB ASP 101 100.179 17.905 11.599 729 H THR 102 H THR 102 102.991 15.377 12.124 730 HA THR 102 HA THR 102 104.592 17.782 12.650 731 HB THR 102 HB THR 102 106.326 16.472 13.800 732 HG1 THR 102 HG1 THR 102 105.921 14.358 14.333 733 HG21 THR 102 3HG2 THR 102 103.592 16.140 15.067 734 HG22 THR 102 1HG2 THR 102 104.534 17.630 15.086 735 HG23 THR 102 2HG2 THR 102 105.137 16.195 15.915 736 H SER 103 H SER 103 104.227 14.680 11.032 737 HA SER 103 HA SER 103 106.340 15.484 9.123 738 HB2 SER 103 1HB SER 103 107.120 13.195 8.998 739 HB3 SER 103 2HB SER 103 107.152 13.709 10.681 740 HG SER 103 HG SER 103 106.107 11.582 9.999 741 H ASP 104 H ASP 104 106.179 14.182 7.052 742 HA ASP 104 HA ASP 104 103.359 14.146 6.225 743 HB2 ASP 104 1HB ASP 104 105.006 15.486 4.920 744 HB3 ASP 104 2HB ASP 104 105.865 13.996 4.534 745 H TYR 105 H TYR 105 102.307 12.309 5.714 746 HA TYR 105 HA TYR 105 103.845 9.779 5.854 747 HB2 TYR 105 1HB TYR 105 100.920 10.211 6.456 748 HB3 TYR 105 2HB TYR 105 101.850 8.751 6.728 749 HD1 TYR 105 HD1 TYR 105 101.115 12.148 7.918 750 HD2 TYR 105 HD2 TYR 105 103.402 8.580 8.615 751 HE1 TYR 105 HE1 TYR 105 101.652 12.940 10.206 752 HE2 TYR 105 HE2 TYR 105 103.941 9.372 10.902 753 HH TYR 105 HH TYR 105 102.343 11.552 12.515 754 H GLY 106 H GLY 106 103.648 8.307 4.245 755 HA2 GLY 106 1HA GLY 106 101.483 8.647 2.263 756 HA3 GLY 106 2HA GLY 106 103.151 8.490 1.718 757 H PHE 107 H PHE 107 101.035 6.711 1.024 758 HA PHE 107 HA PHE 107 101.794 4.233 2.475 759 HB2 PHE 107 1HB PHE 107 99.267 4.869 0.947 760 HB3 PHE 107 2HB PHE 107 99.645 3.315 1.665 761 HD1 PHE 107 HD1 PHE 107 99.746 3.074 4.143 762 HD2 PHE 107 HD2 PHE 107 98.479 6.718 2.255 763 HE1 PHE 107 HE1 PHE 107 98.746 3.836 6.282 764 HE2 PHE 107 HE2 PHE 107 97.480 7.479 4.392 765 HZ PHE 107 HZ PHE 107 97.613 6.038 6.406 766 H SER 108 H SER 108 102.477 2.436 1.276 767 HA SER 108 HA SER 108 102.645 2.800 -1.656 768 HB2 SER 108 1HB SER 108 104.921 1.890 0.120 769 HB3 SER 108 2HB SER 108 104.951 1.996 -1.637 770 HG SER 108 HG SER 108 105.760 3.848 -0.245 771 H TYR 109 H TYR 109 102.653 0.901 -2.874 772 HA TYR 109 HA TYR 109 102.741 -1.677 -1.540 773 HB2 TYR 109 1HB TYR 109 100.577 -2.426 -2.236 774 HB3 TYR 109 2HB TYR 109 100.377 -0.947 -1.319 775 HD1 TYR 109 HD1 TYR 109 100.129 -2.527 -4.627 776 HD2 TYR 109 HD2 TYR 109 99.627 1.116 -2.407 777 HE1 TYR 109 HE1 TYR 109 98.843 -1.556 -6.511 778 HE2 TYR 109 HE2 TYR 109 98.341 2.086 -4.292 779 HH TYR 109 HH TYR 109 98.311 1.583 -6.948 780 H GLY 110 H GLY 110 102.848 -3.475 -3.076 781 HA2 GLY 110 1HA GLY 110 102.791 -3.172 -5.875 782 HA3 GLY 110 2HA GLY 110 104.448 -2.927 -5.337 783 H ALA 111 H ALA 111 104.469 -4.922 -6.885 784 HA ALA 111 HA ALA 111 104.557 -7.303 -5.164 785 HB1 ALA 111 1HB ALA 111 103.247 -8.633 -6.528 786 HB2 ALA 111 2HB ALA 111 103.519 -7.627 -7.951 787 HB3 ALA 111 3HB ALA 111 102.410 -7.088 -6.689 788 H GLY 112 H GLY 112 105.904 -9.044 -6.107 789 HA2 GLY 112 1HA GLY 112 107.758 -8.153 -8.200 790 HA3 GLY 112 2HA GLY 112 108.433 -8.495 -6.610 791 H LEU 113 H LEU 113 109.136 -9.832 -8.991 792 HA LEU 113 HA LEU 113 108.170 -12.576 -8.436 793 HB2 LEU 113 1HB LEU 113 109.156 -11.485 -11.087 794 HB3 LEU 113 2HB LEU 113 108.546 -13.110 -10.784 795 HG LEU 113 HG LEU 113 106.926 -10.570 -10.422 796 HD11 LEU 113 1HD1 LEU 113 107.358 -10.900 -12.780 797 HD12 LEU 113 2HD1 LEU 113 105.711 -11.440 -12.456 798 HD13 LEU 113 3HD1 LEU 113 107.005 -12.623 -12.652 799 HD21 LEU 113 3HD2 LEU 113 105.032 -12.222 -10.331 800 HD22 LEU 113 1HD2 LEU 113 106.153 -12.372 -8.978 801 HD23 LEU 113 2HD2 LEU 113 106.225 -13.520 -10.316 802 H GLN 114 H GLN 114 109.735 -14.161 -8.227 803 HA GLN 114 HA GLN 114 112.548 -13.224 -8.240 804 HB2 GLN 114 1HB GLN 114 111.625 -13.866 -6.011 805 HB3 GLN 114 2HB GLN 114 111.337 -15.489 -6.636 806 HG2 GLN 114 1HG GLN 114 113.727 -15.752 -7.119 807 HG3 GLN 114 2HG GLN 114 114.038 -14.113 -6.555 808 HE21 GLN 114 1HE2 GLN 114 115.450 -16.073 -5.262 809 HE22 GLN 114 2HE2 GLN 114 114.817 -16.360 -3.714 810 H PHE 115 H PHE 115 113.973 -14.252 -9.526 811 HA PHE 115 HA PHE 115 113.116 -16.788 -10.813 812 HB2 PHE 115 1HB PHE 115 114.709 -14.520 -12.014 813 HB3 PHE 115 2HB PHE 115 114.393 -16.058 -12.795 814 HD1 PHE 115 HD2 PHE 115 112.170 -16.596 -13.665 815 HD2 PHE 115 HD1 PHE 115 112.968 -12.836 -11.749 816 HE1 PHE 115 HE2 PHE 115 110.046 -15.686 -14.565 817 HE2 PHE 115 HE1 PHE 115 110.844 -11.926 -12.648 818 HZ PHE 115 HZ PHE 115 109.383 -13.351 -14.057 819 H ASN 116 H ASN 116 114.599 -18.409 -10.908 820 HA ASN 116 HA ASN 116 117.300 -17.870 -9.825 821 HB2 ASN 116 1HB ASN 116 117.165 -20.073 -8.673 822 HB3 ASN 116 2HB ASN 116 116.011 -18.894 -8.049 823 HD21 ASN 116 1HD2 ASN 116 116.272 -22.083 -9.145 824 HD22 ASN 116 2HD2 ASN 116 114.632 -22.364 -9.485 825 HA PRO 117 HA PRO 117 117.637 -20.196 -13.799 826 HB2 PRO 117 1HB PRO 117 119.697 -18.791 -14.885 827 HB3 PRO 117 2HB PRO 117 118.012 -18.248 -14.994 828 HG2 PRO 117 1HG PRO 117 120.176 -17.329 -13.177 829 HG3 PRO 117 2HG PRO 117 118.918 -16.393 -14.006 830 HD2 PRO 117 1HD PRO 117 118.775 -17.124 -11.354 831 HD3 PRO 117 2HD PRO 117 117.356 -16.785 -12.368 832 H MET 118 H MET 118 120.147 -20.692 -14.834 833 HA MET 118 HA MET 118 121.187 -22.683 -13.183 834 HB2 MET 118 1HB MET 118 122.590 -21.120 -15.367 835 HB3 MET 118 2HB MET 118 123.152 -22.646 -14.693 836 HG2 MET 118 1HG MET 118 120.521 -22.215 -16.137 837 HG3 MET 118 2HG MET 118 121.941 -23.008 -16.809 838 HE1 MET 118 3HE MET 118 122.361 -26.227 -14.966 839 HE2 MET 118 1HE MET 118 122.951 -24.787 -14.126 840 HE3 MET 118 2HE MET 118 123.076 -24.902 -15.881 841 H GLU 119 H GLU 119 122.068 -19.271 -13.419 842 HA GLU 119 HA GLU 119 124.462 -19.276 -11.992 843 HB2 GLU 119 1HB GLU 119 122.264 -17.194 -12.006 844 HB3 GLU 119 2HB GLU 119 123.908 -16.928 -11.424 845 HG2 GLU 119 1HG GLU 119 124.774 -17.556 -13.670 846 HG3 GLU 119 2HG GLU 119 123.119 -17.719 -14.240 847 H ASN 120 H ASN 120 124.950 -18.878 -9.797 848 HA ASN 120 HA ASN 120 123.175 -20.241 -7.966 849 HB2 ASN 120 1HB ASN 120 125.862 -18.927 -7.534 850 HB3 ASN 120 2HB ASN 120 125.004 -19.896 -6.337 851 HD21 ASN 120 1HD2 ASN 120 127.615 -20.577 -7.496 852 HD22 ASN 120 2HD2 ASN 120 127.413 -22.043 -8.326 853 H VAL 121 H VAL 121 122.766 -17.263 -9.053 854 HA VAL 121 HA VAL 121 122.049 -16.158 -6.398 855 HB VAL 121 HB VAL 121 122.449 -13.914 -7.352 856 HG11 VAL 121 1HG1 VAL 121 124.244 -15.310 -6.175 857 HG12 VAL 121 2HG1 VAL 121 124.830 -13.992 -7.191 858 HG13 VAL 121 3HG1 VAL 121 124.886 -15.653 -7.782 859 HG21 VAL 121 3HG2 VAL 121 123.575 -15.446 -9.721 860 HG22 VAL 121 1HG2 VAL 121 123.580 -13.694 -9.516 861 HG23 VAL 121 2HG2 VAL 121 122.054 -14.552 -9.734 862 H ALA 122 H ALA 122 120.162 -14.759 -6.395 863 HA ALA 122 HA ALA 122 118.231 -15.497 -8.527 864 HB1 ALA 122 1HB ALA 122 117.933 -16.310 -6.054 865 HB2 ALA 122 2HB ALA 122 116.545 -15.667 -6.932 866 HB3 ALA 122 3HB ALA 122 117.402 -14.652 -5.770 867 H LEU 123 H LEU 123 116.815 -13.905 -9.275 868 HA LEU 123 HA LEU 123 117.676 -11.126 -8.692 869 HB2 LEU 123 1HB LEU 123 116.503 -12.227 -11.258 870 HB3 LEU 123 2HB LEU 123 117.041 -10.571 -10.982 871 HG LEU 123 HG LEU 123 118.828 -13.016 -10.806 872 HD11 LEU 123 1HD1 LEU 123 118.374 -10.960 -12.979 873 HD12 LEU 123 2HD1 LEU 123 118.260 -12.716 -13.108 874 HD13 LEU 123 3HD1 LEU 123 119.834 -11.947 -12.898 875 HD21 LEU 123 3HD2 LEU 123 119.275 -10.041 -10.518 876 HD22 LEU 123 1HD2 LEU 123 120.591 -11.133 -10.948 877 HD23 LEU 123 2HD2 LEU 123 119.749 -11.329 -9.411 878 H ASP 124 H ASP 124 116.108 -9.595 -8.292 879 HA ASP 124 HA ASP 124 113.305 -10.567 -8.197 880 HB2 ASP 124 1HB ASP 124 114.726 -8.741 -6.244 881 HB3 ASP 124 2HB ASP 124 113.010 -9.135 -6.202 882 H PHE 125 H PHE 125 111.941 -9.412 -9.367 883 HA PHE 125 HA PHE 125 112.604 -6.587 -9.989 884 HB2 PHE 125 1HB PHE 125 112.763 -8.094 -11.963 885 HB3 PHE 125 2HB PHE 125 111.089 -8.552 -11.716 886 HD1 PHE 125 HD1 PHE 125 113.365 -5.797 -12.674 887 HD2 PHE 125 HD2 PHE 125 109.283 -7.102 -12.381 888 HE1 PHE 125 HE1 PHE 125 112.649 -3.865 -14.052 889 HE2 PHE 125 HE2 PHE 125 108.566 -5.170 -13.760 890 HZ PHE 125 HZ PHE 125 110.249 -3.550 -14.595 891 H SER 126 H SER 126 111.073 -5.131 -9.380 892 HA SER 126 HA SER 126 108.348 -6.084 -8.839 893 HB2 SER 126 1HB SER 126 109.602 -6.312 -6.717 894 HB3 SER 126 2HB SER 126 110.023 -4.606 -6.799 895 HG SER 126 HG SER 126 108.127 -4.192 -6.007 896 H TYR 127 H TYR 127 106.777 -4.564 -9.051 897 HA TYR 127 HA TYR 127 107.622 -1.831 -9.824 898 HB2 TYR 127 1HB TYR 127 106.462 -3.098 -11.591 899 HB3 TYR 127 2HB TYR 127 105.102 -3.353 -10.515 900 HD1 TYR 127 HD1 TYR 127 103.561 -1.534 -9.981 901 HD2 TYR 127 HD2 TYR 127 106.899 -0.931 -12.617 902 HE1 TYR 127 HE1 TYR 127 102.566 0.598 -10.753 903 HE2 TYR 127 HE2 TYR 127 105.902 1.205 -13.390 904 HH TYR 127 HH TYR 127 103.585 2.212 -13.511 905 H GLU 128 H GLU 128 107.170 -0.295 -8.374 906 HA GLU 128 HA GLU 128 105.034 -0.805 -6.381 907 HB2 GLU 128 1HB GLU 128 107.345 -1.121 -5.477 908 HB3 GLU 128 2HB GLU 128 107.675 0.570 -5.856 909 HG2 GLU 128 1HG GLU 128 105.744 1.231 -4.431 910 HG3 GLU 128 2HG GLU 128 105.510 -0.457 -4.000 911 H GLN 129 H GLN 129 103.675 0.819 -5.942 912 HA GLN 129 HA GLN 129 104.302 3.522 -6.975 913 HB2 GLN 129 1HB GLN 129 101.638 2.083 -7.031 914 HB3 GLN 129 2HB GLN 129 101.844 3.802 -7.363 915 HG2 GLN 129 1HG GLN 129 103.333 3.290 -9.238 916 HG3 GLN 129 2HG GLN 129 103.209 1.567 -8.889 917 HE21 GLN 129 1HE2 GLN 129 102.386 2.807 -11.410 918 HE22 GLN 129 2HE2 GLN 129 100.713 2.561 -11.559 919 H SER 130 H SER 130 103.600 5.245 -5.673 920 HA SER 130 HA SER 130 102.348 4.559 -3.099 921 HB2 SER 130 1HB SER 130 104.001 5.786 -1.838 922 HB3 SER 130 2HB SER 130 104.832 4.575 -2.807 923 HG SER 130 HG SER 130 105.902 6.486 -3.117 924 H ARG 131 H ARG 131 101.202 6.221 -2.143 925 HA ARG 131 HA ARG 131 100.804 8.643 -3.805 926 HB2 ARG 131 1HB ARG 131 98.836 7.111 -3.705 927 HB3 ARG 131 2HB ARG 131 98.806 7.318 -1.953 928 HG2 ARG 131 1HG ARG 131 98.571 9.780 -2.285 929 HG3 ARG 131 2HG ARG 131 98.480 9.507 -4.026 930 HD2 ARG 131 1HD ARG 131 96.580 8.345 -1.969 931 HD3 ARG 131 2HD ARG 131 96.227 9.709 -3.027 932 HE ARG 131 HE ARG 131 96.108 6.945 -3.726 933 HH11 ARG 131 1HH1 ARG 131 96.933 10.079 -5.075 934 HH12 ARG 131 2HH1 ARG 131 96.585 9.584 -6.698 935 HH21 ARG 131 1HH2 ARG 131 95.675 6.366 -5.836 936 HH22 ARG 131 2HH2 ARG 131 95.882 7.508 -7.122 937 H ILE 132 H ILE 132 101.256 10.526 -2.879 938 HA ILE 132 HA ILE 132 101.491 10.681 0.059 939 HB ILE 132 HB ILE 132 103.439 11.888 -1.934 940 HG12 ILE 132 1HG1 ILE 132 103.876 9.684 0.105 941 HG13 ILE 132 2HG1 ILE 132 103.649 9.404 -1.622 942 HG21 ILE 132 1HG2 ILE 132 104.649 12.655 0.022 943 HG22 ILE 132 2HG2 ILE 132 103.529 11.817 1.096 944 HG23 ILE 132 3HG2 ILE 132 102.980 13.207 0.162 945 HD11 ILE 132 3HD1 ILE 132 106.034 9.443 -1.161 946 HD12 ILE 132 1HD1 ILE 132 105.884 10.989 -0.325 947 HD13 ILE 132 2HD1 ILE 132 105.615 10.898 -2.065 948 H ARG 133 H ARG 133 99.673 11.858 0.361 949 HA ARG 133 HA ARG 133 97.793 12.926 -0.593 950 HB2 ARG 133 1HB ARG 133 97.903 15.194 0.323 951 HB3 ARG 133 2HB ARG 133 98.539 13.986 1.432 952 HG2 ARG 133 1HG ARG 133 100.859 14.579 0.534 953 HG3 ARG 133 2HG ARG 133 100.100 15.968 -0.242 954 HD2 ARG 133 1HD ARG 133 99.202 16.678 1.964 955 HD3 ARG 133 2HD ARG 133 100.090 15.356 2.716 956 HE ARG 133 HE ARG 133 101.777 17.030 1.103 957 HH11 ARG 133 1HH1 ARG 133 100.292 16.788 4.275 958 HH12 ARG 133 2HH1 ARG 133 101.494 17.786 5.023 959 HH21 ARG 133 1HH2 ARG 133 103.294 18.307 2.121 960 HH22 ARG 133 2HH2 ARG 133 103.172 18.635 3.817 961 H SER 134 H SER 134 97.684 12.664 -2.795 962 HA SER 134 HA SER 134 96.945 13.665 -4.725 963 HB2 SER 134 1HB SER 134 98.218 16.237 -3.789 964 HB3 SER 134 2HB SER 134 97.064 16.036 -5.102 965 HG SER 134 HG SER 134 95.715 15.039 -3.337 966 H VAL 135 H VAL 135 100.241 13.487 -3.776 967 HA VAL 135 HA VAL 135 101.118 13.987 -6.551 968 HB VAL 135 HB VAL 135 102.783 13.593 -4.047 969 HG11 VAL 135 1HG1 VAL 135 103.457 14.407 -6.889 970 HG12 VAL 135 2HG1 VAL 135 104.025 12.976 -6.030 971 HG13 VAL 135 3HG1 VAL 135 104.571 14.578 -5.533 972 HG21 VAL 135 3HG2 VAL 135 102.151 16.138 -5.575 973 HG22 VAL 135 1HG2 VAL 135 103.139 16.007 -4.121 974 HG23 VAL 135 2HG2 VAL 135 101.407 15.686 -4.042 975 H ASP 136 H ASP 136 101.833 12.325 -7.813 976 HA ASP 136 HA ASP 136 101.578 9.616 -6.642 977 HB2 ASP 136 1HB ASP 136 101.373 10.563 -9.507 978 HB3 ASP 136 2HB ASP 136 101.292 8.878 -9.002 979 H VAL 137 H VAL 137 103.350 8.375 -6.442 980 HA VAL 137 HA VAL 137 105.792 9.182 -7.928 981 HB VAL 137 HB VAL 137 105.621 7.904 -5.185 982 HG11 VAL 137 1HG1 VAL 137 108.040 8.363 -5.115 983 HG12 VAL 137 2HG1 VAL 137 107.968 9.018 -6.752 984 HG13 VAL 137 3HG1 VAL 137 107.646 7.307 -6.472 985 HG21 VAL 137 3HG2 VAL 137 106.533 10.132 -4.438 986 HG22 VAL 137 1HG2 VAL 137 104.877 10.208 -5.044 987 HG23 VAL 137 2HG2 VAL 137 106.213 10.747 -6.061 988 H GLY 138 H GLY 138 106.711 7.668 -9.172 989 HA2 GLY 138 1HA GLY 138 105.805 4.853 -8.867 990 HA3 GLY 138 2HA GLY 138 106.073 5.611 -10.435 991 H THR 139 H THR 139 107.411 3.401 -8.546 992 HA THR 139 HA THR 139 110.162 4.146 -9.329 993 HB THR 139 HB THR 139 109.874 4.647 -6.940 994 HG1 THR 139 HG1 THR 139 111.801 3.905 -6.656 995 HG21 THR 139 3HG2 THR 139 108.074 2.970 -6.513 996 HG22 THR 139 1HG2 THR 139 109.388 2.882 -5.340 997 HG23 THR 139 2HG2 THR 139 109.282 1.691 -6.637 998 H TRP 140 H TRP 140 111.449 2.515 -10.029 999 HA TRP 140 HA TRP 140 110.254 -0.187 -10.173 1000 HB2 TRP 140 1HB TRP 140 112.423 1.113 -11.827 1001 HB3 TRP 140 2HB TRP 140 111.941 -0.566 -11.971 1002 HD1 TRP 140 HD1 TRP 140 109.200 -0.880 -12.576 1003 HE1 TRP 140 HE1 TRP 140 107.833 0.453 -14.308 1004 HE3 TRP 140 HE3 TRP 140 112.156 3.258 -13.039 1005 HZ2 TRP 140 HZ2 TRP 140 107.975 2.947 -15.709 1006 HZ3 TRP 140 HZ3 TRP 140 111.520 5.092 -14.575 1007 HH2 TRP 140 HH2 TRP 140 109.437 4.945 -15.910 1008 H ILE 141 H ILE 141 111.275 -1.872 -9.200 1009 HA ILE 141 HA ILE 141 113.799 -1.261 -7.761 1010 HB ILE 141 HB ILE 141 111.570 -3.116 -6.881 1011 HG12 ILE 141 1HG1 ILE 141 112.362 -0.412 -5.756 1012 HG13 ILE 141 2HG1 ILE 141 110.979 -0.667 -6.821 1013 HG21 ILE 141 1HG2 ILE 141 114.035 -2.106 -5.428 1014 HG22 ILE 141 2HG2 ILE 141 113.854 -3.726 -6.102 1015 HG23 ILE 141 3HG2 ILE 141 112.818 -3.203 -4.774 1016 HD11 ILE 141 3HD1 ILE 141 111.400 -1.998 -4.128 1017 HD12 ILE 141 1HD1 ILE 141 110.023 -2.265 -5.198 1018 HD13 ILE 141 2HD1 ILE 141 110.274 -0.682 -4.460 1019 H ALA 142 H ALA 142 115.482 -2.490 -8.281 1020 HA ALA 142 HA ALA 142 114.998 -5.301 -9.052 1021 HB1 ALA 142 1HB ALA 142 116.822 -5.103 -10.740 1022 HB2 ALA 142 2HB ALA 142 116.854 -3.363 -10.458 1023 HB3 ALA 142 3HB ALA 142 115.414 -4.119 -11.139 1024 H GLY 143 H GLY 143 116.392 -6.738 -8.103 1025 HA2 GLY 143 1HA GLY 143 118.910 -5.805 -6.967 1026 HA3 GLY 143 2HA GLY 143 117.692 -6.283 -5.792 1027 H VAL 144 H VAL 144 119.736 -7.716 -5.439 1028 HA VAL 144 HA VAL 144 119.224 -10.299 -6.743 1029 HB VAL 144 HB VAL 144 121.120 -9.283 -7.947 1030 HG11 VAL 144 1HG1 VAL 144 123.163 -8.684 -6.841 1031 HG12 VAL 144 2HG1 VAL 144 122.593 -9.332 -5.304 1032 HG13 VAL 144 3HG1 VAL 144 121.862 -7.873 -5.972 1033 HG21 VAL 144 3HG2 VAL 144 122.159 -11.449 -6.110 1034 HG22 VAL 144 1HG2 VAL 144 122.588 -11.160 -7.797 1035 HG23 VAL 144 2HG2 VAL 144 120.985 -11.774 -7.386 1036 H GLY 145 H GLY 145 119.770 -12.110 -5.416 1037 HA2 GLY 145 1HA GLY 145 120.560 -11.473 -2.647 1038 HA3 GLY 145 2HA GLY 145 119.036 -12.304 -2.928 1039 H TYR 146 H TYR 146 121.135 -13.316 -1.377 1040 HA TYR 146 HA TYR 146 121.980 -15.670 -2.965 1041 HB2 TYR 146 1HB TYR 146 123.445 -14.417 -0.638 1042 HB3 TYR 146 2HB TYR 146 123.964 -15.811 -1.565 1043 HD1 TYR 146 HD1 TYR 146 124.752 -15.533 -3.908 1044 HD2 TYR 146 HD2 TYR 146 123.749 -12.173 -1.428 1045 HE1 TYR 146 HE1 TYR 146 125.959 -14.024 -5.463 1046 HE2 TYR 146 HE2 TYR 146 124.955 -10.664 -2.984 1047 HH TYR 146 HH TYR 146 125.577 -10.768 -5.531 1048 H ARG 147 H ARG 147 121.700 -17.668 -1.993 1049 HA ARG 147 HA ARG 147 120.139 -17.661 0.526 1050 HB2 ARG 147 1HB ARG 147 118.957 -18.483 -1.517 1051 HB3 ARG 147 2HB ARG 147 120.166 -19.759 -1.655 1052 HG2 ARG 147 1HG ARG 147 119.556 -20.621 0.553 1053 HG3 ARG 147 2HG ARG 147 118.393 -19.311 0.764 1054 HD2 ARG 147 1HD ARG 147 117.162 -21.251 0.036 1055 HD3 ARG 147 2HD ARG 147 117.223 -20.123 -1.315 1056 HE ARG 147 HE ARG 147 119.384 -21.687 -1.765 1057 HH11 ARG 147 1HH1 ARG 147 116.037 -22.503 -1.091 1058 HH12 ARG 147 2HH1 ARG 147 116.112 -23.982 -1.990 1059 HH21 ARG 147 1HH2 ARG 147 119.421 -23.601 -2.908 1060 HH22 ARG 147 2HH2 ARG 147 118.005 -24.595 -3.006 1061 H PHE 148 H PHE 148 120.850 -18.827 2.228 1062 HA PHE 148 HA PHE 148 122.987 -20.803 1.821 1063 HB2 PHE 148 1HB PHE 148 124.060 -18.636 2.363 1064 HB3 PHE 148 2HB PHE 148 123.128 -18.568 3.846 1065 HD1 PHE 148 HD1 PHE 148 123.658 -20.031 5.735 1066 HD2 PHE 148 HD2 PHE 148 125.923 -20.181 2.088 1067 HE1 PHE 148 HE1 PHE 148 125.429 -21.331 6.887 1068 HE2 PHE 148 HE2 PHE 148 127.693 -21.480 3.241 1069 HZ PHE 148 HZ PHE 148 127.446 -22.055 5.640 Start of MODEL 10 1 H1 ALA 1 3H ALA 1 115.542 -23.967 8.970 2 H2 ALA 1 2H ALA 1 116.173 -24.076 10.543 3 H3 ALA 1 HT3 ALA 1 117.208 -24.189 9.201 4 HA ALA 1 HA ALA 1 115.583 -21.769 9.638 5 HB1 ALA 1 2HB ALA 1 118.390 -22.140 10.698 6 HB2 ALA 1 3HB ALA 1 116.966 -22.400 11.705 7 HB3 ALA 1 1HB ALA 1 117.276 -20.808 11.010 8 H THR 2 H THR 2 115.784 -20.603 7.840 9 HA THR 2 HA THR 2 118.257 -20.864 6.223 10 HB THR 2 HB THR 2 115.461 -20.326 5.196 11 HG1 THR 2 HG1 THR 2 117.056 -22.666 5.074 12 HG21 THR 2 3HG2 THR 2 117.036 -19.373 3.698 13 HG22 THR 2 1HG2 THR 2 116.664 -20.955 3.014 14 HG23 THR 2 2HG2 THR 2 118.164 -20.712 3.909 15 H SER 3 H SER 3 119.193 -19.006 5.498 16 HA SER 3 HA SER 3 117.899 -16.445 6.251 17 HB2 SER 3 1HB SER 3 119.803 -17.020 7.750 18 HB3 SER 3 2HB SER 3 120.857 -17.087 6.341 19 HG SER 3 HG SER 3 120.153 -14.974 7.756 20 H THR 4 H THR 4 117.962 -14.826 4.770 21 HA THR 4 HA THR 4 119.446 -15.298 2.253 22 HB THR 4 HB THR 4 117.572 -14.400 0.989 23 HG1 THR 4 HG1 THR 4 115.919 -13.493 1.942 24 HG21 THR 4 3HG2 THR 4 116.305 -16.423 2.813 25 HG22 THR 4 1HG2 THR 4 117.689 -16.884 1.821 26 HG23 THR 4 2HG2 THR 4 116.212 -16.296 1.056 27 H VAL 5 H VAL 5 120.591 -13.590 1.522 28 HA VAL 5 HA VAL 5 120.144 -10.958 2.827 29 HB VAL 5 HB VAL 5 122.578 -10.565 2.587 30 HG11 VAL 5 1HG1 VAL 5 121.594 -11.510 4.685 31 HG12 VAL 5 2HG1 VAL 5 123.268 -11.999 4.428 32 HG13 VAL 5 3HG1 VAL 5 121.956 -13.127 4.084 33 HG21 VAL 5 3HG2 VAL 5 124.008 -12.606 2.144 34 HG22 VAL 5 1HG2 VAL 5 123.112 -12.029 0.739 35 HG23 VAL 5 2HG2 VAL 5 122.543 -13.442 1.629 36 H THR 6 H THR 6 119.829 -9.282 1.452 37 HA THR 6 HA THR 6 120.519 -9.651 -1.394 38 HB THR 6 HB THR 6 118.351 -8.997 -2.150 39 HG1 THR 6 HG1 THR 6 117.819 -7.501 -0.619 40 HG21 THR 6 3HG2 THR 6 117.329 -10.780 -0.032 41 HG22 THR 6 1HG2 THR 6 118.734 -11.405 -0.897 42 HG23 THR 6 2HG2 THR 6 117.276 -10.966 -1.784 43 H GLY 7 H GLY 7 120.329 -7.643 -2.637 44 HA2 GLY 7 1HA GLY 7 119.879 -5.171 -1.152 45 HA3 GLY 7 2HA GLY 7 121.473 -5.342 -1.892 46 H GLY 8 H GLY 8 119.264 -3.442 -2.541 47 HA2 GLY 8 1HA GLY 8 119.386 -3.850 -5.429 48 HA3 GLY 8 2HA GLY 8 117.774 -3.861 -4.725 49 H TYR 9 H TYR 9 118.268 -2.048 -6.585 50 HA TYR 9 HA TYR 9 118.555 0.508 -5.125 51 HB2 TYR 9 1HB TYR 9 119.600 1.490 -7.048 52 HB3 TYR 9 2HB TYR 9 120.491 0.047 -6.605 53 HD1 TYR 9 HD2 TYR 9 120.475 -1.934 -8.046 54 HD2 TYR 9 HD1 TYR 9 118.302 1.618 -9.104 55 HE1 TYR 9 HE2 TYR 9 120.224 -2.778 -10.365 56 HE2 TYR 9 HE1 TYR 9 118.052 0.774 -11.423 57 HH TYR 9 HH TYR 9 118.358 -2.256 -12.318 58 H ALA 10 H ALA 10 117.089 2.111 -5.610 59 HA ALA 10 HA ALA 10 115.067 1.554 -7.679 60 HB1 ALA 10 1HB ALA 10 113.265 1.716 -6.246 61 HB2 ALA 10 2HB ALA 10 114.160 2.658 -5.053 62 HB3 ALA 10 3HB ALA 10 114.434 0.921 -5.192 63 H GLN 11 H GLN 11 114.161 3.349 -8.624 64 HA GLN 11 HA GLN 11 115.038 6.006 -7.656 65 HB2 GLN 11 1HB GLN 11 114.634 5.174 -10.542 66 HB3 GLN 11 2HB GLN 11 115.150 6.759 -9.973 67 HG2 GLN 11 1HG GLN 11 116.671 4.161 -9.608 68 HG3 GLN 11 2HG GLN 11 117.081 5.445 -10.742 69 HE21 GLN 11 1HE2 GLN 11 118.227 4.255 -7.974 70 HE22 GLN 11 2HE2 GLN 11 118.709 5.675 -7.179 71 H SER 12 H SER 12 113.442 7.609 -7.623 72 HA SER 12 HA SER 12 110.702 6.674 -8.293 73 HB2 SER 12 1HB SER 12 111.534 8.399 -5.950 74 HB3 SER 12 2HB SER 12 109.897 7.878 -6.333 75 HG SER 12 HG SER 12 112.133 6.245 -5.682 76 H ASP 13 H ASP 13 109.395 8.057 -9.336 77 HA ASP 13 HA ASP 13 110.360 10.817 -9.815 78 HB2 ASP 13 1HB ASP 13 109.353 10.713 -12.035 79 HB3 ASP 13 2HB ASP 13 110.537 9.425 -11.852 80 H ALA 14 H ALA 14 108.835 12.438 -9.632 81 HA ALA 14 HA ALA 14 106.312 11.611 -8.347 82 HB1 ALA 14 1HB ALA 14 108.211 13.100 -7.214 83 HB2 ALA 14 2HB ALA 14 106.498 13.390 -6.913 84 HB3 ALA 14 3HB ALA 14 107.369 14.385 -8.080 85 H GLN 15 H GLN 15 104.798 11.606 -9.833 86 HA GLN 15 HA GLN 15 104.644 13.544 -11.970 87 HB2 GLN 15 1HB GLN 15 103.844 11.196 -12.229 88 HB3 GLN 15 2HB GLN 15 102.568 11.536 -11.061 89 HG2 GLN 15 1HG GLN 15 101.805 13.419 -12.542 90 HG3 GLN 15 2HG GLN 15 102.977 12.880 -13.745 91 HE21 GLN 15 1HE2 GLN 15 101.942 11.665 -15.325 92 HE22 GLN 15 2HE2 GLN 15 100.689 10.558 -15.037 93 H GLY 16 H GLY 16 103.795 15.463 -11.831 94 HA2 GLY 16 1HA GLY 16 102.330 17.175 -11.238 95 HA3 GLY 16 2HA GLY 16 101.593 16.111 -10.049 96 H GLN 17 H GLN 17 104.536 15.578 -9.099 97 HA GLN 17 HA GLN 17 104.941 18.132 -7.658 98 HB2 GLN 17 1HB GLN 17 104.331 16.181 -6.216 99 HB3 GLN 17 2HB GLN 17 105.783 15.359 -6.782 100 HG2 GLN 17 1HG GLN 17 106.343 16.403 -4.695 101 HG3 GLN 17 2HG GLN 17 107.113 17.353 -5.962 102 HE21 GLN 17 1HE2 GLN 17 107.023 19.471 -5.129 103 HE22 GLN 17 2HE2 GLN 17 105.594 20.230 -4.618 104 H MET 18 H MET 18 107.026 19.003 -7.641 105 HA MET 18 HA MET 18 108.874 17.935 -9.628 106 HB2 MET 18 1HB MET 18 109.035 20.388 -7.858 107 HB3 MET 18 2HB MET 18 110.198 19.969 -9.115 108 HG2 MET 18 1HG MET 18 108.301 19.967 -10.770 109 HG3 MET 18 2HG MET 18 107.258 20.591 -9.492 110 HE1 MET 18 3HE MET 18 111.126 21.460 -10.419 111 HE2 MET 18 1HE MET 18 110.694 22.605 -11.695 112 HE3 MET 18 2HE MET 18 110.128 20.939 -11.775 113 H ASN 19 H ASN 19 109.821 16.083 -8.825 114 HA ASN 19 HA ASN 19 111.862 16.358 -6.858 115 HB2 ASN 19 1HB ASN 19 109.747 16.314 -5.451 116 HB3 ASN 19 2HB ASN 19 109.544 14.643 -5.974 117 HD21 ASN 19 1HD2 ASN 19 110.413 13.186 -4.506 118 HD22 ASN 19 2HD2 ASN 19 111.765 13.480 -3.522 119 H LYS 20 H LYS 20 113.344 14.819 -7.090 120 HA LYS 20 HA LYS 20 112.587 12.204 -8.227 121 HB2 LYS 20 1HB LYS 20 113.594 13.626 -10.016 122 HB3 LYS 20 2HB LYS 20 115.044 13.792 -9.024 123 HG2 LYS 20 1HG LYS 20 115.396 11.375 -9.070 124 HG3 LYS 20 2HG LYS 20 113.898 11.149 -9.975 125 HD2 LYS 20 1HD LYS 20 115.726 11.096 -11.556 126 HD3 LYS 20 2HD LYS 20 114.860 12.615 -11.785 127 HE2 LYS 20 1HE LYS 20 116.521 13.852 -10.585 128 HE3 LYS 20 2HE LYS 20 117.290 12.377 -9.998 129 HZ1 LYS 20 3HZ LYS 20 117.118 13.193 -12.849 130 HZ2 LYS 20 1HZ LYS 20 117.912 11.821 -12.246 131 HZ3 LYS 20 2HZ LYS 20 118.491 13.371 -11.863 132 H MET 21 H MET 21 113.589 10.471 -7.191 133 HA MET 21 HA MET 21 115.560 11.179 -5.085 134 HB2 MET 21 1HB MET 21 113.073 9.492 -4.748 135 HB3 MET 21 2HB MET 21 114.325 9.715 -3.525 136 HG2 MET 21 1HG MET 21 113.924 12.190 -3.650 137 HG3 MET 21 2HG MET 21 112.562 11.869 -4.723 138 HE1 MET 21 3HE MET 21 111.385 8.985 -3.183 139 HE2 MET 21 1HE MET 21 110.848 10.244 -4.303 140 HE3 MET 21 2HE MET 21 110.018 10.014 -2.765 141 H GLY 22 H GLY 22 116.987 9.563 -4.471 142 HA2 GLY 22 1HA GLY 22 116.818 6.988 -5.934 143 HA3 GLY 22 2HA GLY 22 118.347 7.853 -5.761 144 H GLY 23 H GLY 23 117.138 5.187 -4.657 145 HA2 GLY 23 1HA GLY 23 118.207 5.525 -1.953 146 HA3 GLY 23 2HA GLY 23 116.525 5.039 -2.081 147 H PHE 24 H PHE 24 118.177 3.443 -0.739 148 HA PHE 24 HA PHE 24 118.615 1.132 -2.546 149 HB2 PHE 24 1HB PHE 24 120.255 1.924 -0.132 150 HB3 PHE 24 2HB PHE 24 120.453 0.440 -1.045 151 HD1 PHE 24 HD1 PHE 24 121.317 0.516 -3.382 152 HD2 PHE 24 HD2 PHE 24 121.117 4.022 -0.906 153 HE1 PHE 24 HE1 PHE 24 122.875 1.687 -4.915 154 HE2 PHE 24 HE2 PHE 24 122.676 5.193 -2.440 155 HZ PHE 24 HZ PHE 24 123.554 4.025 -4.444 156 H ASN 25 H ASN 25 118.251 -0.964 -1.543 157 HA ASN 25 HA ASN 25 116.795 -0.902 1.008 158 HB2 ASN 25 1HB ASN 25 114.917 -2.178 0.062 159 HB3 ASN 25 2HB ASN 25 115.070 -0.592 -0.690 160 HD21 ASN 25 1HD2 ASN 25 114.553 -0.846 -2.867 161 HD22 ASN 25 2HD2 ASN 25 115.136 -2.091 -3.863 162 H LEU 26 H LEU 26 116.692 -2.853 2.105 163 HA LEU 26 HA LEU 26 118.221 -5.114 0.949 164 HB2 LEU 26 1HB LEU 26 118.114 -4.310 3.870 165 HB3 LEU 26 2HB LEU 26 119.052 -5.631 3.177 166 HG LEU 26 HG LEU 26 119.424 -2.698 2.495 167 HD11 LEU 26 1HD1 LEU 26 120.142 -3.171 4.787 168 HD12 LEU 26 2HD1 LEU 26 121.558 -2.962 3.756 169 HD13 LEU 26 3HD1 LEU 26 121.047 -4.581 4.235 170 HD21 LEU 26 3HD2 LEU 26 121.554 -3.604 1.467 171 HD22 LEU 26 1HD2 LEU 26 120.078 -4.095 0.638 172 HD23 LEU 26 2HD2 LEU 26 120.904 -5.225 1.710 173 H LYS 27 H LYS 27 117.355 -7.214 1.405 174 HA LYS 27 HA LYS 27 114.653 -7.192 2.639 175 HB2 LYS 27 1HB LYS 27 114.553 -7.275 0.142 176 HB3 LYS 27 2HB LYS 27 115.453 -8.788 0.199 177 HG2 LYS 27 1HG LYS 27 113.694 -9.835 1.524 178 HG3 LYS 27 2HG LYS 27 112.799 -8.314 1.580 179 HD2 LYS 27 1HD LYS 27 111.834 -9.677 -0.175 180 HD3 LYS 27 2HD LYS 27 112.715 -8.353 -0.936 181 HE2 LYS 27 1HE LYS 27 114.502 -9.747 -1.577 182 HE3 LYS 27 2HE LYS 27 114.058 -10.999 -0.417 183 HZ1 LYS 27 3HZ LYS 27 111.884 -11.065 -1.798 184 HZ2 LYS 27 1HZ LYS 27 113.266 -11.865 -2.372 185 HZ3 LYS 27 2HZ LYS 27 112.836 -10.349 -3.010 186 H TYR 28 H TYR 28 114.232 -8.748 4.051 187 HA TYR 28 HA TYR 28 116.130 -11.014 4.296 188 HB2 TYR 28 1HB TYR 28 114.627 -9.579 6.488 189 HB3 TYR 28 2HB TYR 28 115.652 -10.985 6.709 190 HD1 TYR 28 HD2 TYR 28 118.089 -10.799 6.576 191 HD2 TYR 28 HD1 TYR 28 115.556 -7.373 6.039 192 HE1 TYR 28 HE2 TYR 28 120.049 -9.306 6.855 193 HE2 TYR 28 HE1 TYR 28 117.515 -5.880 6.318 194 HH TYR 28 HH TYR 28 120.546 -6.745 5.976 195 H ARG 29 H ARG 29 115.288 -13.044 4.535 196 HA ARG 29 HA ARG 29 112.338 -13.289 4.378 197 HB2 ARG 29 1HB ARG 29 114.465 -15.011 3.086 198 HB3 ARG 29 2HB ARG 29 112.734 -15.345 3.053 199 HG2 ARG 29 1HG ARG 29 112.339 -13.180 1.939 200 HG3 ARG 29 2HG ARG 29 114.073 -12.863 1.941 201 HD2 ARG 29 1HD ARG 29 113.514 -13.752 -0.227 202 HD3 ARG 29 2HD ARG 29 114.378 -15.010 0.650 203 HE ARG 29 HE ARG 29 111.492 -15.122 0.911 204 HH11 ARG 29 1HH1 ARG 29 114.254 -16.225 -0.954 205 HH12 ARG 29 2HH1 ARG 29 113.410 -17.604 -1.577 206 HH21 ARG 29 1HH2 ARG 29 110.456 -16.913 0.077 207 HH22 ARG 29 2HH2 ARG 29 111.287 -17.988 -1.000 208 H TYR 30 H TYR 30 111.336 -14.754 5.671 209 HA TYR 30 HA TYR 30 113.023 -16.487 7.383 210 HB2 TYR 30 1HB TYR 30 112.106 -14.513 8.602 211 HB3 TYR 30 2HB TYR 30 110.490 -15.062 8.203 212 HD1 TYR 30 HD1 TYR 30 113.611 -16.012 10.003 213 HD2 TYR 30 HD2 TYR 30 109.392 -16.674 9.544 214 HE1 TYR 30 HE1 TYR 30 113.610 -17.423 12.042 215 HE2 TYR 30 HE2 TYR 30 109.392 -18.085 11.582 216 HH TYR 30 HH TYR 30 112.190 -19.295 12.981 217 H GLU 31 H GLU 31 112.332 -18.585 7.615 218 HA GLU 31 HA GLU 31 109.785 -19.326 6.298 219 HB2 GLU 31 1HB GLU 31 112.461 -20.692 5.949 220 HB3 GLU 31 2HB GLU 31 110.926 -21.271 5.301 221 HG2 GLU 31 1HG GLU 31 112.193 -18.593 4.660 222 HG3 GLU 31 2HG GLU 31 112.222 -20.003 3.609 223 H GLU 32 H GLU 32 108.719 -21.113 7.105 224 HA GLU 32 HA GLU 32 109.587 -22.027 9.758 225 HB2 GLU 32 1HB GLU 32 106.966 -22.337 8.279 226 HB3 GLU 32 2HB GLU 32 107.285 -22.980 9.890 227 HG2 GLU 32 1HG GLU 32 107.486 -20.055 9.122 228 HG3 GLU 32 2HG GLU 32 106.126 -20.783 9.973 229 H ASP 33 H ASP 33 109.819 -24.222 10.267 230 HA ASP 33 HA ASP 33 111.062 -25.716 8.181 231 HB2 ASP 33 1HB ASP 33 110.356 -26.479 11.018 232 HB3 ASP 33 2HB ASP 33 111.365 -27.441 9.941 233 H ASN 34 H ASN 34 107.979 -26.169 9.949 234 HA ASN 34 HA ASN 34 107.466 -28.548 8.273 235 HB2 ASN 34 1HB ASN 34 105.871 -29.217 9.962 236 HB3 ASN 34 2HB ASN 34 107.420 -28.853 10.715 237 HD21 ASN 34 1HD2 ASN 34 104.981 -28.785 12.213 238 HD22 ASN 34 2HD2 ASN 34 104.677 -27.175 12.663 239 H SER 35 H SER 35 106.423 -25.292 8.592 240 HA SER 35 HA SER 35 104.352 -25.813 6.594 241 HB2 SER 35 1HB SER 35 102.841 -24.180 7.943 242 HB3 SER 35 2HB SER 35 102.920 -25.864 8.446 243 HG SER 35 HG SER 35 103.209 -24.372 10.186 244 HA PRO 36 HA PRO 36 107.214 -22.255 6.016 245 HB2 PRO 36 1HB PRO 36 107.475 -22.389 3.292 246 HB3 PRO 36 2HB PRO 36 108.434 -23.365 4.422 247 HG2 PRO 36 1HG PRO 36 106.048 -24.127 2.824 248 HG3 PRO 36 2HG PRO 36 107.508 -25.061 3.194 249 HD2 PRO 36 1HD PRO 36 105.142 -25.441 4.506 250 HD3 PRO 36 2HD PRO 36 106.725 -25.739 5.257 251 H LEU 37 H LEU 37 106.612 -20.239 5.890 252 HA LEU 37 HA LEU 37 104.554 -19.389 3.946 253 HB2 LEU 37 1HB LEU 37 103.728 -19.260 6.307 254 HB3 LEU 37 2HB LEU 37 105.069 -18.178 6.679 255 HG LEU 37 HG LEU 37 104.236 -16.702 4.772 256 HD11 LEU 37 1HD1 LEU 37 101.901 -18.610 5.059 257 HD12 LEU 37 2HD1 LEU 37 102.817 -18.249 3.596 258 HD13 LEU 37 3HD1 LEU 37 101.761 -17.024 4.300 259 HD21 LEU 37 3HD2 LEU 37 102.478 -15.683 6.179 260 HD22 LEU 37 1HD2 LEU 37 103.864 -16.165 7.157 261 HD23 LEU 37 2HD2 LEU 37 102.403 -17.153 7.151 262 H GLY 38 H GLY 38 105.178 -17.561 2.677 263 HA2 GLY 38 1HA GLY 38 108.057 -16.996 2.909 264 HA3 GLY 38 2HA GLY 38 107.046 -16.672 1.498 265 H VAL 39 H VAL 39 108.618 -15.228 4.017 266 HA VAL 39 HA VAL 39 106.834 -12.863 3.915 267 HB VAL 39 HB VAL 39 107.415 -12.416 6.274 268 HG11 VAL 39 1HG1 VAL 39 106.178 -15.126 5.706 269 HG12 VAL 39 2HG1 VAL 39 105.331 -13.581 5.796 270 HG13 VAL 39 3HG1 VAL 39 106.054 -14.278 7.247 271 HG21 VAL 39 3HG2 VAL 39 108.802 -15.095 6.016 272 HG22 VAL 39 1HG2 VAL 39 108.389 -14.372 7.570 273 HG23 VAL 39 2HG2 VAL 39 109.524 -13.559 6.491 274 H ILE 40 H ILE 40 107.802 -11.076 3.322 275 HA ILE 40 HA ILE 40 110.748 -10.874 3.600 276 HB ILE 40 HB ILE 40 110.699 -9.441 1.570 277 HG12 ILE 40 1HG1 ILE 40 107.904 -10.526 1.146 278 HG13 ILE 40 2HG1 ILE 40 108.217 -8.912 1.780 279 HG21 ILE 40 1HG2 ILE 40 109.997 -12.346 1.575 280 HG22 ILE 40 2HG2 ILE 40 111.453 -11.534 1.000 281 HG23 ILE 40 3HG2 ILE 40 109.989 -11.508 0.023 282 HD11 ILE 40 3HD1 ILE 40 107.905 -8.751 -0.621 283 HD12 ILE 40 1HD1 ILE 40 109.118 -9.999 -0.899 284 HD13 ILE 40 2HD1 ILE 40 109.597 -8.431 -0.249 285 H GLY 41 H GLY 41 111.503 -9.160 4.592 286 HA2 GLY 41 1HA GLY 41 109.729 -6.808 4.976 287 HA3 GLY 41 2HA GLY 41 110.913 -7.335 6.176 288 H SER 42 H SER 42 110.487 -4.938 4.136 289 HA SER 42 HA SER 42 113.330 -4.817 3.318 290 HB2 SER 42 1HB SER 42 111.840 -5.280 1.375 291 HB3 SER 42 2HB SER 42 110.976 -3.787 1.723 292 HG SER 42 HG SER 42 113.476 -4.207 0.618 293 H PHE 43 H PHE 43 114.383 -2.979 3.766 294 HA PHE 43 HA PHE 43 112.801 -0.662 4.735 295 HB2 PHE 43 1HB PHE 43 115.623 -1.471 5.461 296 HB3 PHE 43 2HB PHE 43 114.780 -0.052 6.052 297 HD1 PHE 43 HD1 PHE 43 112.696 -0.380 7.482 298 HD2 PHE 43 HD2 PHE 43 115.386 -3.579 6.496 299 HE1 PHE 43 HE1 PHE 43 111.786 -1.724 9.358 300 HE2 PHE 43 HE2 PHE 43 114.476 -4.922 8.370 301 HZ PHE 43 HZ PHE 43 112.676 -3.995 9.801 302 H THR 44 H THR 44 112.969 1.147 3.514 303 HA THR 44 HA THR 44 115.170 1.252 1.519 304 HB THR 44 HB THR 44 112.347 2.287 1.176 305 HG1 THR 44 HG1 THR 44 112.162 0.135 1.057 306 HG21 THR 44 3HG2 THR 44 113.015 2.608 -1.141 307 HG22 THR 44 1HG2 THR 44 114.599 1.904 -0.815 308 HG23 THR 44 2HG2 THR 44 114.157 3.452 -0.095 309 H TYR 45 H TYR 45 116.322 3.071 1.417 310 HA TYR 45 HA TYR 45 115.301 5.481 2.813 311 HB2 TYR 45 1HB TYR 45 117.107 4.379 4.105 312 HB3 TYR 45 2HB TYR 45 118.160 4.503 2.709 313 HD1 TYR 45 HD1 TYR 45 116.383 6.402 5.341 314 HD2 TYR 45 HD2 TYR 45 119.232 6.582 2.132 315 HE1 TYR 45 HE1 TYR 45 117.082 8.662 6.088 316 HE2 TYR 45 HE2 TYR 45 119.931 8.841 2.878 317 HH TYR 45 HH TYR 45 119.788 10.071 5.389 318 H THR 46 H THR 46 115.177 7.207 1.514 319 HA THR 46 HA THR 46 116.803 7.232 -0.967 320 HB THR 46 HB THR 46 114.926 8.263 -2.135 321 HG1 THR 46 HG1 THR 46 113.713 8.016 0.398 322 HG21 THR 46 3HG2 THR 46 113.202 6.267 -1.659 323 HG22 THR 46 1HG2 THR 46 114.613 5.590 -0.848 324 HG23 THR 46 2HG2 THR 46 114.700 6.020 -2.554 325 H GLU 47 H GLU 47 117.484 9.238 -1.693 326 HA GLU 47 HA GLU 47 117.045 11.554 0.066 327 HB2 GLU 47 1HB GLU 47 119.129 10.320 0.762 328 HB3 GLU 47 2HB GLU 47 119.789 10.653 -0.838 329 HG2 GLU 47 1HG GLU 47 119.492 13.087 -0.427 330 HG3 GLU 47 2HG GLU 47 118.902 12.726 1.189 331 H LYS 48 H LYS 48 117.331 13.555 -0.961 332 HA LYS 48 HA LYS 48 118.048 13.514 -3.825 333 HB2 LYS 48 1HB LYS 48 115.569 13.675 -3.580 334 HB3 LYS 48 2HB LYS 48 115.791 15.149 -2.636 335 HG2 LYS 48 1HG LYS 48 117.007 16.163 -4.560 336 HG3 LYS 48 2HG LYS 48 116.669 14.714 -5.505 337 HD2 LYS 48 1HD LYS 48 114.228 15.099 -5.148 338 HD3 LYS 48 2HD LYS 48 114.620 16.612 -4.327 339 HE2 LYS 48 1HE LYS 48 115.986 17.131 -6.502 340 HE3 LYS 48 2HE LYS 48 114.956 15.898 -7.228 341 HZ1 LYS 48 3HZ LYS 48 114.327 18.577 -6.542 342 HZ2 LYS 48 1HZ LYS 48 113.279 17.505 -5.745 343 HZ3 LYS 48 2HZ LYS 48 113.417 17.456 -7.439 344 H SER 49 H SER 49 119.453 15.080 -4.408 345 HA SER 49 HA SER 49 120.086 17.180 -2.409 346 HB2 SER 49 1HB SER 49 121.946 15.841 -4.389 347 HB3 SER 49 2HB SER 49 122.386 17.116 -3.258 348 HG SER 49 HG SER 49 121.914 15.720 -1.567 349 H ARG 50 H ARG 50 120.383 19.255 -3.126 350 HA ARG 50 HA ARG 50 120.005 19.788 -6.008 351 HB2 ARG 50 1HB ARG 50 117.858 20.121 -4.778 352 HB3 ARG 50 2HB ARG 50 118.663 21.322 -3.768 353 HG2 ARG 50 1HG ARG 50 119.239 22.609 -5.830 354 HG3 ARG 50 2HG ARG 50 118.305 21.450 -6.777 355 HD2 ARG 50 1HD ARG 50 117.216 23.152 -4.517 356 HD3 ARG 50 2HD ARG 50 116.963 23.452 -6.234 357 HE ARG 50 HE ARG 50 116.107 20.858 -5.799 358 HH11 ARG 50 1HH1 ARG 50 115.212 24.018 -4.554 359 HH12 ARG 50 2HH1 ARG 50 113.570 23.548 -4.263 360 HH21 ARG 50 1HH2 ARG 50 113.981 20.313 -5.404 361 HH22 ARG 50 2HH2 ARG 50 112.883 21.477 -4.740 362 H THR 51 H THR 51 121.250 21.415 -6.820 363 HA THR 51 HA THR 51 122.943 22.921 -4.903 364 HB THR 51 HB THR 51 123.739 21.968 -7.665 365 HG1 THR 51 HG1 THR 51 123.798 20.174 -6.493 366 HG21 THR 51 3HG2 THR 51 124.836 24.045 -6.853 367 HG22 THR 51 1HG2 THR 51 125.970 22.700 -6.980 368 HG23 THR 51 2HG2 THR 51 125.349 23.184 -5.402 369 H ALA 52 H ALA 52 122.859 25.059 -5.073 370 HA ALA 52 HA ALA 52 121.906 26.272 -7.598 371 HB1 ALA 52 1HB ALA 52 120.916 28.059 -5.964 372 HB2 ALA 52 2HB ALA 52 120.970 26.748 -4.786 373 HB3 ALA 52 3HB ALA 52 120.020 26.569 -6.261 374 H SER 53 H SER 53 122.700 28.409 -8.003 375 HA SER 53 HA SER 53 125.409 28.808 -7.371 376 HB2 SER 53 1HB SER 53 125.171 30.969 -8.436 377 HB3 SER 53 2HB SER 53 124.221 29.791 -9.334 378 HG SER 53 HG SER 53 123.431 32.023 -8.034 379 H SER 54 H SER 54 122.463 30.100 -5.887 380 HA SER 54 HA SER 54 123.730 31.928 -4.131 381 HB2 SER 54 1HB SER 54 121.620 31.971 -2.946 382 HB3 SER 54 2HB SER 54 121.299 31.923 -4.676 383 HG SER 54 HG SER 54 120.734 30.099 -2.712 384 H GLY 55 H GLY 55 123.093 28.468 -3.904 385 HA2 GLY 55 1HA GLY 55 124.361 27.005 -2.537 386 HA3 GLY 55 2HA GLY 55 124.778 28.363 -1.505 387 H ASP 56 H ASP 56 121.491 28.602 -2.016 388 HA ASP 56 HA ASP 56 120.924 27.499 0.618 389 HB2 ASP 56 1HB ASP 56 120.014 29.704 -0.090 390 HB3 ASP 56 2HB ASP 56 119.074 28.886 -1.336 391 H TYR 57 H TYR 57 120.317 25.454 0.883 392 HA TYR 57 HA TYR 57 118.564 24.211 -1.130 393 HB2 TYR 57 1HB TYR 57 119.843 22.185 -1.153 394 HB3 TYR 57 2HB TYR 57 120.904 23.517 -1.564 395 HD1 TYR 57 HD2 TYR 57 122.685 24.225 -0.038 396 HD2 TYR 57 HD1 TYR 57 120.069 20.961 0.941 397 HE1 TYR 57 HE2 TYR 57 124.235 23.523 1.765 398 HE2 TYR 57 HE1 TYR 57 121.620 20.260 2.745 399 HH TYR 57 HH TYR 57 124.507 20.821 3.006 400 H ASN 58 H ASN 58 117.234 22.539 -0.342 401 HA ASN 58 HA ASN 58 116.912 22.543 2.601 402 HB2 ASN 58 1HB ASN 58 115.017 23.467 1.265 403 HB3 ASN 58 2HB ASN 58 114.849 21.895 0.483 404 HD21 ASN 58 1HD2 ASN 58 114.849 23.396 3.758 405 HD22 ASN 58 2HD2 ASN 58 113.774 22.267 4.432 406 H LYS 59 H LYS 59 117.163 20.673 3.676 407 HA LYS 59 HA LYS 59 117.842 18.287 2.129 408 HB2 LYS 59 1HB LYS 59 117.982 18.816 5.107 409 HB3 LYS 59 2HB LYS 59 118.614 17.390 4.283 410 HG2 LYS 59 1HG LYS 59 120.031 18.952 2.879 411 HG3 LYS 59 2HG LYS 59 119.536 20.256 3.959 412 HD2 LYS 59 1HD LYS 59 120.903 17.705 4.862 413 HD3 LYS 59 2HD LYS 59 121.724 19.245 4.614 414 HE2 LYS 59 1HE LYS 59 120.095 20.262 6.272 415 HE3 LYS 59 2HE LYS 59 119.560 18.622 6.637 416 HZ1 LYS 59 3HZ LYS 59 122.411 19.397 6.754 417 HZ2 LYS 59 1HZ LYS 59 121.658 18.042 7.445 418 HZ3 LYS 59 2HZ LYS 59 121.376 19.590 8.087 419 H ASN 60 H ASN 60 116.416 16.746 1.726 420 HA ASN 60 HA ASN 60 114.216 16.271 3.651 421 HB2 ASN 60 1HB ASN 60 114.086 16.160 0.628 422 HB3 ASN 60 2HB ASN 60 112.794 15.653 1.715 423 HD21 ASN 60 1HD2 ASN 60 112.784 17.674 3.632 424 HD22 ASN 60 2HD2 ASN 60 112.431 19.164 2.900 425 H GLN 61 H GLN 61 114.078 14.208 4.360 426 HA GLN 61 HA GLN 61 115.426 12.094 2.762 427 HB2 GLN 61 1HB GLN 61 115.385 12.416 5.774 428 HB3 GLN 61 2HB GLN 61 116.020 11.011 4.916 429 HG2 GLN 61 1HG GLN 61 117.673 12.405 3.781 430 HG3 GLN 61 2HG GLN 61 117.009 13.850 4.537 431 HE21 GLN 61 1HE2 GLN 61 119.747 13.090 4.900 432 HE22 GLN 61 2HE2 GLN 61 119.968 12.656 6.527 433 H TYR 62 H TYR 62 114.348 10.130 2.615 434 HA TYR 62 HA TYR 62 111.723 9.955 3.987 435 HB2 TYR 62 1HB TYR 62 112.322 9.162 1.139 436 HB3 TYR 62 2HB TYR 62 110.791 8.954 1.964 437 HD1 TYR 62 HD2 TYR 62 113.086 11.342 0.379 438 HD2 TYR 62 HD1 TYR 62 109.322 10.868 2.393 439 HE1 TYR 62 HE2 TYR 62 112.403 13.607 -0.367 440 HE2 TYR 62 HE1 TYR 62 108.639 13.133 1.647 441 HH TYR 62 HH TYR 62 109.178 14.731 -0.103 442 H TYR 63 H TYR 63 111.189 8.002 4.812 443 HA TYR 63 HA TYR 63 112.928 5.688 4.204 444 HB2 TYR 63 1HB TYR 63 113.601 6.806 6.347 445 HB3 TYR 63 2HB TYR 63 111.993 6.484 6.965 446 HD1 TYR 63 HD1 TYR 63 111.308 4.205 7.562 447 HD2 TYR 63 HD2 TYR 63 115.243 5.040 6.054 448 HE1 TYR 63 HE1 TYR 63 112.080 1.979 8.339 449 HE2 TYR 63 HE2 TYR 63 116.013 2.814 6.829 450 HH TYR 63 HH TYR 63 115.394 0.855 7.691 451 H GLY 64 H GLY 64 111.832 3.734 4.075 452 HA2 GLY 64 1HA GLY 64 108.935 3.780 4.692 453 HA3 GLY 64 2HA GLY 64 109.496 3.297 3.096 454 H ILE 65 H ILE 65 108.126 1.925 5.499 455 HA ILE 65 HA ILE 65 109.913 -0.442 5.593 456 HB ILE 65 HB ILE 65 109.599 0.585 7.808 457 HG12 ILE 65 1HG1 ILE 65 107.921 -1.924 7.691 458 HG13 ILE 65 2HG1 ILE 65 109.665 -1.957 7.427 459 HG21 ILE 65 1HG2 ILE 65 107.376 1.615 7.288 460 HG22 ILE 65 2HG2 ILE 65 107.405 0.751 8.824 461 HG23 ILE 65 3HG2 ILE 65 106.651 0.012 7.410 462 HD11 ILE 65 3HD1 ILE 65 108.220 -0.982 9.906 463 HD12 ILE 65 1HD1 ILE 65 109.953 -0.789 9.635 464 HD13 ILE 65 2HD1 ILE 65 109.256 -2.403 9.773 465 H THR 66 H THR 66 109.112 -2.293 4.752 466 HA THR 66 HA THR 66 106.223 -2.408 4.117 467 HB THR 66 HB THR 66 106.740 -3.348 1.930 468 HG1 THR 66 HG1 THR 66 108.637 -4.136 1.632 469 HG21 THR 66 3HG2 THR 66 108.096 -0.720 2.572 470 HG22 THR 66 1HG2 THR 66 106.488 -0.973 1.895 471 HG23 THR 66 2HG2 THR 66 107.917 -1.325 0.926 472 H ALA 67 H ALA 67 105.378 -4.524 3.810 473 HA ALA 67 HA ALA 67 107.079 -6.824 4.405 474 HB1 ALA 67 1HB ALA 67 105.115 -7.572 6.005 475 HB2 ALA 67 2HB ALA 67 104.875 -5.835 6.179 476 HB3 ALA 67 3HB ALA 67 106.422 -6.559 6.618 477 H GLY 68 H GLY 68 106.243 -8.747 3.503 478 HA2 GLY 68 1HA GLY 68 103.612 -8.603 2.224 479 HA3 GLY 68 2HA GLY 68 105.003 -8.762 1.174 480 HA PRO 69 HA PRO 69 104.108 -13.120 2.871 481 HB2 PRO 69 1HB PRO 69 101.773 -13.967 1.770 482 HB3 PRO 69 2HB PRO 69 101.861 -13.271 3.401 483 HG2 PRO 69 1HG PRO 69 100.991 -12.011 0.854 484 HG3 PRO 69 2HG PRO 69 100.329 -11.834 2.490 485 HD2 PRO 69 1HD PRO 69 101.995 -9.985 1.327 486 HD3 PRO 69 2HD PRO 69 101.851 -10.217 3.082 487 H ALA 70 H ALA 70 104.269 -15.060 1.368 488 HA ALA 70 HA ALA 70 104.404 -14.338 -1.477 489 HB1 ALA 70 1HB ALA 70 106.713 -15.673 -1.368 490 HB2 ALA 70 2HB ALA 70 106.725 -15.009 0.266 491 HB3 ALA 70 3HB ALA 70 106.634 -13.929 -1.121 492 H TYR 71 H TYR 71 104.452 -16.153 -2.899 493 HA TYR 71 HA TYR 71 103.631 -18.707 -1.640 494 HB2 TYR 71 1HB TYR 71 102.620 -17.492 -4.217 495 HB3 TYR 71 2HB TYR 71 102.171 -19.064 -3.583 496 HD1 TYR 71 HD2 TYR 71 100.664 -19.266 -1.665 497 HD2 TYR 71 HD1 TYR 71 101.779 -15.427 -3.238 498 HE1 TYR 71 HE2 TYR 71 98.820 -18.207 -0.388 499 HE2 TYR 71 HE1 TYR 71 99.935 -14.368 -1.961 500 HH TYR 71 HH TYR 71 97.673 -15.161 -1.003 501 H ARG 72 H ARG 72 104.791 -20.439 -2.248 502 HA ARG 72 HA ARG 72 106.734 -20.089 -4.457 503 HB2 ARG 72 1HB ARG 72 106.836 -21.858 -2.002 504 HB3 ARG 72 2HB ARG 72 108.039 -21.858 -3.292 505 HG2 ARG 72 1HG ARG 72 108.419 -19.423 -2.877 506 HG3 ARG 72 2HG ARG 72 107.313 -19.516 -1.507 507 HD2 ARG 72 1HD ARG 72 109.891 -21.076 -1.828 508 HD3 ARG 72 2HD ARG 72 109.623 -19.729 -0.727 509 HE ARG 72 HE ARG 72 107.709 -21.411 0.072 510 HH11 ARG 72 1HH1 ARG 72 111.080 -22.076 -0.652 511 HH12 ARG 72 2HH1 ARG 72 111.161 -23.399 0.464 512 HH21 ARG 72 1HH2 ARG 72 107.875 -23.123 1.492 513 HH22 ARG 72 2HH2 ARG 72 109.369 -23.983 1.661 514 H ILE 73 H ILE 73 106.796 -21.521 -6.090 515 HA ILE 73 HA ILE 73 104.899 -23.797 -6.021 516 HB ILE 73 HB ILE 73 105.748 -22.133 -8.407 517 HG12 ILE 73 1HG1 ILE 73 103.058 -22.306 -7.018 518 HG13 ILE 73 2HG1 ILE 73 104.207 -20.990 -6.784 519 HG21 ILE 73 1HG2 ILE 73 105.261 -24.503 -8.951 520 HG22 ILE 73 2HG2 ILE 73 104.024 -23.428 -9.603 521 HG23 ILE 73 3HG2 ILE 73 103.702 -24.361 -8.142 522 HD11 ILE 73 3HD1 ILE 73 104.160 -20.645 -9.300 523 HD12 ILE 73 1HD1 ILE 73 102.659 -20.250 -8.460 524 HD13 ILE 73 2HD1 ILE 73 102.801 -21.768 -9.348 525 H ASN 74 H ASN 74 105.637 -25.769 -6.699 526 HA ASN 74 HA ASN 74 108.387 -26.308 -6.425 527 HB2 ASN 74 1HB ASN 74 106.583 -27.964 -6.025 528 HB3 ASN 74 2HB ASN 74 106.287 -28.028 -7.762 529 HD21 ASN 74 1HD2 ASN 74 108.926 -28.527 -5.361 530 HD22 ASN 74 2HD2 ASN 74 109.727 -29.712 -6.276 531 H ASP 75 H ASP 75 110.015 -26.082 -7.791 532 HA ASP 75 HA ASP 75 111.216 -25.717 -9.710 533 HB2 ASP 75 1HB ASP 75 109.060 -27.525 -10.823 534 HB3 ASP 75 2HB ASP 75 110.556 -27.113 -11.656 535 H TRP 76 H TRP 76 109.334 -23.700 -9.056 536 HA TRP 76 HA TRP 76 109.102 -22.461 -11.673 537 HB2 TRP 76 1HB TRP 76 106.723 -23.130 -9.969 538 HB3 TRP 76 2HB TRP 76 106.694 -21.772 -11.080 539 HD1 TRP 76 HD1 TRP 76 106.031 -25.377 -10.887 540 HE1 TRP 76 HE1 TRP 76 105.697 -26.376 -13.238 541 HE3 TRP 76 HE3 TRP 76 107.757 -21.509 -13.738 542 HZ2 TRP 76 HZ2 TRP 76 106.108 -25.631 -15.974 543 HZ3 TRP 76 HZ3 TRP 76 107.775 -21.679 -16.207 544 HH2 TRP 76 HH2 TRP 76 106.955 -23.730 -17.330 545 H ALA 77 H ALA 77 108.382 -20.159 -11.469 546 HA ALA 77 HA ALA 77 109.975 -18.833 -9.543 547 HB1 ALA 77 1HB ALA 77 109.436 -17.896 -11.771 548 HB2 ALA 77 2HB ALA 77 109.040 -16.779 -10.466 549 HB3 ALA 77 3HB ALA 77 107.760 -17.695 -11.263 550 H SER 78 H SER 78 109.280 -17.309 -7.931 551 HA SER 78 HA SER 78 106.725 -18.064 -6.634 552 HB2 SER 78 1HB SER 78 109.259 -16.986 -5.370 553 HB3 SER 78 2HB SER 78 107.774 -17.395 -4.517 554 HG SER 78 HG SER 78 109.429 -19.068 -4.561 555 H ILE 79 H ILE 79 105.531 -16.337 -5.598 556 HA ILE 79 HA ILE 79 106.090 -13.681 -6.811 557 HB ILE 79 HB ILE 79 103.369 -14.993 -6.533 558 HG12 ILE 79 1HG1 ILE 79 104.928 -14.355 -9.053 559 HG13 ILE 79 2HG1 ILE 79 104.874 -15.961 -8.324 560 HG21 ILE 79 1HG2 ILE 79 103.279 -12.556 -6.321 561 HG22 ILE 79 2HG2 ILE 79 102.636 -13.033 -7.892 562 HG23 ILE 79 3HG2 ILE 79 104.266 -12.371 -7.770 563 HD11 ILE 79 3HD1 ILE 79 102.565 -14.370 -9.461 564 HD12 ILE 79 1HD1 ILE 79 102.336 -15.803 -8.459 565 HD13 ILE 79 2HD1 ILE 79 103.169 -15.933 -10.007 566 H TYR 80 H TYR 80 105.402 -11.880 -5.570 567 HA TYR 80 HA TYR 80 104.284 -12.441 -2.916 568 HB2 TYR 80 1HB TYR 80 106.018 -11.248 -1.757 569 HB3 TYR 80 2HB TYR 80 106.741 -12.542 -2.691 570 HD1 TYR 80 HD1 TYR 80 108.155 -12.061 -4.628 571 HD2 TYR 80 HD2 TYR 80 106.368 -8.905 -2.329 572 HE1 TYR 80 HE1 TYR 80 109.677 -10.421 -5.699 573 HE2 TYR 80 HE2 TYR 80 107.891 -7.264 -3.398 574 HH TYR 80 HH TYR 80 110.574 -7.864 -4.756 575 H GLY 81 H GLY 81 103.441 -10.590 -1.848 576 HA2 GLY 81 1HA GLY 81 103.260 -8.124 -3.486 577 HA3 GLY 81 2HA GLY 81 101.815 -8.814 -2.746 578 H VAL 82 H VAL 82 103.138 -6.183 -2.240 579 HA VAL 82 HA VAL 82 103.725 -6.520 0.635 580 HB VAL 82 HB VAL 82 105.620 -4.942 0.418 581 HG11 VAL 82 1HG1 VAL 82 105.675 -7.534 -1.132 582 HG12 VAL 82 2HG1 VAL 82 106.259 -7.223 0.503 583 HG13 VAL 82 3HG1 VAL 82 107.128 -6.567 -0.884 584 HG21 VAL 82 3HG2 VAL 82 106.518 -4.421 -1.795 585 HG22 VAL 82 1HG2 VAL 82 104.843 -3.875 -1.701 586 HG23 VAL 82 2HG2 VAL 82 105.240 -5.362 -2.564 587 H VAL 83 H VAL 83 103.261 -4.806 1.927 588 HA VAL 83 HA VAL 83 102.349 -2.296 0.683 589 HB VAL 83 HB VAL 83 100.551 -2.124 2.373 590 HG11 VAL 83 1HG1 VAL 83 100.366 -3.352 0.052 591 HG12 VAL 83 2HG1 VAL 83 99.034 -3.456 1.202 592 HG13 VAL 83 3HG1 VAL 83 100.172 -4.794 1.046 593 HG21 VAL 83 3HG2 VAL 83 99.947 -4.262 3.602 594 HG22 VAL 83 1HG2 VAL 83 101.430 -3.489 4.159 595 HG23 VAL 83 2HG2 VAL 83 101.515 -4.904 3.111 596 H GLY 84 H GLY 84 102.760 -0.421 2.051 597 HA2 GLY 84 1HA GLY 84 103.957 -0.759 4.645 598 HA3 GLY 84 2HA GLY 84 105.156 -0.403 3.411 599 H VAL 85 H VAL 85 105.311 1.403 5.101 600 HA VAL 85 HA VAL 85 103.643 3.681 4.220 601 HB VAL 85 HB VAL 85 104.465 3.126 7.085 602 HG11 VAL 85 1HG1 VAL 85 103.125 5.084 7.615 603 HG12 VAL 85 2HG1 VAL 85 102.641 5.256 5.928 604 HG13 VAL 85 3HG1 VAL 85 104.317 5.535 6.397 605 HG21 VAL 85 3HG2 VAL 85 101.695 3.085 5.850 606 HG22 VAL 85 1HG2 VAL 85 102.124 2.671 7.510 607 HG23 VAL 85 2HG2 VAL 85 102.641 1.633 6.181 608 H GLY 86 H GLY 86 104.755 5.571 3.927 609 HA2 GLY 86 1HA GLY 86 107.646 5.559 4.599 610 HA3 GLY 86 2HA GLY 86 107.053 6.110 3.033 611 H TYR 87 H TYR 87 108.452 7.455 5.398 612 HA TYR 87 HA TYR 87 106.618 9.773 5.545 613 HB2 TYR 87 1HB TYR 87 107.246 10.186 7.811 614 HB3 TYR 87 2HB TYR 87 106.685 8.531 7.693 615 HD1 TYR 87 HD1 TYR 87 108.273 6.650 7.897 616 HD2 TYR 87 HD2 TYR 87 109.536 10.730 8.348 617 HE1 TYR 87 HE1 TYR 87 110.382 5.881 8.949 618 HE2 TYR 87 HE2 TYR 87 111.646 9.961 9.399 619 HH TYR 87 HH TYR 87 112.880 7.068 9.140 620 H GLY 88 H GLY 88 107.552 11.774 5.450 621 HA2 GLY 88 1HA GLY 88 110.425 11.866 4.734 622 HA3 GLY 88 2HA GLY 88 109.199 12.863 3.955 623 H LYS 89 H LYS 89 111.660 13.407 5.690 624 HA LYS 89 HA LYS 89 110.352 15.205 7.643 625 HB2 LYS 89 1HB LYS 89 111.291 13.177 8.755 626 HB3 LYS 89 2HB LYS 89 112.879 13.606 8.121 627 HG2 LYS 89 1HG LYS 89 112.834 14.490 10.326 628 HG3 LYS 89 2HG LYS 89 112.552 15.876 9.276 629 HD2 LYS 89 1HD LYS 89 110.142 15.723 9.661 630 HD3 LYS 89 2HD LYS 89 110.369 14.270 10.636 631 HE2 LYS 89 1HE LYS 89 111.717 16.886 11.321 632 HE3 LYS 89 2HE LYS 89 110.112 16.472 11.922 633 HZ1 LYS 89 3HZ LYS 89 111.993 15.858 13.419 634 HZ2 LYS 89 1HZ LYS 89 112.479 14.719 12.259 635 HZ3 LYS 89 2HZ LYS 89 110.964 14.570 13.011 636 H PHE 90 H PHE 90 111.224 17.198 7.842 637 HA PHE 90 HA PHE 90 113.672 17.832 6.319 638 HB2 PHE 90 1HB PHE 90 112.652 19.880 5.520 639 HB3 PHE 90 2HB PHE 90 111.694 18.502 5.016 640 HD1 PHE 90 HD1 PHE 90 109.508 18.030 6.106 641 HD2 PHE 90 HD2 PHE 90 111.795 21.551 7.014 642 HE1 PHE 90 HE1 PHE 90 107.503 19.068 7.134 643 HE2 PHE 90 HE2 PHE 90 109.790 22.588 8.042 644 HZ PHE 90 HZ PHE 90 107.644 21.347 8.102 645 H GLN 91 H GLN 91 114.797 19.744 7.099 646 HA GLN 91 HA GLN 91 115.121 19.857 9.859 647 HB2 GLN 91 1HB GLN 91 116.740 20.733 8.177 648 HB3 GLN 91 2HB GLN 91 115.668 22.109 7.912 649 HG2 GLN 91 1HG GLN 91 115.824 22.620 10.366 650 HG3 GLN 91 2HG GLN 91 117.039 21.351 10.504 651 HE21 GLN 91 1HE2 GLN 91 119.100 22.241 10.508 652 HE22 GLN 91 2HE2 GLN 91 119.587 23.576 9.579 653 H THR 92 H THR 92 114.350 21.179 11.494 654 HA THR 92 HA THR 92 111.803 22.547 10.843 655 HB THR 92 HB THR 92 112.556 21.174 13.428 656 HG1 THR 92 HG1 THR 92 111.369 19.484 12.684 657 HG21 THR 92 3HG2 THR 92 110.004 21.294 13.670 658 HG22 THR 92 1HG2 THR 92 110.044 22.454 12.341 659 HG23 THR 92 2HG2 THR 92 110.885 22.812 13.850 660 H THR 93 H THR 93 111.365 24.489 11.668 661 HA THR 93 HA THR 93 113.422 25.820 13.322 662 HB THR 93 HB THR 93 111.295 27.089 11.573 663 HG1 THR 93 HG1 THR 93 112.785 27.201 10.048 664 HG21 THR 93 3HG2 THR 93 113.638 28.166 13.156 665 HG22 THR 93 1HG2 THR 93 111.933 28.575 13.346 666 HG23 THR 93 2HG2 THR 93 112.811 29.099 11.908 667 H GLU 94 H GLU 94 112.586 27.281 15.016 668 HA GLU 94 HA GLU 94 110.473 25.939 16.453 669 HB2 GLU 94 1HB GLU 94 112.077 28.418 17.124 670 HB3 GLU 94 2HB GLU 94 110.970 27.600 18.227 671 HG2 GLU 94 1HG GLU 94 112.306 25.515 17.976 672 HG3 GLU 94 2HG GLU 94 113.440 26.390 16.956 673 H TYR 95 H TYR 95 108.488 26.253 15.719 674 HA TYR 95 HA TYR 95 107.534 29.015 15.288 675 HB2 TYR 95 1HB TYR 95 105.765 28.021 13.890 676 HB3 TYR 95 2HB TYR 95 107.370 27.708 13.261 677 HD1 TYR 95 HD2 TYR 95 104.379 26.242 14.813 678 HD2 TYR 95 HD1 TYR 95 108.304 25.448 13.268 679 HE1 TYR 95 HE2 TYR 95 103.876 23.814 14.786 680 HE2 TYR 95 HE1 TYR 95 107.805 23.020 13.242 681 HH TYR 95 HH TYR 95 105.899 21.520 14.792 682 HA PRO 96 HA PRO 96 104.990 28.546 18.878 683 HB2 PRO 96 1HB PRO 96 102.584 29.667 17.995 684 HB3 PRO 96 2HB PRO 96 103.952 30.571 18.669 685 HG2 PRO 96 1HG PRO 96 103.169 30.165 15.840 686 HG3 PRO 96 2HG PRO 96 103.883 31.583 16.629 687 HD2 PRO 96 1HD PRO 96 105.363 29.944 15.073 688 HD3 PRO 96 2HD PRO 96 106.048 30.740 16.508 689 H THR 97 H THR 97 103.124 27.321 19.685 690 HA THR 97 HA THR 97 102.951 24.888 18.137 691 HB THR 97 HB THR 97 101.700 25.519 20.817 692 HG1 THR 97 HG1 THR 97 103.603 25.198 21.644 693 HG21 THR 97 3HG2 THR 97 102.305 22.973 19.302 694 HG22 THR 97 1HG2 THR 97 100.745 23.528 19.910 695 HG23 THR 97 2HG2 THR 97 101.992 22.993 21.037 696 H TYR 98 H TYR 98 101.364 24.235 16.911 697 HA TYR 98 HA TYR 98 98.606 24.970 17.455 698 HB2 TYR 98 1HB TYR 98 98.141 25.846 15.277 699 HB3 TYR 98 2HB TYR 98 99.465 26.765 15.960 700 HD1 TYR 98 HD1 TYR 98 101.788 26.425 15.108 701 HD2 TYR 98 HD2 TYR 98 98.385 24.540 13.287 702 HE1 TYR 98 HE1 TYR 98 103.132 25.960 13.078 703 HE2 TYR 98 HE2 TYR 98 99.731 24.073 11.257 704 HH TYR 98 HH TYR 98 102.444 25.563 10.469 705 H LYS 99 H LYS 99 97.096 23.660 16.073 706 HA LYS 99 HA LYS 99 98.100 20.948 15.993 707 HB2 LYS 99 1HB LYS 99 95.379 22.058 15.262 708 HB3 LYS 99 2HB LYS 99 95.776 20.350 15.457 709 HG2 LYS 99 1HG LYS 99 96.528 20.897 17.813 710 HG3 LYS 99 2HG LYS 99 95.833 22.501 17.586 711 HD2 LYS 99 1HD LYS 99 94.297 19.906 17.271 712 HD3 LYS 99 2HD LYS 99 94.258 20.924 18.710 713 HE2 LYS 99 1HE LYS 99 93.446 22.819 17.299 714 HE3 LYS 99 2HE LYS 99 93.382 21.721 15.918 715 HZ1 LYS 99 3HZ LYS 99 91.268 21.514 16.682 716 HZ2 LYS 99 1HZ LYS 99 91.683 21.825 18.298 717 HZ3 LYS 99 2HZ LYS 99 91.997 20.299 17.619 718 H HIS 100 H HIS 100 98.992 20.017 14.309 719 HA HIS 100 HA HIS 100 98.030 20.021 11.679 720 HB2 HIS 100 1HB HIS 100 98.800 22.366 11.620 721 HB3 HIS 100 2HB HIS 100 100.400 21.847 12.110 722 HD1 HIS 100 HD1 HIS 100 101.927 20.853 10.306 723 HD2 HIS 100 HD2 HIS 100 98.100 21.739 8.910 724 HE1 HIS 100 HE1 HIS 100 102.021 20.650 7.784 725 H ASP 101 H ASP 101 99.007 18.371 10.557 726 HA ASP 101 HA ASP 101 101.104 16.886 11.918 727 HB2 ASP 101 1HB ASP 101 99.139 15.803 10.753 728 HB3 ASP 101 2HB ASP 101 99.857 16.308 9.224 729 H THR 102 H THR 102 103.048 17.886 11.767 730 HA THR 102 HA THR 102 103.856 19.516 9.603 731 HB THR 102 HB THR 102 105.622 18.160 11.649 732 HG1 THR 102 HG1 THR 102 104.193 19.293 12.813 733 HG21 THR 102 3HG2 THR 102 106.994 20.243 11.253 734 HG22 THR 102 1HG2 THR 102 105.930 20.609 9.895 735 HG23 THR 102 2HG2 THR 102 106.917 19.148 9.872 736 H SER 103 H SER 103 104.600 16.137 10.421 737 HA SER 103 HA SER 103 106.501 15.835 8.293 738 HB2 SER 103 1HB SER 103 106.626 13.545 8.963 739 HB3 SER 103 2HB SER 103 106.442 14.490 10.437 740 HG SER 103 HG SER 103 104.859 12.571 9.440 741 H ASP 104 H ASP 104 106.263 14.356 6.482 742 HA ASP 104 HA ASP 104 103.489 14.298 5.433 743 HB2 ASP 104 1HB ASP 104 106.142 14.191 3.975 744 HB3 ASP 104 2HB ASP 104 104.560 14.083 3.207 745 H TYR 105 H TYR 105 102.585 12.355 4.814 746 HA TYR 105 HA TYR 105 104.290 9.950 4.933 747 HB2 TYR 105 1HB TYR 105 102.711 8.776 6.289 748 HB3 TYR 105 2HB TYR 105 103.141 10.264 7.106 749 HD1 TYR 105 HD1 TYR 105 101.512 12.146 7.213 750 HD2 TYR 105 HD2 TYR 105 100.478 8.329 5.536 751 HE1 TYR 105 HE1 TYR 105 99.105 12.720 7.387 752 HE2 TYR 105 HE2 TYR 105 98.071 8.903 5.710 753 HH TYR 105 HH TYR 105 96.810 11.518 5.809 754 H GLY 106 H GLY 106 103.503 8.137 3.765 755 HA2 GLY 106 1HA GLY 106 101.061 8.439 2.193 756 HA3 GLY 106 2HA GLY 106 102.562 8.350 1.280 757 H PHE 107 H PHE 107 100.669 6.456 0.851 758 HA PHE 107 HA PHE 107 101.630 4.053 2.308 759 HB2 PHE 107 1HB PHE 107 98.993 4.529 0.913 760 HB3 PHE 107 2HB PHE 107 99.485 3.017 1.652 761 HD1 PHE 107 HD1 PHE 107 99.722 2.853 4.125 762 HD2 PHE 107 HD2 PHE 107 98.203 6.386 2.211 763 HE1 PHE 107 HE1 PHE 107 98.808 3.636 6.294 764 HE2 PHE 107 HE2 PHE 107 97.290 7.168 4.380 765 HZ PHE 107 HZ PHE 107 97.593 5.793 6.421 766 H SER 108 H SER 108 102.285 2.252 1.117 767 HA SER 108 HA SER 108 102.400 2.612 -1.826 768 HB2 SER 108 1HB SER 108 104.607 1.527 -0.061 769 HB3 SER 108 2HB SER 108 104.656 1.688 -1.814 770 HG SER 108 HG SER 108 105.565 3.530 -1.117 771 H TYR 109 H TYR 109 102.120 0.819 -3.061 772 HA TYR 109 HA TYR 109 101.922 -1.820 -1.770 773 HB2 TYR 109 1HB TYR 109 99.848 -0.755 -3.692 774 HB3 TYR 109 2HB TYR 109 99.830 -2.303 -2.871 775 HD1 TYR 109 HD1 TYR 109 99.694 1.381 -2.291 776 HD2 TYR 109 HD2 TYR 109 98.799 -2.530 -0.759 777 HE1 TYR 109 HE1 TYR 109 98.404 2.403 -0.436 778 HE2 TYR 109 HE2 TYR 109 97.513 -1.509 1.099 779 HH TYR 109 HH TYR 109 96.431 1.578 1.104 780 H GLY 110 H GLY 110 102.457 -3.558 -3.195 781 HA2 GLY 110 1HA GLY 110 102.565 -3.230 -6.030 782 HA3 GLY 110 2HA GLY 110 104.172 -3.075 -5.336 783 H ALA 111 H ALA 111 104.072 -5.034 -7.007 784 HA ALA 111 HA ALA 111 104.210 -7.429 -5.331 785 HB1 ALA 111 1HB ALA 111 103.102 -8.642 -7.399 786 HB2 ALA 111 2HB ALA 111 102.360 -7.062 -7.658 787 HB3 ALA 111 3HB ALA 111 102.095 -7.924 -6.142 788 H GLY 112 H GLY 112 105.553 -9.109 -6.293 789 HA2 GLY 112 1HA GLY 112 107.155 -8.268 -8.601 790 HA3 GLY 112 2HA GLY 112 107.992 -8.432 -7.064 791 H LEU 113 H LEU 113 108.846 -9.905 -9.128 792 HA LEU 113 HA LEU 113 107.969 -12.653 -8.476 793 HB2 LEU 113 1HB LEU 113 107.192 -11.942 -10.743 794 HB3 LEU 113 2HB LEU 113 108.872 -11.654 -11.190 795 HG LEU 113 HG LEU 113 109.277 -14.107 -10.455 796 HD11 LEU 113 1HD1 LEU 113 107.330 -15.564 -10.565 797 HD12 LEU 113 2HD1 LEU 113 106.284 -14.191 -10.928 798 HD13 LEU 113 3HD1 LEU 113 107.044 -14.326 -9.342 799 HD21 LEU 113 3HD2 LEU 113 109.304 -13.300 -12.803 800 HD22 LEU 113 1HD2 LEU 113 107.558 -13.529 -12.887 801 HD23 LEU 113 2HD2 LEU 113 108.621 -14.920 -12.680 802 H GLN 114 H GLN 114 109.616 -14.113 -8.126 803 HA GLN 114 HA GLN 114 112.387 -13.110 -8.444 804 HB2 GLN 114 1HB GLN 114 112.993 -14.303 -6.419 805 HB3 GLN 114 2HB GLN 114 111.670 -13.192 -6.075 806 HG2 GLN 114 1HG GLN 114 110.088 -15.155 -6.425 807 HG3 GLN 114 2HG GLN 114 111.513 -16.193 -6.438 808 HE21 GLN 114 1HE2 GLN 114 111.296 -17.243 -4.414 809 HE22 GLN 114 2HE2 GLN 114 111.229 -16.417 -2.932 810 H PHE 115 H PHE 115 113.768 -14.372 -9.561 811 HA PHE 115 HA PHE 115 112.996 -17.186 -10.055 812 HB2 PHE 115 1HB PHE 115 113.634 -16.971 -12.401 813 HB3 PHE 115 2HB PHE 115 112.279 -15.936 -11.998 814 HD1 PHE 115 HD1 PHE 115 112.697 -13.453 -11.657 815 HD2 PHE 115 HD2 PHE 115 115.637 -16.113 -13.308 816 HE1 PHE 115 HE1 PHE 115 113.913 -11.515 -12.613 817 HE2 PHE 115 HE2 PHE 115 116.856 -14.175 -14.260 818 HZ PHE 115 HZ PHE 115 115.994 -11.876 -13.914 819 H ASN 116 H ASN 116 114.728 -18.583 -10.605 820 HA ASN 116 HA ASN 116 117.399 -17.571 -9.830 821 HB2 ASN 116 1HB ASN 116 116.164 -18.838 -8.000 822 HB3 ASN 116 2HB ASN 116 116.317 -20.266 -9.022 823 HD21 ASN 116 1HD2 ASN 116 118.482 -21.142 -9.373 824 HD22 ASN 116 2HD2 ASN 116 119.792 -20.663 -8.405 825 HA PRO 117 HA PRO 117 117.725 -19.909 -13.808 826 HB2 PRO 117 1HB PRO 117 119.774 -18.448 -14.884 827 HB3 PRO 117 2HB PRO 117 118.071 -17.968 -15.008 828 HG2 PRO 117 1HG PRO 117 120.181 -16.980 -13.162 829 HG3 PRO 117 2HG PRO 117 118.907 -16.083 -14.010 830 HD2 PRO 117 1HD PRO 117 118.724 -16.775 -11.371 831 HD3 PRO 117 2HD PRO 117 117.308 -16.574 -12.423 832 H MET 118 H MET 118 120.256 -20.335 -14.884 833 HA MET 118 HA MET 118 121.318 -22.368 -13.314 834 HB2 MET 118 1HB MET 118 122.660 -20.698 -15.446 835 HB3 MET 118 2HB MET 118 123.323 -22.195 -14.789 836 HG2 MET 118 1HG MET 118 121.194 -23.353 -15.466 837 HG3 MET 118 2HG MET 118 120.704 -21.868 -16.279 838 HE1 MET 118 3HE MET 118 122.204 -20.569 -17.591 839 HE2 MET 118 1HE MET 118 122.903 -21.244 -19.068 840 HE3 MET 118 2HE MET 118 123.912 -20.995 -17.646 841 H GLU 119 H GLU 119 122.160 -18.937 -13.390 842 HA GLU 119 HA GLU 119 124.514 -18.974 -11.890 843 HB2 GLU 119 1HB GLU 119 122.296 -16.913 -11.886 844 HB3 GLU 119 2HB GLU 119 123.925 -16.656 -11.257 845 HG2 GLU 119 1HG GLU 119 123.254 -17.404 -14.117 846 HG3 GLU 119 2HG GLU 119 123.681 -15.789 -13.567 847 H ASN 120 H ASN 120 124.910 -18.627 -9.655 848 HA ASN 120 HA ASN 120 123.108 -20.123 -7.960 849 HB2 ASN 120 1HB ASN 120 125.716 -18.735 -7.321 850 HB3 ASN 120 2HB ASN 120 124.854 -19.843 -6.254 851 HD21 ASN 120 1HD2 ASN 120 127.559 -20.033 -7.793 852 HD22 ASN 120 2HD2 ASN 120 127.461 -21.544 -8.560 853 H VAL 121 H VAL 121 122.653 -17.108 -8.927 854 HA VAL 121 HA VAL 121 121.757 -16.173 -6.263 855 HB VAL 121 HB VAL 121 122.155 -13.865 -7.053 856 HG11 VAL 121 1HG1 VAL 121 123.902 -14.952 -5.752 857 HG12 VAL 121 2HG1 VAL 121 124.657 -13.996 -7.027 858 HG13 VAL 121 3HG1 VAL 121 124.529 -15.747 -7.196 859 HG21 VAL 121 3HG2 VAL 121 123.616 -13.626 -9.113 860 HG22 VAL 121 1HG2 VAL 121 121.959 -14.134 -9.443 861 HG23 VAL 121 2HG2 VAL 121 123.267 -15.316 -9.472 862 H ALA 122 H ALA 122 119.847 -14.813 -6.298 863 HA ALA 122 HA ALA 122 118.066 -15.451 -8.585 864 HB1 ALA 122 1HB ALA 122 117.193 -14.889 -5.749 865 HB2 ALA 122 2HB ALA 122 117.542 -16.517 -6.330 866 HB3 ALA 122 3HB ALA 122 116.239 -15.580 -7.063 867 H LEU 123 H LEU 123 116.585 -13.836 -9.245 868 HA LEU 123 HA LEU 123 117.403 -11.088 -8.473 869 HB2 LEU 123 1HB LEU 123 116.500 -12.137 -11.165 870 HB3 LEU 123 2HB LEU 123 116.768 -10.435 -10.788 871 HG LEU 123 HG LEU 123 119.126 -11.296 -9.974 872 HD11 LEU 123 1HD1 LEU 123 119.771 -13.165 -11.705 873 HD12 LEU 123 2HD1 LEU 123 118.045 -13.528 -11.673 874 HD13 LEU 123 3HD1 LEU 123 118.994 -13.620 -10.189 875 HD21 LEU 123 3HD2 LEU 123 118.707 -11.312 -12.957 876 HD22 LEU 123 1HD2 LEU 123 120.014 -10.579 -12.026 877 HD23 LEU 123 2HD2 LEU 123 118.413 -9.840 -12.030 878 H ASP 124 H ASP 124 115.806 -9.615 -8.057 879 HA ASP 124 HA ASP 124 113.010 -10.607 -8.167 880 HB2 ASP 124 1HB ASP 124 114.272 -8.835 -6.059 881 HB3 ASP 124 2HB ASP 124 112.590 -9.354 -6.103 882 H PHE 125 H PHE 125 111.672 -9.369 -9.318 883 HA PHE 125 HA PHE 125 112.337 -6.502 -9.683 884 HB2 PHE 125 1HB PHE 125 111.180 -8.398 -11.734 885 HB3 PHE 125 2HB PHE 125 111.363 -6.667 -11.948 886 HD1 PHE 125 HD1 PHE 125 113.629 -5.663 -12.150 887 HD2 PHE 125 HD2 PHE 125 113.032 -9.912 -11.940 888 HE1 PHE 125 HE1 PHE 125 115.929 -6.028 -13.003 889 HE2 PHE 125 HE2 PHE 125 115.332 -10.277 -12.793 890 HZ PHE 125 HZ PHE 125 116.780 -8.335 -13.325 891 H SER 126 H SER 126 110.697 -5.137 -9.189 892 HA SER 126 HA SER 126 107.949 -6.169 -9.133 893 HB2 SER 126 1HB SER 126 108.816 -6.513 -6.858 894 HB3 SER 126 2HB SER 126 109.279 -4.820 -6.775 895 HG SER 126 HG SER 126 107.242 -5.168 -5.823 896 H TYR 127 H TYR 127 106.339 -4.567 -9.227 897 HA TYR 127 HA TYR 127 107.303 -1.864 -9.963 898 HB2 TYR 127 1HB TYR 127 104.690 -3.235 -10.627 899 HB3 TYR 127 2HB TYR 127 105.150 -1.617 -11.123 900 HD1 TYR 127 HD2 TYR 127 106.813 -1.265 -12.884 901 HD2 TYR 127 HD1 TYR 127 105.669 -5.217 -11.650 902 HE1 TYR 127 HE2 TYR 127 107.878 -2.208 -14.916 903 HE2 TYR 127 HE1 TYR 127 106.734 -6.160 -13.682 904 HH TYR 127 HH TYR 127 108.506 -5.518 -15.293 905 H GLU 128 H GLU 128 106.910 -0.293 -8.540 906 HA GLU 128 HA GLU 128 104.903 -0.794 -6.413 907 HB2 GLU 128 1HB GLU 128 107.296 -0.845 -5.686 908 HB3 GLU 128 2HB GLU 128 107.444 0.832 -6.211 909 HG2 GLU 128 1HG GLU 128 106.975 0.887 -3.860 910 HG3 GLU 128 2HG GLU 128 105.500 1.377 -4.685 911 H GLN 129 H GLN 129 103.404 0.721 -6.029 912 HA GLN 129 HA GLN 129 103.747 3.405 -7.234 913 HB2 GLN 129 1HB GLN 129 101.215 1.744 -7.099 914 HB3 GLN 129 2HB GLN 129 101.288 3.432 -7.610 915 HG2 GLN 129 1HG GLN 129 102.776 2.843 -9.457 916 HG3 GLN 129 2HG GLN 129 102.808 1.165 -8.926 917 HE21 GLN 129 1HE2 GLN 129 101.899 1.890 -11.543 918 HE22 GLN 129 2HE2 GLN 129 100.238 1.554 -11.641 919 H SER 130 H SER 130 103.213 5.109 -5.897 920 HA SER 130 HA SER 130 102.080 4.437 -3.243 921 HB2 SER 130 1HB SER 130 104.428 6.278 -3.749 922 HB3 SER 130 2HB SER 130 103.691 5.934 -2.189 923 HG SER 130 HG SER 130 105.082 4.176 -3.928 924 H ARG 131 H ARG 131 100.803 5.973 -2.313 925 HA ARG 131 HA ARG 131 100.160 8.356 -3.954 926 HB2 ARG 131 1HB ARG 131 98.305 6.702 -3.710 927 HB3 ARG 131 2HB ARG 131 98.380 6.928 -1.963 928 HG2 ARG 131 1HG ARG 131 97.964 9.365 -2.296 929 HG3 ARG 131 2HG ARG 131 97.772 9.065 -4.024 930 HD2 ARG 131 1HD ARG 131 96.097 7.809 -1.833 931 HD3 ARG 131 2HD ARG 131 95.584 9.133 -2.874 932 HE ARG 131 HE ARG 131 95.813 6.327 -3.601 933 HH11 ARG 131 1HH1 ARG 131 95.518 9.614 -4.799 934 HH12 ARG 131 2HH1 ARG 131 94.914 9.104 -6.340 935 HH21 ARG 131 1HH2 ARG 131 95.034 5.732 -5.605 936 HH22 ARG 131 2HH2 ARG 131 94.644 6.933 -6.790 937 H ILE 132 H ILE 132 100.661 10.249 -3.090 938 HA ILE 132 HA ILE 132 100.961 10.480 -0.158 939 HB ILE 132 HB ILE 132 102.795 11.733 -2.231 940 HG12 ILE 132 1HG1 ILE 132 103.413 9.572 -0.195 941 HG13 ILE 132 2HG1 ILE 132 103.115 9.256 -1.905 942 HG21 ILE 132 1HG2 ILE 132 102.355 13.045 -0.130 943 HG22 ILE 132 2HG2 ILE 132 104.040 12.560 -0.322 944 HG23 ILE 132 3HG2 ILE 132 102.991 11.685 0.794 945 HD11 ILE 132 3HD1 ILE 132 104.972 11.059 -2.295 946 HD12 ILE 132 1HD1 ILE 132 105.449 9.425 -1.836 947 HD13 ILE 132 2HD1 ILE 132 105.418 10.707 -0.625 948 H ARG 133 H ARG 133 99.105 11.610 0.160 949 HA ARG 133 HA ARG 133 97.169 12.567 -0.836 950 HB2 ARG 133 1HB ARG 133 97.159 14.826 0.105 951 HB3 ARG 133 2HB ARG 133 97.840 13.637 1.208 952 HG2 ARG 133 1HG ARG 133 100.139 14.352 0.344 953 HG3 ARG 133 2HG ARG 133 99.322 15.713 -0.423 954 HD2 ARG 133 1HD ARG 133 98.360 16.345 1.781 955 HD3 ARG 133 2HD ARG 133 99.302 15.058 2.527 956 HE ARG 133 HE ARG 133 101.219 16.439 1.261 957 HH11 ARG 133 1HH1 ARG 133 98.590 17.595 3.281 958 HH12 ARG 133 2HH1 ARG 133 99.483 18.976 3.824 959 HH21 ARG 133 1HH2 ARG 133 102.318 18.234 1.996 960 HH22 ARG 133 2HH2 ARG 133 101.568 19.333 3.105 961 H SER 134 H SER 134 97.070 12.337 -3.032 962 HA SER 134 HA SER 134 96.355 13.310 -4.986 963 HB2 SER 134 1HB SER 134 97.511 15.928 -4.027 964 HB3 SER 134 2HB SER 134 96.378 15.681 -5.349 965 HG SER 134 HG SER 134 95.930 15.886 -2.685 966 H VAL 135 H VAL 135 99.612 13.194 -3.964 967 HA VAL 135 HA VAL 135 100.569 13.790 -6.691 968 HB VAL 135 HB VAL 135 102.154 13.355 -4.143 969 HG11 VAL 135 1HG1 VAL 135 103.320 12.828 -6.306 970 HG12 VAL 135 2HG1 VAL 135 104.042 14.180 -5.431 971 HG13 VAL 135 3HG1 VAL 135 103.006 14.485 -6.826 972 HG21 VAL 135 3HG2 VAL 135 100.885 15.407 -3.947 973 HG22 VAL 135 1HG2 VAL 135 101.301 15.877 -5.595 974 HG23 VAL 135 2HG2 VAL 135 102.547 15.841 -4.348 975 H ASP 136 H ASP 136 101.441 12.203 -7.958 976 HA ASP 136 HA ASP 136 101.120 9.443 -6.940 977 HB2 ASP 136 1HB ASP 136 99.809 10.088 -8.954 978 HB3 ASP 136 2HB ASP 136 101.321 10.411 -9.800 979 H VAL 137 H VAL 137 102.922 8.304 -6.486 980 HA VAL 137 HA VAL 137 105.474 9.198 -7.712 981 HB VAL 137 HB VAL 137 105.064 7.790 -5.061 982 HG11 VAL 137 1HG1 VAL 137 107.526 9.078 -6.278 983 HG12 VAL 137 2HG1 VAL 137 107.229 7.339 -6.218 984 HG13 VAL 137 3HG1 VAL 137 107.439 8.250 -4.723 985 HG21 VAL 137 3HG2 VAL 137 104.230 10.078 -4.929 986 HG22 VAL 137 1HG2 VAL 137 105.682 10.686 -5.725 987 HG23 VAL 137 2HG2 VAL 137 105.789 9.991 -4.108 988 H GLY 138 H GLY 138 106.571 7.758 -8.899 989 HA2 GLY 138 1HA GLY 138 105.689 4.923 -8.831 990 HA3 GLY 138 2HA GLY 138 106.118 5.760 -10.320 991 H THR 139 H THR 139 107.262 3.586 -8.176 992 HA THR 139 HA THR 139 110.056 4.230 -8.889 993 HB THR 139 HB THR 139 109.700 4.875 -6.544 994 HG1 THR 139 HG1 THR 139 111.121 2.459 -6.495 995 HG21 THR 139 3HG2 THR 139 109.238 2.010 -5.808 996 HG22 THR 139 1HG2 THR 139 107.865 2.988 -6.326 997 HG23 THR 139 2HG2 THR 139 108.815 3.475 -4.922 998 H TRP 140 H TRP 140 111.322 2.519 -9.433 999 HA TRP 140 HA TRP 140 110.042 -0.156 -9.446 1000 HB2 TRP 140 1HB TRP 140 112.098 1.013 -11.328 1001 HB3 TRP 140 2HB TRP 140 111.518 -0.641 -11.374 1002 HD1 TRP 140 HD1 TRP 140 108.796 -0.896 -11.873 1003 HE1 TRP 140 HE1 TRP 140 107.331 0.494 -13.473 1004 HE3 TRP 140 HE3 TRP 140 111.738 3.246 -12.388 1005 HZ2 TRP 140 HZ2 TRP 140 107.397 3.032 -14.800 1006 HZ3 TRP 140 HZ3 TRP 140 111.016 5.129 -13.823 1007 HH2 TRP 140 HH2 TRP 140 108.853 5.031 -15.028 1008 H ILE 141 H ILE 141 111.132 -1.813 -8.498 1009 HA ILE 141 HA ILE 141 113.822 -1.206 -7.404 1010 HB ILE 141 HB ILE 141 113.289 -2.694 -5.544 1011 HG12 ILE 141 1HG1 ILE 141 110.509 -2.873 -6.752 1012 HG13 ILE 141 2HG1 ILE 141 111.703 -4.169 -6.819 1013 HG21 ILE 141 1HG2 ILE 141 111.578 -1.278 -4.468 1014 HG22 ILE 141 2HG2 ILE 141 111.138 -0.613 -6.041 1015 HG23 ILE 141 3HG2 ILE 141 112.735 -0.300 -5.365 1016 HD11 ILE 141 3HD1 ILE 141 111.815 -4.048 -4.285 1017 HD12 ILE 141 1HD1 ILE 141 110.294 -4.650 -4.944 1018 HD13 ILE 141 2HD1 ILE 141 110.405 -2.991 -4.355 1019 H ALA 142 H ALA 142 115.446 -2.534 -7.871 1020 HA ALA 142 HA ALA 142 114.837 -5.300 -8.690 1021 HB1 ALA 142 1HB ALA 142 116.547 -5.152 -10.480 1022 HB2 ALA 142 2HB ALA 142 116.709 -3.424 -10.163 1023 HB3 ALA 142 3HB ALA 142 115.187 -4.070 -10.777 1024 H GLY 143 H GLY 143 116.197 -6.778 -7.772 1025 HA2 GLY 143 1HA GLY 143 118.788 -5.907 -6.732 1026 HA3 GLY 143 2HA GLY 143 117.600 -6.380 -5.525 1027 H VAL 144 H VAL 144 119.805 -7.754 -5.440 1028 HA VAL 144 HA VAL 144 119.152 -10.370 -6.650 1029 HB VAL 144 HB VAL 144 121.943 -9.239 -6.292 1030 HG11 VAL 144 1HG1 VAL 144 121.729 -11.709 -6.027 1031 HG12 VAL 144 2HG1 VAL 144 122.654 -11.265 -7.462 1032 HG13 VAL 144 3HG1 VAL 144 120.978 -11.790 -7.621 1033 HG21 VAL 144 3HG2 VAL 144 120.749 -8.146 -8.150 1034 HG22 VAL 144 1HG2 VAL 144 120.300 -9.723 -8.799 1035 HG23 VAL 144 2HG2 VAL 144 121.993 -9.231 -8.772 1036 H GLY 145 H GLY 145 119.544 -12.159 -5.300 1037 HA2 GLY 145 1HA GLY 145 120.466 -11.575 -2.559 1038 HA3 GLY 145 2HA GLY 145 118.875 -12.288 -2.795 1039 H TYR 146 H TYR 146 121.018 -13.439 -1.325 1040 HA TYR 146 HA TYR 146 121.291 -15.962 -2.836 1041 HB2 TYR 146 1HB TYR 146 123.457 -14.744 -2.820 1042 HB3 TYR 146 2HB TYR 146 123.410 -14.728 -1.067 1043 HD1 TYR 146 HD2 TYR 146 123.922 -16.781 -4.072 1044 HD2 TYR 146 HD1 TYR 146 123.814 -16.768 0.222 1045 HE1 TYR 146 HE2 TYR 146 125.036 -18.996 -4.038 1046 HE2 TYR 146 HE1 TYR 146 124.928 -18.983 0.257 1047 HH TYR 146 HH TYR 146 126.617 -20.225 -1.987 1048 H ARG 147 H ARG 147 121.025 -17.822 -1.584 1049 HA ARG 147 HA ARG 147 120.233 -17.369 1.237 1050 HB2 ARG 147 1HB ARG 147 118.411 -18.950 0.945 1051 HB3 ARG 147 2HB ARG 147 118.255 -17.636 -0.216 1052 HG2 ARG 147 1HG ARG 147 119.404 -19.107 -1.914 1053 HG3 ARG 147 2HG ARG 147 119.303 -20.428 -0.750 1054 HD2 ARG 147 1HD ARG 147 116.827 -20.099 -0.661 1055 HD3 ARG 147 2HD ARG 147 116.976 -18.884 -1.926 1056 HE ARG 147 HE ARG 147 118.101 -21.507 -2.530 1057 HH11 ARG 147 1HH1 ARG 147 115.344 -19.362 -2.876 1058 HH12 ARG 147 2HH1 ARG 147 114.713 -20.230 -4.236 1059 HH21 ARG 147 1HH2 ARG 147 117.242 -22.583 -4.284 1060 HH22 ARG 147 2HH2 ARG 147 115.776 -22.031 -5.023 1061 H PHE 148 H PHE 148 120.763 -18.902 2.707 1062 HA PHE 148 HA PHE 148 121.968 -21.417 1.852 1063 HB2 PHE 148 1HB PHE 148 124.022 -21.073 3.090 1064 HB3 PHE 148 2HB PHE 148 123.848 -19.833 1.862 1065 HD1 PHE 148 HD2 PHE 148 123.430 -17.501 2.480 1066 HD2 PHE 148 HD1 PHE 148 123.859 -20.561 5.464 1067 HE1 PHE 148 HE2 PHE 148 123.714 -15.760 4.224 1068 HE2 PHE 148 HE1 PHE 148 124.145 -18.820 7.208 1069 HZ PHE 148 HZ PHE 148 124.072 -16.420 6.587 Start of MODEL 11 1 H1 ALA 1 3H ALA 1 117.135 -23.415 10.650 2 H2 ALA 1 2H ALA 1 117.693 -24.300 9.310 3 H3 ALA 1 HT3 ALA 1 116.300 -24.803 10.144 4 HA ALA 1 HA ALA 1 115.209 -23.747 8.513 5 HB1 ALA 1 2HB ALA 1 114.834 -21.351 9.052 6 HB2 ALA 1 3HB ALA 1 116.204 -21.402 10.160 7 HB3 ALA 1 1HB ALA 1 114.767 -22.368 10.491 8 H THR 2 H THR 2 115.348 -21.486 7.119 9 HA THR 2 HA THR 2 118.056 -21.335 5.954 10 HB THR 2 HB THR 2 116.715 -22.865 4.575 11 HG1 THR 2 HG1 THR 2 118.200 -21.481 3.569 12 HG21 THR 2 3HG2 THR 2 114.752 -21.931 3.337 13 HG22 THR 2 1HG2 THR 2 114.840 -20.494 4.357 14 HG23 THR 2 2HG2 THR 2 114.477 -22.064 5.075 15 H SER 3 H SER 3 118.669 -19.341 5.215 16 HA SER 3 HA SER 3 116.725 -17.130 5.575 17 HB2 SER 3 1HB SER 3 118.390 -17.221 7.424 18 HB3 SER 3 2HB SER 3 119.679 -17.078 6.235 19 HG SER 3 HG SER 3 119.318 -15.013 6.257 20 H THR 4 H THR 4 116.731 -15.545 4.050 21 HA THR 4 HA THR 4 118.730 -15.720 1.874 22 HB THR 4 HB THR 4 115.773 -15.167 1.514 23 HG1 THR 4 HG1 THR 4 117.364 -17.473 1.228 24 HG21 THR 4 3HG2 THR 4 116.356 -15.430 -0.891 25 HG22 THR 4 1HG2 THR 4 118.055 -15.571 -0.439 26 HG23 THR 4 2HG2 THR 4 117.188 -14.065 -0.145 27 H VAL 5 H VAL 5 119.612 -13.808 1.289 28 HA VAL 5 HA VAL 5 118.385 -11.329 2.365 29 HB VAL 5 HB VAL 5 121.350 -11.944 2.197 30 HG11 VAL 5 1HG1 VAL 5 120.809 -9.563 1.902 31 HG12 VAL 5 2HG1 VAL 5 121.557 -9.830 3.476 32 HG13 VAL 5 3HG1 VAL 5 119.813 -9.598 3.356 33 HG21 VAL 5 3HG2 VAL 5 119.579 -11.669 4.647 34 HG22 VAL 5 1HG2 VAL 5 121.297 -12.071 4.624 35 HG23 VAL 5 2HG2 VAL 5 120.115 -13.214 3.985 36 H THR 6 H THR 6 118.135 -9.726 0.910 37 HA THR 6 HA THR 6 119.712 -9.796 -1.570 38 HB THR 6 HB THR 6 117.577 -10.965 -2.022 39 HG1 THR 6 HG1 THR 6 117.062 -9.682 -3.820 40 HG21 THR 6 3HG2 THR 6 115.492 -9.573 -2.079 41 HG22 THR 6 1HG2 THR 6 116.365 -8.320 -1.197 42 HG23 THR 6 2HG2 THR 6 116.091 -9.894 -0.452 43 H GLY 7 H GLY 7 119.820 -7.796 -2.682 44 HA2 GLY 7 1HA GLY 7 118.767 -5.441 -1.263 45 HA3 GLY 7 2HA GLY 7 120.499 -5.531 -1.587 46 H GLY 8 H GLY 8 118.546 -3.587 -2.627 47 HA2 GLY 8 1HA GLY 8 119.180 -3.904 -5.463 48 HA3 GLY 8 2HA GLY 8 117.470 -3.869 -5.056 49 H TYR 9 H TYR 9 118.360 -2.029 -6.739 50 HA TYR 9 HA TYR 9 118.475 0.477 -5.164 51 HB2 TYR 9 1HB TYR 9 120.530 0.014 -6.499 52 HB3 TYR 9 2HB TYR 9 119.546 -0.006 -7.948 53 HD1 TYR 9 HD2 TYR 9 121.028 2.082 -5.314 54 HD2 TYR 9 HD1 TYR 9 118.613 2.064 -8.866 55 HE1 TYR 9 HE2 TYR 9 121.296 4.540 -5.508 56 HE2 TYR 9 HE1 TYR 9 118.881 4.521 -9.061 57 HH TYR 9 HH TYR 9 121.116 6.231 -7.792 58 H ALA 10 H ALA 10 117.062 2.126 -5.773 59 HA ALA 10 HA ALA 10 115.209 1.566 -7.993 60 HB1 ALA 10 1HB ALA 10 113.885 2.658 -5.594 61 HB2 ALA 10 2HB ALA 10 114.506 1.024 -5.394 62 HB3 ALA 10 3HB ALA 10 113.373 1.379 -6.694 63 H GLN 11 H GLN 11 114.364 3.342 -8.996 64 HA GLN 11 HA GLN 11 115.122 6.009 -7.952 65 HB2 GLN 11 1HB GLN 11 114.858 5.091 -10.830 66 HB3 GLN 11 2HB GLN 11 115.122 6.762 -10.327 67 HG2 GLN 11 1HG GLN 11 117.233 6.144 -9.264 68 HG3 GLN 11 2HG GLN 11 116.965 4.450 -9.663 69 HE21 GLN 11 1HE2 GLN 11 119.284 5.861 -10.583 70 HE22 GLN 11 2HE2 GLN 11 119.184 6.001 -12.272 71 H SER 12 H SER 12 113.484 7.585 -7.940 72 HA SER 12 HA SER 12 110.770 6.534 -8.540 73 HB2 SER 12 1HB SER 12 111.609 8.395 -6.305 74 HB3 SER 12 2HB SER 12 109.967 7.856 -6.640 75 HG SER 12 HG SER 12 112.201 6.397 -5.721 76 H ASP 13 H ASP 13 109.426 7.778 -9.671 77 HA ASP 13 HA ASP 13 110.355 10.463 -10.495 78 HB2 ASP 13 1HB ASP 13 108.511 8.518 -11.910 79 HB3 ASP 13 2HB ASP 13 108.910 10.136 -12.484 80 H ALA 14 H ALA 14 108.953 12.179 -10.277 81 HA ALA 14 HA ALA 14 106.586 11.663 -8.597 82 HB1 ALA 14 1HB ALA 14 108.668 13.193 -7.932 83 HB2 ALA 14 2HB ALA 14 107.020 13.609 -7.462 84 HB3 ALA 14 3HB ALA 14 107.762 14.391 -8.858 85 H GLN 15 H GLN 15 104.890 11.538 -9.883 86 HA GLN 15 HA GLN 15 104.552 13.269 -12.188 87 HB2 GLN 15 1HB GLN 15 102.630 11.301 -10.921 88 HB3 GLN 15 2HB GLN 15 102.412 12.098 -12.477 89 HG2 GLN 15 1HG GLN 15 104.664 10.201 -11.754 90 HG3 GLN 15 2HG GLN 15 103.289 9.821 -12.784 91 HE21 GLN 15 1HE2 GLN 15 106.450 10.364 -13.125 92 HE22 GLN 15 2HE2 GLN 15 106.477 11.249 -14.574 93 H GLY 16 H GLY 16 103.701 15.185 -12.132 94 HA2 GLY 16 1HA GLY 16 102.290 16.945 -11.518 95 HA3 GLY 16 2HA GLY 16 101.762 16.017 -10.122 96 H GLN 17 H GLN 17 104.808 15.561 -9.568 97 HA GLN 17 HA GLN 17 105.463 18.276 -8.589 98 HB2 GLN 17 1HB GLN 17 105.131 16.579 -6.791 99 HB3 GLN 17 2HB GLN 17 106.435 15.625 -7.495 100 HG2 GLN 17 1HG GLN 17 107.948 17.611 -7.234 101 HG3 GLN 17 2HG GLN 17 106.646 18.430 -6.371 102 HE21 GLN 17 1HE2 GLN 17 106.954 18.281 -4.153 103 HE22 GLN 17 2HE2 GLN 17 107.594 16.933 -3.345 104 H MET 18 H MET 18 107.537 19.082 -9.058 105 HA MET 18 HA MET 18 108.993 17.612 -11.139 106 HB2 MET 18 1HB MET 18 109.290 20.432 -10.077 107 HB3 MET 18 2HB MET 18 110.289 19.738 -11.354 108 HG2 MET 18 1HG MET 18 108.227 19.293 -12.681 109 HG3 MET 18 2HG MET 18 107.279 20.094 -11.428 110 HE1 MET 18 3HE MET 18 107.088 20.957 -14.370 111 HE2 MET 18 1HE MET 18 107.135 22.718 -14.221 112 HE3 MET 18 2HE MET 18 106.246 21.755 -13.043 113 H ASN 19 H ASN 19 110.156 16.027 -10.118 114 HA ASN 19 HA ASN 19 112.592 16.683 -8.862 115 HB2 ASN 19 1HB ASN 19 111.086 17.270 -6.956 116 HB3 ASN 19 2HB ASN 19 110.508 15.605 -6.949 117 HD21 ASN 19 1HD2 ASN 19 113.537 17.522 -6.639 118 HD22 ASN 19 2HD2 ASN 19 114.321 16.393 -5.644 119 H LYS 20 H LYS 20 113.874 14.853 -8.397 120 HA LYS 20 HA LYS 20 112.671 12.208 -8.937 121 HB2 LYS 20 1HB LYS 20 115.353 13.228 -9.915 122 HB3 LYS 20 2HB LYS 20 114.796 11.560 -10.055 123 HG2 LYS 20 1HG LYS 20 112.823 12.365 -11.352 124 HG3 LYS 20 2HG LYS 20 113.486 13.998 -11.291 125 HD2 LYS 20 1HD LYS 20 115.557 13.153 -12.407 126 HD3 LYS 20 2HD LYS 20 114.786 11.574 -12.566 127 HE2 LYS 20 1HE LYS 20 113.115 12.417 -14.030 128 HE3 LYS 20 2HE LYS 20 113.495 14.090 -13.626 129 HZ1 LYS 20 3HZ LYS 20 115.181 12.187 -15.153 130 HZ2 LYS 20 1HZ LYS 20 115.726 13.699 -14.609 131 HZ3 LYS 20 2HZ LYS 20 114.451 13.609 -15.729 132 H MET 21 H MET 21 113.559 10.480 -7.688 133 HA MET 21 HA MET 21 115.397 11.329 -5.520 134 HB2 MET 21 1HB MET 21 112.818 9.777 -5.187 135 HB3 MET 21 2HB MET 21 113.995 10.091 -3.911 136 HG2 MET 21 1HG MET 21 113.699 12.552 -4.332 137 HG3 MET 21 2HG MET 21 112.389 12.151 -5.444 138 HE1 MET 21 3HE MET 21 114.003 11.748 -2.257 139 HE2 MET 21 1HE MET 21 112.997 10.527 -1.466 140 HE3 MET 21 2HE MET 21 112.802 12.230 -1.064 141 H GLY 22 H GLY 22 116.480 9.540 -4.428 142 HA2 GLY 22 1HA GLY 22 116.476 7.005 -5.959 143 HA3 GLY 22 2HA GLY 22 117.997 7.847 -5.671 144 H GLY 23 H GLY 23 116.840 5.176 -4.709 145 HA2 GLY 23 1HA GLY 23 117.714 5.480 -1.943 146 HA3 GLY 23 2HA GLY 23 116.048 4.961 -2.164 147 H PHE 24 H PHE 24 117.707 3.347 -0.796 148 HA PHE 24 HA PHE 24 118.159 1.088 -2.658 149 HB2 PHE 24 1HB PHE 24 120.272 2.248 -1.754 150 HB3 PHE 24 2HB PHE 24 119.826 1.573 -0.198 151 HD1 PHE 24 HD1 PHE 24 120.785 0.748 -3.683 152 HD2 PHE 24 HD2 PHE 24 120.212 -0.741 0.304 153 HE1 PHE 24 HE1 PHE 24 121.901 -1.373 -4.317 154 HE2 PHE 24 HE2 PHE 24 121.329 -2.863 -0.331 155 HZ PHE 24 HZ PHE 24 122.173 -3.180 -2.639 156 H ASN 25 H ASN 25 117.738 -1.001 -1.748 157 HA ASN 25 HA ASN 25 116.092 -0.923 0.720 158 HB2 ASN 25 1HB ASN 25 115.548 -2.426 -1.847 159 HB3 ASN 25 2HB ASN 25 114.636 -2.624 -0.353 160 HD21 ASN 25 1HD2 ASN 25 113.539 -1.623 -2.895 161 HD22 ASN 25 2HD2 ASN 25 113.007 -0.037 -2.600 162 H LEU 26 H LEU 26 116.391 -2.513 2.163 163 HA LEU 26 HA LEU 26 118.096 -4.817 1.413 164 HB2 LEU 26 1HB LEU 26 117.940 -3.440 4.111 165 HB3 LEU 26 2HB LEU 26 118.943 -4.835 3.713 166 HG LEU 26 HG LEU 26 119.154 -2.133 2.353 167 HD11 LEU 26 1HD1 LEU 26 120.829 -3.422 4.529 168 HD12 LEU 26 2HD1 LEU 26 119.879 -1.944 4.671 169 HD13 LEU 26 3HD1 LEU 26 121.304 -1.978 3.633 170 HD21 LEU 26 3HD2 LEU 26 119.950 -3.812 0.865 171 HD22 LEU 26 1HD2 LEU 26 120.685 -4.735 2.176 172 HD23 LEU 26 2HD2 LEU 26 121.398 -3.204 1.668 173 H LYS 27 H LYS 27 117.318 -6.838 2.028 174 HA LYS 27 HA LYS 27 114.668 -6.844 3.363 175 HB2 LYS 27 1HB LYS 27 115.488 -8.379 0.896 176 HB3 LYS 27 2HB LYS 27 113.958 -8.572 1.750 177 HG2 LYS 27 1HG LYS 27 113.486 -6.153 1.375 178 HG3 LYS 27 2HG LYS 27 114.964 -6.041 0.421 179 HD2 LYS 27 1HD LYS 27 114.071 -7.819 -1.092 180 HD3 LYS 27 2HD LYS 27 112.558 -7.781 -0.186 181 HE2 LYS 27 1HE LYS 27 112.499 -5.268 -0.682 182 HE3 LYS 27 2HE LYS 27 113.779 -5.579 -1.855 183 HZ1 LYS 27 3HZ LYS 27 111.690 -5.690 -2.968 184 HZ2 LYS 27 1HZ LYS 27 111.061 -6.768 -1.819 185 HZ3 LYS 27 2HZ LYS 27 112.303 -7.271 -2.863 186 H TYR 28 H TYR 28 114.182 -8.541 4.651 187 HA TYR 28 HA TYR 28 116.217 -10.671 4.983 188 HB2 TYR 28 1HB TYR 28 114.401 -9.473 7.082 189 HB3 TYR 28 2HB TYR 28 115.519 -10.799 7.337 190 HD1 TYR 28 HD2 TYR 28 117.932 -10.404 7.455 191 HD2 TYR 28 HD1 TYR 28 115.169 -7.175 6.830 192 HE1 TYR 28 HE2 TYR 28 119.717 -8.771 7.998 193 HE2 TYR 28 HE1 TYR 28 116.955 -5.542 7.373 194 HH TYR 28 HH TYR 28 119.446 -5.466 7.341 195 H ARG 29 H ARG 29 115.482 -12.766 5.058 196 HA ARG 29 HA ARG 29 112.594 -13.163 4.516 197 HB2 ARG 29 1HB ARG 29 114.042 -13.465 2.520 198 HB3 ARG 29 2HB ARG 29 114.940 -14.708 3.386 199 HG2 ARG 29 1HG ARG 29 113.368 -15.900 2.074 200 HG3 ARG 29 2HG ARG 29 112.674 -15.896 3.693 201 HD2 ARG 29 1HD ARG 29 111.286 -13.933 3.070 202 HD3 ARG 29 2HD ARG 29 111.951 -14.001 1.441 203 HE ARG 29 HE ARG 29 109.870 -15.647 2.493 204 HH11 ARG 29 1HH1 ARG 29 112.598 -15.743 0.283 205 HH12 ARG 29 2HH1 ARG 29 111.926 -17.040 -0.648 206 HH21 ARG 29 1HH2 ARG 29 109.059 -17.319 1.256 207 HH22 ARG 29 2HH2 ARG 29 109.947 -17.918 -0.104 208 H TYR 30 H TYR 30 111.563 -14.767 5.606 209 HA TYR 30 HA TYR 30 113.179 -16.593 7.284 210 HB2 TYR 30 1HB TYR 30 110.595 -15.242 8.067 211 HB3 TYR 30 2HB TYR 30 111.470 -16.417 9.030 212 HD1 TYR 30 HD1 TYR 30 113.753 -15.824 9.929 213 HD2 TYR 30 HD2 TYR 30 111.177 -12.939 8.058 214 HE1 TYR 30 HE1 TYR 30 115.073 -13.986 10.945 215 HE2 TYR 30 HE2 TYR 30 112.497 -11.102 9.074 216 HH TYR 30 HH TYR 30 114.401 -10.593 10.165 217 H GLU 31 H GLU 31 112.475 -18.705 7.382 218 HA GLU 31 HA GLU 31 109.921 -19.378 6.081 219 HB2 GLU 31 1HB GLU 31 111.763 -19.555 4.397 220 HB3 GLU 31 2HB GLU 31 112.523 -20.773 5.424 221 HG2 GLU 31 1HG GLU 31 110.446 -22.137 5.290 222 HG3 GLU 31 2HG GLU 31 109.755 -20.945 4.198 223 H GLU 32 H GLU 32 108.937 -21.242 6.842 224 HA GLU 32 HA GLU 32 110.091 -22.365 9.302 225 HB2 GLU 32 1HB GLU 32 107.742 -21.476 9.300 226 HB3 GLU 32 2HB GLU 32 107.313 -22.768 8.178 227 HG2 GLU 32 1HG GLU 32 108.133 -24.438 9.827 228 HG3 GLU 32 2HG GLU 32 108.465 -23.132 10.956 229 H ASP 33 H ASP 33 110.447 -24.569 9.573 230 HA ASP 33 HA ASP 33 111.415 -25.828 7.218 231 HB2 ASP 33 1HB ASP 33 112.106 -27.632 8.694 232 HB3 ASP 33 2HB ASP 33 112.492 -26.071 9.412 233 H ASN 34 H ASN 34 108.595 -26.581 9.306 234 HA ASN 34 HA ASN 34 107.926 -28.776 7.443 235 HB2 ASN 34 1HB ASN 34 106.558 -29.676 9.222 236 HB3 ASN 34 2HB ASN 34 108.181 -29.350 9.824 237 HD21 ASN 34 1HD2 ASN 34 105.948 -29.524 11.602 238 HD22 ASN 34 2HD2 ASN 34 105.668 -27.984 12.261 239 H SER 35 H SER 35 106.859 -25.615 8.278 240 HA SER 35 HA SER 35 104.636 -25.953 6.414 241 HB2 SER 35 1HB SER 35 103.260 -24.482 8.115 242 HB3 SER 35 2HB SER 35 103.299 -26.233 8.284 243 HG SER 35 HG SER 35 103.778 -25.299 10.264 244 HA PRO 36 HA PRO 36 107.292 -22.184 6.159 245 HB2 PRO 36 1HB PRO 36 107.810 -22.173 3.493 246 HB3 PRO 36 2HB PRO 36 108.709 -23.182 4.643 247 HG2 PRO 36 1HG PRO 36 106.523 -23.934 2.779 248 HG3 PRO 36 2HG PRO 36 107.978 -24.835 3.240 249 HD2 PRO 36 1HD PRO 36 105.477 -25.328 4.291 250 HD3 PRO 36 2HD PRO 36 106.999 -25.722 5.118 251 H LEU 37 H LEU 37 106.492 -20.227 6.080 252 HA LEU 37 HA LEU 37 104.677 -19.451 3.879 253 HB2 LEU 37 1HB LEU 37 104.679 -18.542 6.769 254 HB3 LEU 37 2HB LEU 37 103.869 -17.647 5.484 255 HG LEU 37 HG LEU 37 102.783 -19.994 4.950 256 HD11 LEU 37 1HD1 LEU 37 103.788 -21.484 6.419 257 HD12 LEU 37 2HD1 LEU 37 102.360 -21.036 7.348 258 HD13 LEU 37 3HD1 LEU 37 103.918 -20.292 7.710 259 HD21 LEU 37 3HD2 LEU 37 100.915 -19.417 6.465 260 HD22 LEU 37 1HD2 LEU 37 101.552 -17.977 5.671 261 HD23 LEU 37 2HD2 LEU 37 101.973 -18.318 7.350 262 H GLY 38 H GLY 38 105.354 -17.544 2.761 263 HA2 GLY 38 1HA GLY 38 108.174 -16.937 3.338 264 HA3 GLY 38 2HA GLY 38 107.335 -16.615 1.822 265 H VAL 39 H VAL 39 108.575 -15.201 4.534 266 HA VAL 39 HA VAL 39 106.840 -12.814 4.206 267 HB VAL 39 HB VAL 39 108.230 -13.720 6.744 268 HG11 VAL 39 1HG1 VAL 39 106.856 -11.901 7.757 269 HG12 VAL 39 2HG1 VAL 39 106.319 -11.441 6.141 270 HG13 VAL 39 3HG1 VAL 39 108.020 -11.289 6.581 271 HG21 VAL 39 3HG2 VAL 39 105.264 -13.664 6.116 272 HG22 VAL 39 1HG2 VAL 39 106.033 -14.291 7.575 273 HG23 VAL 39 2HG2 VAL 39 106.249 -15.124 6.036 274 H ILE 40 H ILE 40 107.862 -11.059 3.591 275 HA ILE 40 HA ILE 40 110.795 -10.874 3.988 276 HB ILE 40 HB ILE 40 109.187 -9.788 1.658 277 HG12 ILE 40 1HG1 ILE 40 111.197 -12.060 1.718 278 HG13 ILE 40 2HG1 ILE 40 109.450 -12.295 1.701 279 HG21 ILE 40 1HG2 ILE 40 111.163 -8.432 2.234 280 HG22 ILE 40 2HG2 ILE 40 111.423 -9.296 0.718 281 HG23 ILE 40 3HG2 ILE 40 112.171 -9.879 2.205 282 HD11 ILE 40 3HD1 ILE 40 110.413 -12.443 -0.578 283 HD12 ILE 40 1HD1 ILE 40 111.023 -10.797 -0.417 284 HD13 ILE 40 2HD1 ILE 40 109.285 -11.096 -0.433 285 H GLY 41 H GLY 41 111.456 -9.163 5.079 286 HA2 GLY 41 1HA GLY 41 109.638 -6.827 5.343 287 HA3 GLY 41 2HA GLY 41 110.814 -7.311 6.569 288 H SER 42 H SER 42 110.384 -4.919 4.525 289 HA SER 42 HA SER 42 113.209 -4.821 3.631 290 HB2 SER 42 1HB SER 42 111.596 -5.325 1.765 291 HB3 SER 42 2HB SER 42 110.846 -3.765 2.074 292 HG SER 42 HG SER 42 112.374 -3.360 0.565 293 H PHE 43 H PHE 43 114.274 -2.976 4.002 294 HA PHE 43 HA PHE 43 112.739 -0.654 5.026 295 HB2 PHE 43 1HB PHE 43 115.619 -1.441 5.504 296 HB3 PHE 43 2HB PHE 43 114.862 0.024 6.099 297 HD1 PHE 43 HD1 PHE 43 113.089 -0.105 7.846 298 HD2 PHE 43 HD2 PHE 43 115.278 -3.570 6.555 299 HE1 PHE 43 HE1 PHE 43 112.339 -1.332 9.866 300 HE2 PHE 43 HE2 PHE 43 114.527 -4.796 8.576 301 HZ PHE 43 HZ PHE 43 113.057 -3.677 10.232 302 H THR 44 H THR 44 112.766 1.148 3.801 303 HA THR 44 HA THR 44 114.695 1.245 1.545 304 HB THR 44 HB THR 44 111.943 2.492 1.739 305 HG1 THR 44 HG1 THR 44 111.229 0.747 0.804 306 HG21 THR 44 3HG2 THR 44 112.984 3.808 0.159 307 HG22 THR 44 1HG2 THR 44 112.490 2.468 -0.875 308 HG23 THR 44 2HG2 THR 44 114.148 2.558 -0.279 309 H TYR 45 H TYR 45 116.089 2.860 1.511 310 HA TYR 45 HA TYR 45 115.517 5.297 3.107 311 HB2 TYR 45 1HB TYR 45 118.206 4.117 2.378 312 HB3 TYR 45 2HB TYR 45 117.936 5.566 3.327 313 HD1 TYR 45 HD1 TYR 45 117.836 1.891 3.300 314 HD2 TYR 45 HD2 TYR 45 117.173 5.426 5.647 315 HE1 TYR 45 HE1 TYR 45 117.782 0.514 5.362 316 HE2 TYR 45 HE2 TYR 45 117.117 4.049 7.708 317 HH TYR 45 HH TYR 45 116.649 0.850 7.768 318 H THR 46 H THR 46 115.175 7.034 1.863 319 HA THR 46 HA THR 46 116.374 7.109 -0.846 320 HB THR 46 HB THR 46 113.616 8.112 -0.114 321 HG1 THR 46 HG1 THR 46 114.274 5.812 -1.617 322 HG21 THR 46 3HG2 THR 46 113.341 8.300 -2.523 323 HG22 THR 46 1HG2 THR 46 114.937 7.602 -2.791 324 HG23 THR 46 2HG2 THR 46 114.784 9.191 -2.041 325 H GLU 47 H GLU 47 116.973 9.129 -1.619 326 HA GLU 47 HA GLU 47 116.968 11.334 0.352 327 HB2 GLU 47 1HB GLU 47 119.163 10.114 0.291 328 HB3 GLU 47 2HB GLU 47 119.308 10.565 -1.407 329 HG2 GLU 47 1HG GLU 47 119.117 12.959 -0.757 330 HG3 GLU 47 2HG GLU 47 119.064 12.477 0.933 331 H LYS 48 H LYS 48 116.860 13.382 -0.483 332 HA LYS 48 HA LYS 48 116.468 13.645 -3.406 333 HB2 LYS 48 1HB LYS 48 114.357 13.797 -1.968 334 HB3 LYS 48 2HB LYS 48 115.034 15.290 -1.317 335 HG2 LYS 48 1HG LYS 48 115.322 16.005 -3.786 336 HG3 LYS 48 2HG LYS 48 114.203 14.691 -4.152 337 HD2 LYS 48 1HD LYS 48 113.601 16.850 -2.118 338 HD3 LYS 48 2HD LYS 48 113.109 16.955 -3.809 339 HE2 LYS 48 1HE LYS 48 111.736 14.996 -3.623 340 HE3 LYS 48 2HE LYS 48 112.402 14.605 -2.037 341 HZ1 LYS 48 3HZ LYS 48 110.179 15.696 -2.002 342 HZ2 LYS 48 1HZ LYS 48 110.908 17.101 -2.613 343 HZ3 LYS 48 2HZ LYS 48 111.369 16.498 -1.093 344 H SER 49 H SER 49 117.562 15.305 -4.366 345 HA SER 49 HA SER 49 119.188 17.040 -2.590 346 HB2 SER 49 1HB SER 49 120.862 17.078 -4.359 347 HB3 SER 49 2HB SER 49 120.499 15.413 -3.918 348 HG SER 49 HG SER 49 119.612 16.900 -6.161 349 H ARG 50 H ARG 50 119.377 19.200 -3.065 350 HA ARG 50 HA ARG 50 117.877 20.261 -5.364 351 HB2 ARG 50 1HB ARG 50 116.404 20.345 -3.353 352 HB3 ARG 50 2HB ARG 50 117.617 21.343 -2.549 353 HG2 ARG 50 1HG ARG 50 117.430 23.012 -4.378 354 HG3 ARG 50 2HG ARG 50 116.165 22.032 -5.121 355 HD2 ARG 50 1HD ARG 50 114.831 22.236 -3.020 356 HD3 ARG 50 2HD ARG 50 116.065 23.317 -2.379 357 HE ARG 50 HE ARG 50 115.377 24.444 -4.776 358 HH11 ARG 50 1HH1 ARG 50 113.527 23.491 -1.948 359 HH12 ARG 50 2HH1 ARG 50 112.323 24.708 -2.203 360 HH21 ARG 50 1HH2 ARG 50 113.795 25.992 -5.051 361 HH22 ARG 50 2HH2 ARG 50 112.474 26.106 -3.938 362 H THR 51 H THR 51 118.796 22.049 -6.290 363 HA THR 51 HA THR 51 121.208 23.170 -4.972 364 HB THR 51 HB THR 51 120.795 22.766 -7.944 365 HG1 THR 51 HG1 THR 51 122.572 21.219 -7.485 366 HG21 THR 51 3HG2 THR 51 122.262 24.667 -7.219 367 HG22 THR 51 1HG2 THR 51 123.125 23.415 -8.114 368 HG23 THR 51 2HG2 THR 51 123.269 23.503 -6.359 369 H ALA 52 H ALA 52 121.309 25.329 -4.825 370 HA ALA 52 HA ALA 52 119.409 26.956 -6.408 371 HB1 ALA 52 1HB ALA 52 119.394 28.444 -4.273 372 HB2 ALA 52 2HB ALA 52 119.925 26.980 -3.447 373 HB3 ALA 52 3HB ALA 52 118.384 26.998 -4.305 374 H SER 53 H SER 53 120.109 29.063 -6.917 375 HA SER 53 HA SER 53 122.838 29.378 -7.487 376 HB2 SER 53 1HB SER 53 120.760 31.557 -7.171 377 HB3 SER 53 2HB SER 53 122.283 31.684 -8.042 378 HG SER 53 HG SER 53 121.323 30.787 -9.675 379 H SER 54 H SER 54 120.911 30.471 -4.726 380 HA SER 54 HA SER 54 122.768 32.186 -3.528 381 HB2 SER 54 1HB SER 54 120.799 30.355 -2.137 382 HB3 SER 54 2HB SER 54 121.548 31.797 -1.457 383 HG SER 54 HG SER 54 120.332 33.038 -2.734 384 H GLY 55 H GLY 55 122.543 28.663 -3.456 385 HA2 GLY 55 1HA GLY 55 124.486 27.303 -3.140 386 HA3 GLY 55 2HA GLY 55 125.192 28.584 -2.171 387 H ASP 56 H ASP 56 122.134 28.480 -1.009 388 HA ASP 56 HA ASP 56 122.844 27.098 1.376 389 HB2 ASP 56 1HB ASP 56 120.138 27.955 0.324 390 HB3 ASP 56 2HB ASP 56 120.444 27.372 1.957 391 H TYR 57 H TYR 57 122.291 25.060 2.098 392 HA TYR 57 HA TYR 57 121.238 23.203 0.039 393 HB2 TYR 57 1HB TYR 57 123.135 22.634 2.318 394 HB3 TYR 57 2HB TYR 57 122.554 21.464 1.149 395 HD1 TYR 57 HD1 TYR 57 124.800 24.313 1.735 396 HD2 TYR 57 HD2 TYR 57 123.396 21.457 -1.150 397 HE1 TYR 57 HE1 TYR 57 126.703 24.880 0.249 398 HE2 TYR 57 HE2 TYR 57 125.298 22.025 -2.637 399 HH TYR 57 HH TYR 57 127.923 24.064 -1.564 400 H ASN 58 H ASN 58 119.453 22.093 0.502 401 HA ASN 58 HA ASN 58 118.489 22.045 3.305 402 HB2 ASN 58 1HB ASN 58 116.900 21.884 0.730 403 HB3 ASN 58 2HB ASN 58 116.230 21.830 2.360 404 HD21 ASN 58 1HD2 ASN 58 117.707 23.862 3.636 405 HD22 ASN 58 2HD2 ASN 58 117.371 25.351 2.892 406 H LYS 59 H LYS 59 118.368 20.102 4.252 407 HA LYS 59 HA LYS 59 118.837 17.729 2.585 408 HB2 LYS 59 1HB LYS 59 119.561 16.628 4.600 409 HB3 LYS 59 2HB LYS 59 120.362 18.190 4.493 410 HG2 LYS 59 1HG LYS 59 118.624 19.129 6.035 411 HG3 LYS 59 2HG LYS 59 117.965 17.502 6.218 412 HD2 LYS 59 1HD LYS 59 120.302 16.775 6.931 413 HD3 LYS 59 2HD LYS 59 120.704 18.490 7.034 414 HE2 LYS 59 1HE LYS 59 120.006 17.685 9.235 415 HE3 LYS 59 2HE LYS 59 118.805 18.814 8.609 416 HZ1 LYS 59 3HZ LYS 59 118.371 16.056 7.870 417 HZ2 LYS 59 1HZ LYS 59 117.270 17.214 8.438 418 HZ3 LYS 59 2HZ LYS 59 118.247 16.361 9.536 419 H ASN 60 H ASN 60 117.291 16.358 2.120 420 HA ASN 60 HA ASN 60 114.922 16.181 3.891 421 HB2 ASN 60 1HB ASN 60 115.038 15.956 0.872 422 HB3 ASN 60 2HB ASN 60 113.612 15.627 1.852 423 HD21 ASN 60 1HD2 ASN 60 113.775 17.736 -0.164 424 HD22 ASN 60 2HD2 ASN 60 113.591 19.216 0.649 425 H GLN 61 H GLN 61 114.212 14.117 4.393 426 HA GLN 61 HA GLN 61 115.637 11.852 3.150 427 HB2 GLN 61 1HB GLN 61 116.119 10.874 5.327 428 HB3 GLN 61 2HB GLN 61 116.853 12.471 5.210 429 HG2 GLN 61 1HG GLN 61 114.763 13.371 6.369 430 HG3 GLN 61 2HG GLN 61 114.342 11.693 6.707 431 HE21 GLN 61 1HE2 GLN 61 114.744 11.628 8.971 432 HE22 GLN 61 2HE2 GLN 61 116.262 11.953 9.657 433 H TYR 62 H TYR 62 114.483 9.967 3.008 434 HA TYR 62 HA TYR 62 111.759 9.947 4.165 435 HB2 TYR 62 1HB TYR 62 111.768 10.632 1.758 436 HB3 TYR 62 2HB TYR 62 112.502 9.092 1.367 437 HD1 TYR 62 HD1 TYR 62 111.200 7.013 1.475 438 HD2 TYR 62 HD2 TYR 62 109.436 10.818 2.405 439 HE1 TYR 62 HE1 TYR 62 108.938 6.015 1.277 440 HE2 TYR 62 HE2 TYR 62 107.175 9.819 2.210 441 HH TYR 62 HH TYR 62 106.009 7.968 1.860 442 H TYR 63 H TYR 63 111.213 8.064 5.112 443 HA TYR 63 HA TYR 63 112.877 5.670 4.563 444 HB2 TYR 63 1HB TYR 63 111.804 6.469 7.270 445 HB3 TYR 63 2HB TYR 63 112.854 5.114 6.905 446 HD1 TYR 63 HD1 TYR 63 115.237 5.521 6.259 447 HD2 TYR 63 HD2 TYR 63 112.643 8.681 7.579 448 HE1 TYR 63 HE1 TYR 63 117.209 6.967 6.678 449 HE2 TYR 63 HE2 TYR 63 114.613 10.124 7.997 450 HH TYR 63 HH TYR 63 117.787 8.926 8.079 451 H GLY 64 H GLY 64 111.726 3.758 4.363 452 HA2 GLY 64 1HA GLY 64 108.822 3.864 4.969 453 HA3 GLY 64 2HA GLY 64 109.392 3.313 3.398 454 H ILE 65 H ILE 65 107.973 2.051 5.843 455 HA ILE 65 HA ILE 65 109.717 -0.342 6.031 456 HB ILE 65 HB ILE 65 107.613 0.587 8.008 457 HG12 ILE 65 1HG1 ILE 65 110.635 0.556 8.281 458 HG13 ILE 65 2HG1 ILE 65 109.690 2.005 7.938 459 HG21 ILE 65 1HG2 ILE 65 108.438 -1.231 9.398 460 HG22 ILE 65 2HG2 ILE 65 109.676 -1.627 8.208 461 HG23 ILE 65 3HG2 ILE 65 107.974 -1.888 7.829 462 HD11 ILE 65 3HD1 ILE 65 110.078 1.931 10.322 463 HD12 ILE 65 1HD1 ILE 65 109.518 0.261 10.409 464 HD13 ILE 65 2HD1 ILE 65 108.378 1.556 10.042 465 H THR 66 H THR 66 108.901 -2.154 5.127 466 HA THR 66 HA THR 66 105.993 -2.365 4.743 467 HB THR 66 HB THR 66 106.924 -1.370 2.692 468 HG1 THR 66 HG1 THR 66 105.454 -2.496 1.767 469 HG21 THR 66 3HG2 THR 66 108.210 -3.435 1.392 470 HG22 THR 66 1HG2 THR 66 108.910 -3.521 3.006 471 HG23 THR 66 2HG2 THR 66 108.997 -2.023 2.088 472 H ALA 67 H ALA 67 105.261 -4.502 4.194 473 HA ALA 67 HA ALA 67 107.155 -6.708 4.550 474 HB1 ALA 67 1HB ALA 67 104.620 -6.687 6.179 475 HB2 ALA 67 2HB ALA 67 106.111 -5.992 6.816 476 HB3 ALA 67 3HB ALA 67 106.052 -7.699 6.377 477 H GLY 68 H GLY 68 106.344 -8.705 3.692 478 HA2 GLY 68 1HA GLY 68 103.738 -8.585 2.358 479 HA3 GLY 68 2HA GLY 68 105.153 -8.760 1.351 480 HA PRO 69 HA PRO 69 104.225 -13.100 3.084 481 HB2 PRO 69 1HB PRO 69 101.853 -13.936 2.058 482 HB3 PRO 69 2HB PRO 69 101.997 -13.233 3.682 483 HG2 PRO 69 1HG PRO 69 101.059 -11.976 1.158 484 HG3 PRO 69 2HG PRO 69 100.445 -11.792 2.811 485 HD2 PRO 69 1HD PRO 69 102.083 -9.952 1.603 486 HD3 PRO 69 2HD PRO 69 101.998 -10.188 3.360 487 H ALA 70 H ALA 70 104.346 -15.035 1.635 488 HA ALA 70 HA ALA 70 104.871 -14.243 -1.172 489 HB1 ALA 70 1HB ALA 70 105.871 -16.756 0.145 490 HB2 ALA 70 2HB ALA 70 106.733 -15.228 0.316 491 HB3 ALA 70 3HB ALA 70 106.499 -15.935 -1.283 492 H TYR 71 H TYR 71 104.242 -15.701 -2.860 493 HA TYR 71 HA TYR 71 102.070 -17.574 -2.108 494 HB2 TYR 71 1HB TYR 71 102.246 -15.810 -4.558 495 HB3 TYR 71 2HB TYR 71 100.997 -17.001 -4.249 496 HD1 TYR 71 HD1 TYR 71 99.427 -16.661 -2.296 497 HD2 TYR 71 HD2 TYR 71 102.151 -13.624 -3.641 498 HE1 TYR 71 HE1 TYR 71 98.112 -14.944 -1.083 499 HE2 TYR 71 HE2 TYR 71 100.835 -11.907 -2.428 500 HH TYR 71 HH TYR 71 97.842 -12.211 -1.489 501 H ARG 72 H ARG 72 102.351 -19.611 -2.841 502 HA ARG 72 HA ARG 72 104.632 -20.086 -4.660 503 HB2 ARG 72 1HB ARG 72 104.689 -21.153 -2.407 504 HB3 ARG 72 2HB ARG 72 103.227 -22.044 -2.832 505 HG2 ARG 72 1HG ARG 72 104.425 -23.000 -4.801 506 HG3 ARG 72 2HG ARG 72 105.895 -22.184 -4.267 507 HD2 ARG 72 1HD ARG 72 104.342 -24.222 -2.649 508 HD3 ARG 72 2HD ARG 72 105.840 -24.541 -3.517 509 HE ARG 72 HE ARG 72 105.983 -22.363 -1.604 510 HH11 ARG 72 1HH1 ARG 72 106.443 -25.810 -2.085 511 HH12 ARG 72 2HH1 ARG 72 107.516 -25.956 -0.733 512 HH21 ARG 72 1HH2 ARG 72 107.370 -22.612 0.124 513 HH22 ARG 72 2HH2 ARG 72 108.034 -24.167 0.501 514 H ILE 73 H ILE 73 103.919 -20.105 -6.683 515 HA ILE 73 HA ILE 73 102.060 -22.253 -7.379 516 HB ILE 73 HB ILE 73 100.802 -20.990 -8.933 517 HG12 ILE 73 1HG1 ILE 73 102.506 -19.505 -9.855 518 HG13 ILE 73 2HG1 ILE 73 101.100 -18.585 -9.352 519 HG21 ILE 73 1HG2 ILE 73 99.991 -20.803 -6.671 520 HG22 ILE 73 2HG2 ILE 73 99.728 -19.271 -7.504 521 HG23 ILE 73 3HG2 ILE 73 101.059 -19.435 -6.357 522 HD11 ILE 73 3HD1 ILE 73 102.601 -18.434 -7.084 523 HD12 ILE 73 1HD1 ILE 73 102.675 -17.250 -8.386 524 HD13 ILE 73 2HD1 ILE 73 103.869 -18.544 -8.300 525 H ASN 74 H ASN 74 102.882 -23.519 -8.921 526 HA ASN 74 HA ASN 74 104.463 -24.403 -10.321 527 HB2 ASN 74 1HB ASN 74 104.709 -21.540 -11.286 528 HB3 ASN 74 2HB ASN 74 105.314 -22.967 -12.120 529 HD21 ASN 74 1HD2 ASN 74 103.269 -21.113 -13.157 530 HD22 ASN 74 2HD2 ASN 74 101.857 -22.030 -13.372 531 H ASP 75 H ASP 75 106.262 -25.150 -9.432 532 HA ASP 75 HA ASP 75 107.782 -23.901 -7.490 533 HB2 ASP 75 1HB ASP 75 108.591 -26.059 -9.444 534 HB3 ASP 75 2HB ASP 75 109.531 -25.603 -8.026 535 H TRP 76 H TRP 76 108.106 -23.657 -10.978 536 HA TRP 76 HA TRP 76 110.750 -22.885 -11.239 537 HB2 TRP 76 1HB TRP 76 108.317 -21.997 -12.777 538 HB3 TRP 76 2HB TRP 76 109.959 -21.615 -13.258 539 HD1 TRP 76 HD1 TRP 76 107.334 -24.185 -13.601 540 HE1 TRP 76 HE1 TRP 76 108.268 -26.281 -14.774 541 HE3 TRP 76 HE3 TRP 76 112.333 -23.169 -13.371 542 HZ2 TRP 76 HZ2 TRP 76 110.805 -27.383 -15.518 543 HZ3 TRP 76 HZ3 TRP 76 113.982 -24.753 -14.317 544 HH2 TRP 76 HH2 TRP 76 113.229 -26.857 -15.389 545 H ALA 77 H ALA 77 107.986 -20.892 -10.246 546 HA ALA 77 HA ALA 77 109.885 -18.782 -9.485 547 HB1 ALA 77 1HB ALA 77 109.110 -18.155 -11.713 548 HB2 ALA 77 2HB ALA 77 108.457 -17.050 -10.504 549 HB3 ALA 77 3HB ALA 77 107.433 -18.310 -11.191 550 H SER 78 H SER 78 109.189 -17.385 -7.885 551 HA SER 78 HA SER 78 106.652 -18.066 -6.522 552 HB2 SER 78 1HB SER 78 107.749 -17.644 -4.382 553 HB3 SER 78 2HB SER 78 108.633 -18.889 -5.259 554 HG SER 78 HG SER 78 110.249 -17.520 -5.583 555 H ILE 79 H ILE 79 105.610 -16.214 -5.431 556 HA ILE 79 HA ILE 79 106.518 -13.619 -6.571 557 HB ILE 79 HB ILE 79 103.654 -14.587 -6.344 558 HG12 ILE 79 1HG1 ILE 79 105.322 -14.091 -8.828 559 HG13 ILE 79 2HG1 ILE 79 105.039 -15.693 -8.144 560 HG21 ILE 79 1HG2 ILE 79 103.862 -12.164 -6.066 561 HG22 ILE 79 2HG2 ILE 79 103.185 -12.515 -7.655 562 HG23 ILE 79 3HG2 ILE 79 104.883 -12.064 -7.501 563 HD11 ILE 79 3HD1 ILE 79 103.012 -13.787 -9.324 564 HD12 ILE 79 1HD1 ILE 79 102.536 -15.141 -8.298 565 HD13 ILE 79 2HD1 ILE 79 103.373 -15.440 -9.822 566 H TYR 80 H TYR 80 106.059 -11.785 -5.323 567 HA TYR 80 HA TYR 80 105.028 -12.276 -2.591 568 HB2 TYR 80 1HB TYR 80 107.412 -10.548 -3.274 569 HB3 TYR 80 2HB TYR 80 106.754 -10.838 -1.676 570 HD1 TYR 80 HD1 TYR 80 107.126 -12.987 -0.535 571 HD2 TYR 80 HD2 TYR 80 108.782 -12.186 -4.416 572 HE1 TYR 80 HE1 TYR 80 108.662 -14.917 -0.280 573 HE2 TYR 80 HE2 TYR 80 110.316 -14.117 -4.159 574 HH TYR 80 HH TYR 80 109.911 -16.513 -2.002 575 H GLY 81 H GLY 81 103.831 -10.567 -1.726 576 HA2 GLY 81 1HA GLY 81 103.773 -8.043 -3.300 577 HA3 GLY 81 2HA GLY 81 102.275 -8.782 -2.730 578 H VAL 82 H VAL 82 103.497 -6.160 -2.036 579 HA VAL 82 HA VAL 82 103.789 -6.527 0.874 580 HB VAL 82 HB VAL 82 105.698 -4.936 0.867 581 HG11 VAL 82 1HG1 VAL 82 105.893 -7.597 -0.514 582 HG12 VAL 82 2HG1 VAL 82 106.444 -7.130 1.094 583 HG13 VAL 82 3HG1 VAL 82 107.329 -6.594 -0.331 584 HG21 VAL 82 3HG2 VAL 82 105.166 -3.908 -1.345 585 HG22 VAL 82 1HG2 VAL 82 105.684 -5.401 -2.128 586 HG23 VAL 82 2HG2 VAL 82 106.845 -4.431 -1.222 587 H VAL 83 H VAL 83 103.315 -4.741 2.127 588 HA VAL 83 HA VAL 83 102.551 -2.235 0.780 589 HB VAL 83 HB VAL 83 100.935 -3.537 2.995 590 HG11 VAL 83 1HG1 VAL 83 100.868 -1.128 3.172 591 HG12 VAL 83 2HG1 VAL 83 99.353 -1.647 2.435 592 HG13 VAL 83 3HG1 VAL 83 100.629 -0.957 1.433 593 HG21 VAL 83 3HG2 VAL 83 100.557 -4.701 0.888 594 HG22 VAL 83 1HG2 VAL 83 100.369 -3.168 0.035 595 HG23 VAL 83 2HG2 VAL 83 99.165 -3.671 1.222 596 H GLY 84 H GLY 84 102.861 -0.355 2.173 597 HA2 GLY 84 1HA GLY 84 103.869 -0.700 4.850 598 HA3 GLY 84 2HA GLY 84 105.144 -0.336 3.695 599 H VAL 85 H VAL 85 105.155 1.483 5.411 600 HA VAL 85 HA VAL 85 103.563 3.747 4.375 601 HB VAL 85 HB VAL 85 104.104 3.202 7.309 602 HG11 VAL 85 1HG1 VAL 85 104.040 5.589 6.770 603 HG12 VAL 85 2HG1 VAL 85 102.567 5.136 7.629 604 HG13 VAL 85 3HG1 VAL 85 102.532 5.370 5.881 605 HG21 VAL 85 3HG2 VAL 85 101.677 2.832 7.474 606 HG22 VAL 85 1HG2 VAL 85 102.391 1.683 6.341 607 HG23 VAL 85 2HG2 VAL 85 101.508 3.086 5.737 608 H GLY 86 H GLY 86 104.704 5.669 4.231 609 HA2 GLY 86 1HA GLY 86 107.522 5.602 5.150 610 HA3 GLY 86 2HA GLY 86 107.108 6.099 3.514 611 H TYR 87 H TYR 87 108.449 7.573 5.668 612 HA TYR 87 HA TYR 87 106.619 9.894 5.826 613 HB2 TYR 87 1HB TYR 87 108.578 8.991 7.942 614 HB3 TYR 87 2HB TYR 87 107.587 10.436 8.009 615 HD1 TYR 87 HD1 TYR 87 105.076 10.203 8.159 616 HD2 TYR 87 HD2 TYR 87 107.743 6.862 8.578 617 HE1 TYR 87 HE1 TYR 87 103.264 8.890 9.227 618 HE2 TYR 87 HE2 TYR 87 105.931 5.550 9.647 619 HH TYR 87 HH TYR 87 103.858 5.892 10.814 620 H GLY 88 H GLY 88 107.544 11.877 5.470 621 HA2 GLY 88 1HA GLY 88 110.407 11.917 4.704 622 HA3 GLY 88 2HA GLY 88 109.166 12.784 3.802 623 H LYS 89 H LYS 89 111.621 13.535 5.518 624 HA LYS 89 HA LYS 89 110.284 15.638 7.111 625 HB2 LYS 89 1HB LYS 89 112.666 13.958 7.933 626 HB3 LYS 89 2HB LYS 89 112.068 15.366 8.815 627 HG2 LYS 89 1HG LYS 89 109.930 14.285 9.203 628 HG3 LYS 89 2HG LYS 89 110.393 12.918 8.189 629 HD2 LYS 89 1HD LYS 89 110.718 12.248 10.481 630 HD3 LYS 89 2HD LYS 89 112.314 12.503 9.778 631 HE2 LYS 89 1HE LYS 89 112.119 13.531 12.031 632 HE3 LYS 89 2HE LYS 89 112.432 14.735 10.782 633 HZ1 LYS 89 3HZ LYS 89 110.367 15.604 10.969 634 HZ2 LYS 89 1HZ LYS 89 110.501 15.001 12.549 635 HZ3 LYS 89 2HZ LYS 89 109.642 14.123 11.376 636 H PHE 90 H PHE 90 111.220 17.631 7.028 637 HA PHE 90 HA PHE 90 113.636 17.926 5.335 638 HB2 PHE 90 1HB PHE 90 112.727 20.033 4.551 639 HB3 PHE 90 2HB PHE 90 111.602 18.731 4.217 640 HD1 PHE 90 HD1 PHE 90 112.240 21.759 6.198 641 HD2 PHE 90 HD2 PHE 90 109.464 18.580 5.401 642 HE1 PHE 90 HE1 PHE 90 110.460 23.016 7.384 643 HE2 PHE 90 HE2 PHE 90 107.684 19.837 6.587 644 HZ PHE 90 HZ PHE 90 108.183 22.055 7.577 645 H GLN 91 H GLN 91 115.004 19.753 5.854 646 HA GLN 91 HA GLN 91 115.690 19.913 8.548 647 HB2 GLN 91 1HB GLN 91 117.172 20.523 6.636 648 HB3 GLN 91 2HB GLN 91 116.247 22.011 6.439 649 HG2 GLN 91 1HG GLN 91 116.816 22.695 8.725 650 HG3 GLN 91 2HG GLN 91 117.697 21.190 8.972 651 HE21 GLN 91 1HE2 GLN 91 119.166 23.470 9.355 652 HE22 GLN 91 2HE2 GLN 91 120.224 23.739 8.055 653 H THR 92 H THR 92 115.181 21.246 10.216 654 HA THR 92 HA THR 92 113.081 23.280 9.741 655 HB THR 92 HB THR 92 113.204 21.372 12.084 656 HG1 THR 92 HG1 THR 92 112.372 20.070 10.665 657 HG21 THR 92 3HG2 THR 92 110.868 22.247 12.420 658 HG22 THR 92 1HG2 THR 92 111.193 23.442 11.165 659 HG23 THR 92 2HG2 THR 92 112.128 23.458 12.660 660 H THR 93 H THR 93 113.103 25.075 11.032 661 HA THR 93 HA THR 93 115.559 25.557 12.578 662 HB THR 93 HB THR 93 113.416 27.524 11.731 663 HG1 THR 93 HG1 THR 93 114.323 27.380 9.862 664 HG21 THR 93 3HG2 THR 93 115.357 29.129 12.133 665 HG22 THR 93 1HG2 THR 93 116.180 27.787 12.927 666 HG23 THR 93 2HG2 THR 93 114.657 28.395 13.576 667 H GLU 94 H GLU 94 115.347 26.621 14.707 668 HA GLU 94 HA GLU 94 113.374 25.179 16.244 669 HB2 GLU 94 1HB GLU 94 115.720 25.519 17.020 670 HB3 GLU 94 2HB GLU 94 115.381 27.243 17.182 671 HG2 GLU 94 1HG GLU 94 115.069 26.262 19.354 672 HG3 GLU 94 2HG GLU 94 113.471 26.631 18.718 673 H TYR 95 H TYR 95 111.380 25.888 16.121 674 HA TYR 95 HA TYR 95 110.814 28.756 16.524 675 HB2 TYR 95 1HB TYR 95 109.488 26.640 14.878 676 HB3 TYR 95 2HB TYR 95 108.521 27.961 15.511 677 HD1 TYR 95 HD1 TYR 95 112.026 27.898 14.186 678 HD2 TYR 95 HD2 TYR 95 108.014 29.356 13.710 679 HE1 TYR 95 HE1 TYR 95 112.770 29.328 12.301 680 HE2 TYR 95 HE2 TYR 95 108.757 30.786 11.824 681 HH TYR 95 HH TYR 95 111.412 30.374 10.142 682 HA PRO 96 HA PRO 96 108.881 27.650 20.394 683 HB2 PRO 96 1HB PRO 96 106.612 29.439 19.675 684 HB3 PRO 96 2HB PRO 96 107.660 29.467 21.106 685 HG2 PRO 96 1HG PRO 96 107.884 31.282 19.170 686 HG3 PRO 96 2HG PRO 96 109.297 30.673 20.053 687 HD2 PRO 96 1HD PRO 96 108.392 30.019 17.279 688 HD3 PRO 96 2HD PRO 96 110.042 30.139 17.931 689 H THR 97 H THR 97 106.953 26.479 21.201 690 HA THR 97 HA THR 97 106.226 24.586 19.144 691 HB THR 97 HB THR 97 105.226 23.319 21.040 692 HG1 THR 97 HG1 THR 97 104.611 24.644 22.566 693 HG21 THR 97 3HG2 THR 97 107.383 22.977 22.249 694 HG22 THR 97 1HG2 THR 97 108.025 24.410 21.446 695 HG23 THR 97 2HG2 THR 97 107.578 22.992 20.497 696 H TYR 98 H TYR 98 104.504 24.693 17.953 697 HA TYR 98 HA TYR 98 101.907 25.354 19.074 698 HB2 TYR 98 1HB TYR 98 102.841 27.543 18.340 699 HB3 TYR 98 2HB TYR 98 103.015 26.894 16.722 700 HD1 TYR 98 HD1 TYR 98 101.060 26.514 15.300 701 HD2 TYR 98 HD2 TYR 98 100.661 28.098 19.273 702 HE1 TYR 98 HE1 TYR 98 98.731 27.200 14.793 703 HE2 TYR 98 HE2 TYR 98 98.331 28.783 18.765 704 HH TYR 98 HH TYR 98 97.120 29.209 15.922 705 H LYS 99 H LYS 99 100.159 24.746 17.572 706 HA LYS 99 HA LYS 99 100.929 22.409 16.025 707 HB2 LYS 99 1HB LYS 99 98.224 23.638 16.610 708 HB3 LYS 99 2HB LYS 99 98.472 22.118 15.749 709 HG2 LYS 99 1HG LYS 99 99.696 21.234 17.735 710 HG3 LYS 99 2HG LYS 99 99.315 22.725 18.598 711 HD2 LYS 99 1HD LYS 99 96.886 22.273 18.221 712 HD3 LYS 99 2HD LYS 99 97.322 20.725 17.495 713 HE2 LYS 99 1HE LYS 99 98.329 21.443 20.238 714 HE3 LYS 99 2HE LYS 99 96.705 20.786 20.031 715 HZ1 LYS 99 3HZ LYS 99 98.112 19.107 18.528 716 HZ2 LYS 99 1HZ LYS 99 97.793 18.841 20.173 717 HZ3 LYS 99 2HZ LYS 99 99.284 19.499 19.694 718 H HIS 100 H HIS 100 101.370 22.459 13.922 719 HA HIS 100 HA HIS 100 99.857 23.845 11.983 720 HB2 HIS 100 1HB HIS 100 100.944 25.826 12.971 721 HB3 HIS 100 2HB HIS 100 102.515 25.112 12.660 722 HD1 HIS 100 HD1 HIS 100 99.411 26.039 10.632 723 HD2 HIS 100 HD2 HIS 100 103.564 25.994 10.276 724 HE1 HIS 100 HE1 HIS 100 99.945 27.034 8.367 725 H ASP 101 H ASP 101 103.332 23.184 12.486 726 HA ASP 101 HA ASP 101 103.567 22.111 9.809 727 HB2 ASP 101 1HB ASP 101 105.354 23.487 10.846 728 HB3 ASP 101 2HB ASP 101 105.616 22.208 12.032 729 H THR 102 H THR 102 103.178 20.081 9.280 730 HA THR 102 HA THR 102 103.668 17.947 11.276 731 HB THR 102 HB THR 102 101.470 17.979 9.193 732 HG1 THR 102 HG1 THR 102 100.188 18.689 10.728 733 HG21 THR 102 3HG2 THR 102 102.384 16.041 11.306 734 HG22 THR 102 1HG2 THR 102 101.982 15.729 9.617 735 HG23 THR 102 2HG2 THR 102 100.700 16.063 10.782 736 H SER 103 H SER 103 104.653 16.092 10.522 737 HA SER 103 HA SER 103 106.262 16.311 8.188 738 HB2 SER 103 1HB SER 103 107.055 14.122 8.730 739 HB3 SER 103 2HB SER 103 106.770 14.941 10.263 740 HG SER 103 HG SER 103 105.234 12.961 8.960 741 H ASP 104 H ASP 104 106.249 14.662 6.402 742 HA ASP 104 HA ASP 104 103.478 14.408 5.421 743 HB2 ASP 104 1HB ASP 104 106.127 14.276 3.963 744 HB3 ASP 104 2HB ASP 104 104.547 14.102 3.203 745 H TYR 105 H TYR 105 102.586 12.449 4.892 746 HA TYR 105 HA TYR 105 104.308 10.059 5.035 747 HB2 TYR 105 1HB TYR 105 102.746 8.896 6.424 748 HB3 TYR 105 2HB TYR 105 103.176 10.398 7.216 749 HD1 TYR 105 HD2 TYR 105 101.535 12.198 7.472 750 HD2 TYR 105 HD1 TYR 105 100.512 8.502 5.537 751 HE1 TYR 105 HE2 TYR 105 99.128 12.764 7.662 752 HE2 TYR 105 HE1 TYR 105 98.104 9.068 5.727 753 HH TYR 105 HH TYR 105 96.995 11.750 7.633 754 H GLY 106 H GLY 106 103.509 8.224 3.906 755 HA2 GLY 106 1HA GLY 106 101.077 8.505 2.318 756 HA3 GLY 106 2HA GLY 106 102.581 8.445 1.405 757 H PHE 107 H PHE 107 100.790 6.521 0.893 758 HA PHE 107 HA PHE 107 101.711 4.128 2.389 759 HB2 PHE 107 1HB PHE 107 99.142 4.566 0.861 760 HB3 PHE 107 2HB PHE 107 99.619 3.061 1.626 761 HD1 PHE 107 HD1 PHE 107 99.729 2.900 4.108 762 HD2 PHE 107 HD2 PHE 107 98.256 6.408 2.114 763 HE1 PHE 107 HE1 PHE 107 98.689 3.667 6.225 764 HE2 PHE 107 HE2 PHE 107 97.216 7.176 4.231 765 HZ PHE 107 HZ PHE 107 97.433 5.805 6.287 766 H SER 108 H SER 108 102.453 2.342 1.214 767 HA SER 108 HA SER 108 102.610 2.670 -1.724 768 HB2 SER 108 1HB SER 108 104.909 1.886 0.084 769 HB3 SER 108 2HB SER 108 104.947 1.933 -1.675 770 HG SER 108 HG SER 108 105.416 3.966 -1.439 771 H TYR 109 H TYR 109 102.618 0.776 -2.908 772 HA TYR 109 HA TYR 109 102.809 -1.791 -1.554 773 HB2 TYR 109 1HB TYR 109 100.657 -2.600 -2.221 774 HB3 TYR 109 2HB TYR 109 100.429 -1.122 -1.310 775 HD1 TYR 109 HD1 TYR 109 99.767 0.977 -2.479 776 HD2 TYR 109 HD2 TYR 109 100.034 -2.788 -4.530 777 HE1 TYR 109 HE1 TYR 109 98.435 1.904 -4.355 778 HE2 TYR 109 HE2 TYR 109 98.702 -1.860 -6.406 779 HH TYR 109 HH TYR 109 97.909 1.542 -6.589 780 H GLY 110 H GLY 110 102.886 -3.603 -3.093 781 HA2 GLY 110 1HA GLY 110 102.794 -3.326 -5.884 782 HA3 GLY 110 2HA GLY 110 104.454 -3.034 -5.382 783 H ALA 111 H ALA 111 104.449 -5.053 -6.928 784 HA ALA 111 HA ALA 111 104.746 -7.387 -5.181 785 HB1 ALA 111 1HB ALA 111 102.870 -7.185 -7.507 786 HB2 ALA 111 2HB ALA 111 102.644 -7.990 -5.954 787 HB3 ALA 111 3HB ALA 111 103.677 -8.719 -7.184 788 H GLY 112 H GLY 112 106.107 -9.052 -6.116 789 HA2 GLY 112 1HA GLY 112 107.649 -8.241 -8.483 790 HA3 GLY 112 2HA GLY 112 108.516 -8.467 -6.968 791 H LEU 113 H LEU 113 109.113 -9.942 -9.238 792 HA LEU 113 HA LEU 113 108.206 -12.661 -8.496 793 HB2 LEU 113 1HB LEU 113 108.801 -11.635 -11.284 794 HB3 LEU 113 2HB LEU 113 108.382 -13.295 -10.862 795 HG LEU 113 HG LEU 113 106.277 -12.136 -9.737 796 HD11 LEU 113 1HD1 LEU 113 106.644 -9.852 -10.051 797 HD12 LEU 113 2HD1 LEU 113 105.633 -10.234 -11.442 798 HD13 LEU 113 3HD1 LEU 113 107.379 -10.086 -11.637 799 HD21 LEU 113 3HD2 LEU 113 106.514 -12.427 -12.748 800 HD22 LEU 113 1HD2 LEU 113 105.028 -12.521 -11.803 801 HD23 LEU 113 2HD2 LEU 113 106.264 -13.767 -11.629 802 H GLN 114 H GLN 114 109.785 -14.331 -8.779 803 HA GLN 114 HA GLN 114 112.564 -13.303 -8.727 804 HB2 GLN 114 1HB GLN 114 111.513 -15.908 -7.600 805 HB3 GLN 114 2HB GLN 114 113.126 -15.237 -7.386 806 HG2 GLN 114 1HG GLN 114 110.538 -14.047 -6.350 807 HG3 GLN 114 2HG GLN 114 111.781 -14.834 -5.384 808 HE21 GLN 114 1HE2 GLN 114 110.663 -11.859 -5.815 809 HE22 GLN 114 2HE2 GLN 114 112.097 -10.953 -5.792 810 H PHE 115 H PHE 115 114.061 -14.118 -10.100 811 HA PHE 115 HA PHE 115 113.305 -16.421 -11.802 812 HB2 PHE 115 1HB PHE 115 113.175 -14.251 -13.027 813 HB3 PHE 115 2HB PHE 115 114.871 -13.986 -12.668 814 HD1 PHE 115 HD2 PHE 115 112.452 -15.918 -14.648 815 HD2 PHE 115 HD1 PHE 115 116.613 -15.287 -13.792 816 HE1 PHE 115 HE2 PHE 115 113.063 -17.196 -16.683 817 HE2 PHE 115 HE1 PHE 115 117.224 -16.566 -15.827 818 HZ PHE 115 HZ PHE 115 115.450 -17.520 -17.273 819 H ASN 116 H ASN 116 115.140 -17.654 -12.600 820 HA ASN 116 HA ASN 116 117.485 -17.467 -10.795 821 HB2 ASN 116 1HB ASN 116 117.696 -19.925 -11.130 822 HB3 ASN 116 2HB ASN 116 116.202 -19.462 -10.321 823 HD21 ASN 116 1HD2 ASN 116 114.218 -19.297 -11.796 824 HD22 ASN 116 2HD2 ASN 116 114.133 -20.347 -13.127 825 HA PRO 117 HA PRO 117 119.028 -16.619 -15.092 826 HB2 PRO 117 1HB PRO 117 121.292 -15.505 -13.517 827 HB3 PRO 117 2HB PRO 117 120.410 -14.802 -14.886 828 HG2 PRO 117 1HG PRO 117 120.062 -13.923 -12.398 829 HG3 PRO 117 2HG PRO 117 118.730 -13.987 -13.566 830 HD2 PRO 117 1HD PRO 117 119.285 -15.796 -11.252 831 HD3 PRO 117 2HD PRO 117 117.728 -15.266 -11.925 832 H MET 118 H MET 118 121.429 -17.287 -12.514 833 HA MET 118 HA MET 118 122.662 -19.286 -14.272 834 HB2 MET 118 1HB MET 118 123.641 -18.115 -11.655 835 HB3 MET 118 2HB MET 118 124.559 -19.183 -12.713 836 HG2 MET 118 1HG MET 118 123.535 -16.418 -13.429 837 HG3 MET 118 2HG MET 118 125.208 -16.840 -13.078 838 HE1 MET 118 3HE MET 118 126.479 -18.891 -15.847 839 HE2 MET 118 1HE MET 118 125.413 -19.835 -14.799 840 HE3 MET 118 2HE MET 118 126.435 -18.575 -14.114 841 H GLU 119 H GLU 119 122.284 -19.190 -10.714 842 HA GLU 119 HA GLU 119 120.618 -21.473 -10.551 843 HB2 GLU 119 1HB GLU 119 122.670 -22.577 -11.454 844 HB3 GLU 119 2HB GLU 119 123.544 -22.035 -10.021 845 HG2 GLU 119 1HG GLU 119 122.823 -24.286 -9.592 846 HG3 GLU 119 2HG GLU 119 121.812 -23.223 -8.621 847 H ASN 120 H ASN 120 123.541 -20.389 -8.803 848 HA ASN 120 HA ASN 120 122.114 -20.600 -6.284 849 HB2 ASN 120 1HB ASN 120 124.264 -20.208 -5.249 850 HB3 ASN 120 2HB ASN 120 124.431 -21.413 -6.521 851 HD21 ASN 120 1HD2 ASN 120 126.674 -19.885 -5.606 852 HD22 ASN 120 2HD2 ASN 120 127.172 -18.863 -6.866 853 H VAL 121 H VAL 121 121.856 -18.236 -8.433 854 HA VAL 121 HA VAL 121 121.737 -16.152 -6.341 855 HB VAL 121 HB VAL 121 123.714 -15.762 -7.761 856 HG11 VAL 121 1HG1 VAL 121 122.957 -16.859 -9.811 857 HG12 VAL 121 2HG1 VAL 121 123.375 -15.180 -10.153 858 HG13 VAL 121 3HG1 VAL 121 121.683 -15.656 -10.009 859 HG21 VAL 121 3HG2 VAL 121 123.170 -13.448 -8.403 860 HG22 VAL 121 1HG2 VAL 121 122.455 -13.841 -6.840 861 HG23 VAL 121 2HG2 VAL 121 121.449 -13.814 -8.288 862 H ALA 122 H ALA 122 119.944 -14.853 -6.386 863 HA ALA 122 HA ALA 122 117.892 -15.523 -8.423 864 HB1 ALA 122 1HB ALA 122 116.229 -15.309 -6.790 865 HB2 ALA 122 2HB ALA 122 117.276 -14.393 -5.705 866 HB3 ALA 122 3HB ALA 122 117.532 -16.124 -5.923 867 H LEU 123 H LEU 123 116.830 -13.897 -9.442 868 HA LEU 123 HA LEU 123 117.749 -11.129 -8.904 869 HB2 LEU 123 1HB LEU 123 118.461 -12.227 -11.096 870 HB3 LEU 123 2HB LEU 123 116.757 -12.224 -11.545 871 HG LEU 123 HG LEU 123 116.757 -9.723 -11.090 872 HD11 LEU 123 1HD1 LEU 123 119.720 -10.318 -10.910 873 HD12 LEU 123 2HD1 LEU 123 118.718 -9.465 -9.737 874 HD13 LEU 123 3HD1 LEU 123 119.099 -8.711 -11.284 875 HD21 LEU 123 3HD2 LEU 123 116.997 -10.868 -13.367 876 HD22 LEU 123 1HD2 LEU 123 118.731 -10.578 -13.222 877 HD23 LEU 123 2HD2 LEU 123 117.611 -9.217 -13.272 878 H ASP 124 H ASP 124 116.137 -9.598 -8.557 879 HA ASP 124 HA ASP 124 113.347 -10.609 -8.712 880 HB2 ASP 124 1HB ASP 124 112.903 -9.387 -6.625 881 HB3 ASP 124 2HB ASP 124 114.138 -10.624 -6.399 882 H PHE 125 H PHE 125 111.900 -9.340 -9.646 883 HA PHE 125 HA PHE 125 112.506 -6.456 -9.967 884 HB2 PHE 125 1HB PHE 125 111.209 -8.303 -11.977 885 HB3 PHE 125 2HB PHE 125 111.230 -6.557 -12.112 886 HD1 PHE 125 HD1 PHE 125 113.211 -9.644 -12.339 887 HD2 PHE 125 HD2 PHE 125 113.283 -5.364 -12.686 888 HE1 PHE 125 HE1 PHE 125 115.395 -9.774 -13.505 889 HE2 PHE 125 HE2 PHE 125 115.469 -5.494 -13.848 890 HZ PHE 125 HZ PHE 125 116.525 -7.699 -14.258 891 H SER 126 H SER 126 110.818 -5.088 -9.466 892 HA SER 126 HA SER 126 108.146 -6.250 -9.091 893 HB2 SER 126 1HB SER 126 109.331 -4.502 -6.948 894 HB3 SER 126 2HB SER 126 107.894 -5.512 -6.871 895 HG SER 126 HG SER 126 109.735 -6.453 -5.836 896 H TYR 127 H TYR 127 106.448 -4.698 -9.031 897 HA TYR 127 HA TYR 127 107.184 -2.040 -10.113 898 HB2 TYR 127 1HB TYR 127 104.514 -3.455 -10.225 899 HB3 TYR 127 2HB TYR 127 104.935 -1.949 -11.018 900 HD1 TYR 127 HD1 TYR 127 106.500 -1.954 -12.959 901 HD2 TYR 127 HD2 TYR 127 105.113 -5.587 -11.135 902 HE1 TYR 127 HE1 TYR 127 107.228 -3.236 -14.955 903 HE2 TYR 127 HE2 TYR 127 105.841 -6.867 -13.130 904 HH TYR 127 HH TYR 127 107.643 -5.323 -15.746 905 H GLU 128 H GLU 128 106.958 -0.371 -8.744 906 HA GLU 128 HA GLU 128 105.259 -0.755 -6.340 907 HB2 GLU 128 1HB GLU 128 107.718 -0.669 -5.916 908 HB3 GLU 128 2HB GLU 128 107.738 0.958 -6.593 909 HG2 GLU 128 1HG GLU 128 107.555 1.197 -4.209 910 HG3 GLU 128 2HG GLU 128 105.982 1.594 -4.893 911 H GLN 129 H GLN 129 103.721 0.683 -5.935 912 HA GLN 129 HA GLN 129 103.832 3.331 -7.249 913 HB2 GLN 129 1HB GLN 129 101.399 1.557 -6.891 914 HB3 GLN 129 2HB GLN 129 101.353 3.230 -7.451 915 HG2 GLN 129 1HG GLN 129 102.735 2.657 -9.384 916 HG3 GLN 129 2HG GLN 129 102.887 0.997 -8.812 917 HE21 GLN 129 1HE2 GLN 129 101.759 1.600 -11.376 918 HE22 GLN 129 2HE2 GLN 129 100.114 1.184 -11.344 919 H SER 130 H SER 130 103.252 5.047 -5.938 920 HA SER 130 HA SER 130 102.262 4.426 -3.228 921 HB2 SER 130 1HB SER 130 104.738 4.629 -3.142 922 HB3 SER 130 2HB SER 130 104.605 6.247 -3.824 923 HG SER 130 HG SER 130 103.384 6.838 -2.005 924 H ARG 131 H ARG 131 101.043 6.021 -2.275 925 HA ARG 131 HA ARG 131 100.391 8.376 -3.957 926 HB2 ARG 131 1HB ARG 131 98.544 6.705 -3.787 927 HB3 ARG 131 2HB ARG 131 98.555 6.923 -2.036 928 HG2 ARG 131 1HG ARG 131 98.130 9.359 -2.375 929 HG3 ARG 131 2HG ARG 131 98.001 9.064 -4.110 930 HD2 ARG 131 1HD ARG 131 96.260 7.790 -1.980 931 HD3 ARG 131 2HD ARG 131 95.775 9.109 -3.041 932 HE ARG 131 HE ARG 131 96.632 7.102 -4.729 933 HH11 ARG 131 1HH1 ARG 131 94.156 7.358 -2.252 934 HH12 ARG 131 2HH1 ARG 131 93.135 6.183 -3.011 935 HH21 ARG 131 1HH2 ARG 131 95.275 5.596 -5.659 936 HH22 ARG 131 2HH2 ARG 131 93.761 5.199 -4.916 937 H ILE 132 H ILE 132 100.819 10.279 -3.059 938 HA ILE 132 HA ILE 132 101.059 10.478 -0.121 939 HB ILE 132 HB ILE 132 102.935 11.758 -2.137 940 HG12 ILE 132 1HG1 ILE 132 103.499 9.581 -0.102 941 HG13 ILE 132 2HG1 ILE 132 103.264 9.285 -1.825 942 HG21 ILE 132 1HG2 ILE 132 103.019 11.703 0.895 943 HG22 ILE 132 2HG2 ILE 132 102.461 13.075 -0.063 944 HG23 ILE 132 3HG2 ILE 132 104.141 12.549 -0.172 945 HD11 ILE 132 3HD1 ILE 132 105.132 11.019 -2.198 946 HD12 ILE 132 1HD1 ILE 132 105.615 9.443 -1.571 947 HD13 ILE 132 2HD1 ILE 132 105.486 10.823 -0.480 948 H ARG 133 H ARG 133 99.190 11.580 0.170 949 HA ARG 133 HA ARG 133 97.248 12.587 -0.773 950 HB2 ARG 133 1HB ARG 133 99.032 14.842 0.144 951 HB3 ARG 133 2HB ARG 133 97.273 14.847 0.101 952 HG2 ARG 133 1HG ARG 133 98.896 12.876 1.733 953 HG3 ARG 133 2HG ARG 133 98.270 14.390 2.378 954 HD2 ARG 133 1HD ARG 133 96.584 12.180 1.163 955 HD3 ARG 133 2HD ARG 133 96.764 12.499 2.883 956 HE ARG 133 HE ARG 133 95.063 13.903 1.070 957 HH11 ARG 133 1HH1 ARG 133 97.050 14.398 3.923 958 HH12 ARG 133 2HH1 ARG 133 96.126 15.764 4.451 959 HH21 ARG 133 1HH2 ARG 133 93.912 15.668 1.801 960 HH22 ARG 133 2HH2 ARG 133 94.372 16.473 3.264 961 H SER 134 H SER 134 97.190 12.315 -3.023 962 HA SER 134 HA SER 134 96.469 13.301 -4.968 963 HB2 SER 134 1HB SER 134 95.979 15.354 -3.611 964 HB3 SER 134 2HB SER 134 97.601 15.922 -3.996 965 HG SER 134 HG SER 134 95.501 15.277 -5.800 966 H VAL 135 H VAL 135 99.727 13.217 -3.940 967 HA VAL 135 HA VAL 135 100.660 13.803 -6.683 968 HB VAL 135 HB VAL 135 102.274 13.446 -4.141 969 HG11 VAL 135 1HG1 VAL 135 104.108 14.377 -5.497 970 HG12 VAL 135 2HG1 VAL 135 103.038 14.462 -6.897 971 HG13 VAL 135 3HG1 VAL 135 103.488 12.895 -6.225 972 HG21 VAL 135 3HG2 VAL 135 101.278 15.903 -5.604 973 HG22 VAL 135 1HG2 VAL 135 102.629 15.956 -4.472 974 HG23 VAL 135 2HG2 VAL 135 101.028 15.479 -3.910 975 H ASP 136 H ASP 136 101.529 12.183 -7.929 976 HA ASP 136 HA ASP 136 101.266 9.455 -6.802 977 HB2 ASP 136 1HB ASP 136 101.209 10.402 -9.674 978 HB3 ASP 136 2HB ASP 136 101.074 8.722 -9.156 979 H VAL 137 H VAL 137 103.033 8.214 -6.571 980 HA VAL 137 HA VAL 137 105.539 9.091 -7.900 981 HB VAL 137 HB VAL 137 105.260 7.738 -5.203 982 HG11 VAL 137 1HG1 VAL 137 107.718 8.571 -5.113 983 HG12 VAL 137 2HG1 VAL 137 107.587 8.693 -6.867 984 HG13 VAL 137 3HG1 VAL 137 107.368 7.134 -6.073 985 HG21 VAL 137 3HG2 VAL 137 104.525 9.943 -4.821 986 HG22 VAL 137 1HG2 VAL 137 105.614 10.614 -6.035 987 HG23 VAL 137 2HG2 VAL 137 106.255 10.044 -4.495 988 H GLY 138 H GLY 138 106.631 7.591 -9.037 989 HA2 GLY 138 1HA GLY 138 105.680 4.779 -8.901 990 HA3 GLY 138 2HA GLY 138 106.136 5.569 -10.410 991 H THR 139 H THR 139 107.222 3.383 -8.279 992 HA THR 139 HA THR 139 110.063 4.138 -8.683 993 HB THR 139 HB THR 139 108.926 2.666 -6.296 994 HG1 THR 139 HG1 THR 139 108.630 4.553 -5.458 995 HG21 THR 139 3HG2 THR 139 111.199 3.141 -5.371 996 HG22 THR 139 1HG2 THR 139 111.669 3.778 -6.948 997 HG23 THR 139 2HG2 THR 139 111.237 2.076 -6.777 998 H TRP 140 H TRP 140 111.303 2.662 -9.622 999 HA TRP 140 HA TRP 140 110.259 -0.091 -9.942 1000 HB2 TRP 140 1HB TRP 140 112.305 1.426 -11.572 1001 HB3 TRP 140 2HB TRP 140 111.814 -0.232 -11.856 1002 HD1 TRP 140 HD1 TRP 140 110.250 3.300 -11.763 1003 HE1 TRP 140 HE1 TRP 140 108.359 3.384 -13.512 1004 HE3 TRP 140 HE3 TRP 140 110.328 -1.543 -13.377 1005 HZ2 TRP 140 HZ2 TRP 140 107.052 1.627 -15.358 1006 HZ3 TRP 140 HZ3 TRP 140 108.756 -2.309 -15.129 1007 HH2 TRP 140 HH2 TRP 140 107.119 -0.735 -16.121 1008 H ILE 141 H ILE 141 111.406 -1.748 -9.057 1009 HA ILE 141 HA ILE 141 114.065 -1.102 -7.908 1010 HB ILE 141 HB ILE 141 113.548 -2.627 -6.062 1011 HG12 ILE 141 1HG1 ILE 141 110.715 -2.708 -7.131 1012 HG13 ILE 141 2HG1 ILE 141 111.880 -4.001 -7.414 1013 HG21 ILE 141 1HG2 ILE 141 111.877 -0.210 -6.623 1014 HG22 ILE 141 2HG2 ILE 141 113.068 -0.492 -5.358 1015 HG23 ILE 141 3HG2 ILE 141 111.458 -1.182 -5.214 1016 HD11 ILE 141 3HD1 ILE 141 110.634 -3.120 -4.829 1017 HD12 ILE 141 1HD1 ILE 141 112.213 -3.905 -4.815 1018 HD13 ILE 141 2HD1 ILE 141 110.815 -4.749 -5.479 1019 H ALA 142 H ALA 142 115.687 -2.483 -8.251 1020 HA ALA 142 HA ALA 142 115.074 -5.241 -9.079 1021 HB1 ALA 142 1HB ALA 142 117.140 -4.940 -10.672 1022 HB2 ALA 142 2HB ALA 142 116.701 -3.232 -10.607 1023 HB3 ALA 142 3HB ALA 142 115.543 -4.419 -11.210 1024 H GLY 143 H GLY 143 116.468 -6.746 -8.187 1025 HA2 GLY 143 1HA GLY 143 119.018 -5.906 -7.071 1026 HA3 GLY 143 2HA GLY 143 117.794 -6.275 -5.864 1027 H VAL 144 H VAL 144 119.820 -7.785 -5.540 1028 HA VAL 144 HA VAL 144 119.146 -10.384 -6.764 1029 HB VAL 144 HB VAL 144 121.559 -10.929 -6.890 1030 HG11 VAL 144 1HG1 VAL 144 120.461 -8.567 -8.408 1031 HG12 VAL 144 2HG1 VAL 144 120.666 -10.231 -8.956 1032 HG13 VAL 144 3HG1 VAL 144 122.075 -9.190 -8.750 1033 HG21 VAL 144 3HG2 VAL 144 123.228 -9.183 -6.607 1034 HG22 VAL 144 1HG2 VAL 144 122.257 -9.266 -5.137 1035 HG23 VAL 144 2HG2 VAL 144 121.973 -7.980 -6.310 1036 H GLY 145 H GLY 145 119.622 -12.204 -5.428 1037 HA2 GLY 145 1HA GLY 145 120.344 -11.595 -2.635 1038 HA3 GLY 145 2HA GLY 145 118.803 -12.378 -2.964 1039 H TYR 146 H TYR 146 120.723 -13.513 -1.341 1040 HA TYR 146 HA TYR 146 121.370 -15.952 -2.860 1041 HB2 TYR 146 1HB TYR 146 123.432 -14.588 -2.621 1042 HB3 TYR 146 2HB TYR 146 123.218 -14.606 -0.881 1043 HD1 TYR 146 HD1 TYR 146 123.992 -16.665 -3.858 1044 HD2 TYR 146 HD2 TYR 146 123.810 -16.536 0.432 1045 HE1 TYR 146 HE1 TYR 146 125.253 -18.797 -3.740 1046 HE2 TYR 146 HE2 TYR 146 125.071 -18.668 0.550 1047 HH TYR 146 HH TYR 146 125.499 -20.697 -2.082 1048 H ARG 147 H ARG 147 121.110 -17.849 -1.676 1049 HA ARG 147 HA ARG 147 119.976 -17.514 1.044 1050 HB2 ARG 147 1HB ARG 147 118.487 -19.375 0.569 1051 HB3 ARG 147 2HB ARG 147 118.276 -18.116 -0.643 1052 HG2 ARG 147 1HG ARG 147 119.860 -19.393 -2.134 1053 HG3 ARG 147 2HG ARG 147 119.827 -20.701 -0.951 1054 HD2 ARG 147 1HD ARG 147 117.340 -20.789 -1.186 1055 HD3 ARG 147 2HD ARG 147 117.451 -19.580 -2.461 1056 HE ARG 147 HE ARG 147 118.174 -22.385 -2.650 1057 HH11 ARG 147 1HH1 ARG 147 118.539 -19.212 -4.105 1058 HH12 ARG 147 2HH1 ARG 147 118.973 -19.860 -5.651 1059 HH21 ARG 147 1HH2 ARG 147 118.739 -23.161 -4.662 1060 HH22 ARG 147 2HH2 ARG 147 119.085 -22.069 -5.962 1061 H PHE 148 H PHE 148 120.522 -18.971 2.613 1062 HA PHE 148 HA PHE 148 122.200 -21.261 2.012 1063 HB2 PHE 148 1HB PHE 148 123.801 -19.371 2.066 1064 HB3 PHE 148 2HB PHE 148 123.272 -18.996 3.695 1065 HD1 PHE 148 HD1 PHE 148 125.052 -21.454 1.581 1066 HD2 PHE 148 HD2 PHE 148 124.026 -20.288 5.584 1067 HE1 PHE 148 HE1 PHE 148 126.723 -23.055 2.476 1068 HE2 PHE 148 HE2 PHE 148 125.696 -21.887 6.480 1069 HZ PHE 148 HZ PHE 148 127.045 -23.271 4.925 Start of MODEL 12 1 H1 ALA 1 3H ALA 1 118.029 -23.135 10.251 2 H2 ALA 1 2H ALA 1 117.307 -24.450 9.454 3 H3 ALA 1 HT3 ALA 1 116.582 -23.793 10.843 4 HA ALA 1 HA ALA 1 115.520 -23.158 8.679 5 HB1 ALA 1 2HB ALA 1 115.683 -20.606 9.388 6 HB2 ALA 1 3HB ALA 1 116.510 -21.281 10.793 7 HB3 ALA 1 1HB ALA 1 114.859 -21.775 10.419 8 H THR 2 H THR 2 115.671 -21.318 7.071 9 HA THR 2 HA THR 2 118.458 -20.968 6.119 10 HB THR 2 HB THR 2 117.631 -21.133 3.830 11 HG1 THR 2 HG1 THR 2 115.143 -21.936 4.873 12 HG21 THR 2 3HG2 THR 2 117.487 -23.450 3.770 13 HG22 THR 2 1HG2 THR 2 116.434 -23.524 5.183 14 HG23 THR 2 2HG2 THR 2 118.156 -23.205 5.383 15 H SER 3 H SER 3 119.007 -18.971 5.324 16 HA SER 3 HA SER 3 116.946 -16.847 5.522 17 HB2 SER 3 1HB SER 3 119.825 -16.675 6.450 18 HB3 SER 3 2HB SER 3 118.651 -15.362 6.474 19 HG SER 3 HG SER 3 119.048 -17.288 8.272 20 H THR 4 H THR 4 117.162 -15.126 4.061 21 HA THR 4 HA THR 4 119.216 -15.470 1.950 22 HB THR 4 HB THR 4 116.351 -14.607 1.501 23 HG1 THR 4 HG1 THR 4 116.324 -16.761 1.954 24 HG21 THR 4 3HG2 THR 4 118.636 -15.282 -0.373 25 HG22 THR 4 1HG2 THR 4 117.936 -13.683 -0.112 26 HG23 THR 4 2HG2 THR 4 116.979 -14.949 -0.881 27 H VAL 5 H VAL 5 120.309 -13.671 1.410 28 HA VAL 5 HA VAL 5 119.388 -11.100 2.580 29 HB VAL 5 HB VAL 5 122.218 -11.940 1.886 30 HG11 VAL 5 1HG1 VAL 5 122.801 -9.878 3.159 31 HG12 VAL 5 2HG1 VAL 5 121.082 -9.503 3.293 32 HG13 VAL 5 3HG1 VAL 5 121.859 -9.526 1.709 33 HG21 VAL 5 3HG2 VAL 5 121.339 -13.186 3.829 34 HG22 VAL 5 1HG2 VAL 5 120.836 -11.670 4.577 35 HG23 VAL 5 2HG2 VAL 5 122.550 -12.010 4.338 36 H THR 6 H THR 6 118.915 -9.518 1.171 37 HA THR 6 HA THR 6 119.915 -9.716 -1.597 38 HB THR 6 HB THR 6 117.028 -9.106 -0.955 39 HG1 THR 6 HG1 THR 6 117.066 -11.162 -0.422 40 HG21 THR 6 3HG2 THR 6 118.388 -8.613 -3.238 41 HG22 THR 6 1HG2 THR 6 116.690 -9.085 -3.221 42 HG23 THR 6 2HG2 THR 6 117.936 -10.293 -3.525 43 H GLY 7 H GLY 7 120.157 -7.741 -2.650 44 HA2 GLY 7 1HA GLY 7 119.263 -5.314 -1.231 45 HA3 GLY 7 2HA GLY 7 120.957 -5.451 -1.707 46 H GLY 8 H GLY 8 118.916 -3.521 -2.635 47 HA2 GLY 8 1HA GLY 8 119.382 -3.866 -5.491 48 HA3 GLY 8 2HA GLY 8 117.695 -3.888 -4.993 49 H TYR 9 H TYR 9 118.407 -2.023 -6.729 50 HA TYR 9 HA TYR 9 118.474 0.486 -5.159 51 HB2 TYR 9 1HB TYR 9 119.723 1.551 -6.909 52 HB3 TYR 9 2HB TYR 9 120.582 0.108 -6.414 53 HD1 TYR 9 HD1 TYR 9 120.613 -1.897 -7.894 54 HD2 TYR 9 HD2 TYR 9 118.838 1.817 -9.122 55 HE1 TYR 9 HE1 TYR 9 120.655 -2.658 -10.253 56 HE2 TYR 9 HE2 TYR 9 118.881 1.056 -11.482 57 HH TYR 9 HH TYR 9 120.385 -0.695 -12.821 58 H ALA 10 H ALA 10 117.023 2.076 -5.773 59 HA ALA 10 HA ALA 10 115.297 1.524 -8.095 60 HB1 ALA 10 1HB ALA 10 113.992 2.505 -5.598 61 HB2 ALA 10 2HB ALA 10 114.389 0.791 -5.710 62 HB3 ALA 10 3HB ALA 10 113.329 1.530 -6.908 63 H GLN 11 H GLN 11 114.563 3.291 -9.153 64 HA GLN 11 HA GLN 11 115.156 5.958 -8.005 65 HB2 GLN 11 1HB GLN 11 116.479 5.400 -10.057 66 HB3 GLN 11 2HB GLN 11 114.960 5.214 -10.937 67 HG2 GLN 11 1HG GLN 11 114.358 7.538 -10.435 68 HG3 GLN 11 2HG GLN 11 115.836 7.735 -9.499 69 HE21 GLN 11 1HE2 GLN 11 115.526 9.509 -11.563 70 HE22 GLN 11 2HE2 GLN 11 116.541 9.112 -12.866 71 H SER 12 H SER 12 113.471 7.483 -8.056 72 HA SER 12 HA SER 12 110.826 6.358 -8.812 73 HB2 SER 12 1HB SER 12 111.490 8.161 -6.474 74 HB3 SER 12 2HB SER 12 109.887 7.576 -6.907 75 HG SER 12 HG SER 12 112.151 6.103 -6.044 76 H ASP 13 H ASP 13 109.483 7.596 -9.947 77 HA ASP 13 HA ASP 13 110.374 10.304 -10.703 78 HB2 ASP 13 1HB ASP 13 108.378 8.435 -12.013 79 HB3 ASP 13 2HB ASP 13 108.765 10.057 -12.582 80 H ALA 14 H ALA 14 109.017 12.056 -10.361 81 HA ALA 14 HA ALA 14 106.726 11.523 -8.563 82 HB1 ALA 14 1HB ALA 14 109.038 12.682 -7.798 83 HB2 ALA 14 2HB ALA 14 107.474 13.084 -7.093 84 HB3 ALA 14 3HB ALA 14 108.164 14.110 -8.352 85 H GLN 15 H GLN 15 104.988 11.826 -9.759 86 HA GLN 15 HA GLN 15 104.802 13.989 -11.697 87 HB2 GLN 15 1HB GLN 15 103.743 11.758 -12.101 88 HB3 GLN 15 2HB GLN 15 102.654 12.074 -10.750 89 HG2 GLN 15 1HG GLN 15 101.448 12.741 -12.689 90 HG3 GLN 15 2HG GLN 15 102.020 14.240 -11.961 91 HE21 GLN 15 1HE2 GLN 15 102.991 15.638 -13.426 92 HE22 GLN 15 2HE2 GLN 15 103.757 15.163 -14.865 93 H GLY 16 H GLY 16 104.160 15.945 -11.216 94 HA2 GLY 16 1HA GLY 16 102.958 17.664 -10.184 95 HA3 GLY 16 2HA GLY 16 102.351 16.513 -9.005 96 H GLN 17 H GLN 17 105.351 15.655 -8.684 97 HA GLN 17 HA GLN 17 106.258 17.986 -7.102 98 HB2 GLN 17 1HB GLN 17 105.737 15.922 -5.777 99 HB3 GLN 17 2HB GLN 17 106.995 15.082 -6.678 100 HG2 GLN 17 1HG GLN 17 108.031 15.824 -4.666 101 HG3 GLN 17 2HG GLN 17 108.585 16.933 -5.917 102 HE21 GLN 17 1HE2 GLN 17 108.408 19.101 -5.347 103 HE22 GLN 17 2HE2 GLN 17 107.297 19.724 -4.224 104 H MET 18 H MET 18 108.431 18.626 -7.343 105 HA MET 18 HA MET 18 109.565 17.888 -9.925 106 HB2 MET 18 1HB MET 18 110.326 20.004 -7.903 107 HB3 MET 18 2HB MET 18 111.148 19.762 -9.445 108 HG2 MET 18 1HG MET 18 108.976 20.101 -10.620 109 HG3 MET 18 2HG MET 18 108.218 20.444 -9.066 110 HE1 MET 18 3HE MET 18 108.287 22.923 -11.546 111 HE2 MET 18 1HE MET 18 108.006 23.881 -10.086 112 HE3 MET 18 2HE MET 18 107.341 22.255 -10.218 113 H ASN 19 H ASN 19 111.829 17.424 -10.179 114 HA ASN 19 HA ASN 19 113.843 16.455 -9.718 115 HB2 ASN 19 1HB ASN 19 113.846 18.007 -7.729 116 HB3 ASN 19 2HB ASN 19 113.187 16.675 -6.781 117 HD21 ASN 19 1HD2 ASN 19 115.968 17.430 -8.946 118 HD22 ASN 19 2HD2 ASN 19 117.053 16.398 -8.147 119 H LYS 20 H LYS 20 114.596 14.421 -9.592 120 HA LYS 20 HA LYS 20 112.674 12.304 -8.975 121 HB2 LYS 20 1HB LYS 20 115.465 12.111 -10.140 122 HB3 LYS 20 2HB LYS 20 114.265 10.822 -10.078 123 HG2 LYS 20 1HG LYS 20 113.904 13.445 -11.558 124 HG3 LYS 20 2HG LYS 20 114.368 11.919 -12.313 125 HD2 LYS 20 1HD LYS 20 112.257 10.904 -11.406 126 HD3 LYS 20 2HD LYS 20 111.775 12.511 -10.858 127 HE2 LYS 20 1HE LYS 20 110.742 12.214 -12.991 128 HE3 LYS 20 2HE LYS 20 112.113 13.290 -13.263 129 HZ1 LYS 20 3HZ LYS 20 113.387 11.540 -14.138 130 HZ2 LYS 20 1HZ LYS 20 111.863 11.389 -14.867 131 HZ3 LYS 20 2HZ LYS 20 112.300 10.354 -13.593 132 H MET 21 H MET 21 113.466 10.366 -7.745 133 HA MET 21 HA MET 21 115.302 11.192 -5.556 134 HB2 MET 21 1HB MET 21 112.741 9.591 -5.363 135 HB3 MET 21 2HB MET 21 113.878 9.835 -4.035 136 HG2 MET 21 1HG MET 21 113.590 12.318 -4.340 137 HG3 MET 21 2HG MET 21 112.313 11.973 -5.505 138 HE1 MET 21 3HE MET 21 111.005 9.241 -4.046 139 HE2 MET 21 1HE MET 21 110.388 10.517 -5.104 140 HE3 MET 21 2HE MET 21 109.603 10.191 -3.560 141 H GLY 22 H GLY 22 116.527 9.505 -4.577 142 HA2 GLY 22 1HA GLY 22 116.565 6.936 -6.051 143 HA3 GLY 22 2HA GLY 22 118.059 7.841 -5.826 144 H GLY 23 H GLY 23 116.950 5.152 -4.767 145 HA2 GLY 23 1HA GLY 23 117.946 5.515 -2.047 146 HA3 GLY 23 2HA GLY 23 116.269 5.010 -2.185 147 H PHE 24 H PHE 24 117.945 3.424 -0.839 148 HA PHE 24 HA PHE 24 118.419 1.129 -2.658 149 HB2 PHE 24 1HB PHE 24 119.985 1.902 -0.191 150 HB3 PHE 24 2HB PHE 24 120.217 0.430 -1.115 151 HD1 PHE 24 HD1 PHE 24 121.149 0.534 -3.422 152 HD2 PHE 24 HD2 PHE 24 120.853 4.014 -0.921 153 HE1 PHE 24 HE1 PHE 24 122.744 1.731 -4.897 154 HE2 PHE 24 HE2 PHE 24 122.448 5.211 -2.397 155 HZ PHE 24 HZ PHE 24 123.393 4.069 -4.385 156 H ASN 25 H ASN 25 118.000 -0.967 -1.727 157 HA ASN 25 HA ASN 25 116.325 -0.915 0.713 158 HB2 ASN 25 1HB ASN 25 115.635 -2.332 -1.872 159 HB3 ASN 25 2HB ASN 25 114.701 -2.384 -0.379 160 HD21 ASN 25 1HD2 ASN 25 113.681 -1.365 -2.918 161 HD22 ASN 25 2HD2 ASN 25 113.342 0.283 -2.694 162 H LEU 26 H LEU 26 116.538 -2.653 2.038 163 HA LEU 26 HA LEU 26 118.148 -4.953 1.084 164 HB2 LEU 26 1HB LEU 26 118.201 -3.462 3.702 165 HB3 LEU 26 2HB LEU 26 118.633 -5.165 3.656 166 HG LEU 26 HG LEU 26 120.605 -3.679 3.498 167 HD11 LEU 26 1HD1 LEU 26 120.330 -4.997 0.817 168 HD12 LEU 26 2HD1 LEU 26 120.323 -5.974 2.285 169 HD13 LEU 26 3HD1 LEU 26 121.716 -4.962 1.906 170 HD21 LEU 26 3HD2 LEU 26 119.140 -1.999 2.025 171 HD22 LEU 26 1HD2 LEU 26 119.894 -2.895 0.705 172 HD23 LEU 26 2HD2 LEU 26 120.895 -2.063 1.891 173 H LYS 27 H LYS 27 117.268 -6.977 1.501 174 HA LYS 27 HA LYS 27 114.590 -6.960 2.787 175 HB2 LYS 27 1HB LYS 27 115.504 -8.488 0.344 176 HB3 LYS 27 2HB LYS 27 113.934 -8.671 1.127 177 HG2 LYS 27 1HG LYS 27 113.510 -6.241 0.756 178 HG3 LYS 27 2HG LYS 27 115.029 -6.141 -0.134 179 HD2 LYS 27 1HD LYS 27 114.180 -7.899 -1.695 180 HD3 LYS 27 2HD LYS 27 112.630 -7.848 -0.854 181 HE2 LYS 27 1HE LYS 27 113.873 -5.340 -1.977 182 HE3 LYS 27 2HE LYS 27 112.882 -6.398 -2.983 183 HZ1 LYS 27 3HZ LYS 27 112.070 -4.530 -1.008 184 HZ2 LYS 27 1HZ LYS 27 111.487 -6.079 -0.632 185 HZ3 LYS 27 2HZ LYS 27 111.126 -5.379 -2.137 186 H TYR 28 H TYR 28 114.085 -8.553 4.153 187 HA TYR 28 HA TYR 28 115.938 -10.846 4.430 188 HB2 TYR 28 1HB TYR 28 114.509 -9.380 6.654 189 HB3 TYR 28 2HB TYR 28 115.502 -10.811 6.846 190 HD1 TYR 28 HD1 TYR 28 117.977 -10.671 6.353 191 HD2 TYR 28 HD2 TYR 28 115.449 -7.204 6.552 192 HE1 TYR 28 HE1 TYR 28 119.976 -9.228 6.626 193 HE2 TYR 28 HE2 TYR 28 117.448 -5.762 6.826 194 HH TYR 28 HH TYR 28 120.548 -7.031 7.513 195 H ARG 29 H ARG 29 114.963 -12.849 4.621 196 HA ARG 29 HA ARG 29 112.041 -12.929 4.933 197 HB2 ARG 29 1HB ARG 29 111.825 -14.499 3.056 198 HB3 ARG 29 2HB ARG 29 112.459 -12.943 2.519 199 HG2 ARG 29 1HG ARG 29 114.770 -13.887 2.674 200 HG3 ARG 29 2HG ARG 29 114.062 -15.460 3.048 201 HD2 ARG 29 1HD ARG 29 113.590 -13.854 0.521 202 HD3 ARG 29 2HD ARG 29 114.566 -15.314 0.652 203 HE ARG 29 HE ARG 29 111.941 -15.814 1.607 204 HH11 ARG 29 1HH1 ARG 29 113.667 -15.314 -1.409 205 HH12 ARG 29 2HH1 ARG 29 112.526 -16.233 -2.330 206 HH21 ARG 29 1HH2 ARG 29 110.505 -16.987 0.367 207 HH22 ARG 29 2HH2 ARG 29 110.758 -17.168 -1.337 208 H TYR 30 H TYR 30 111.216 -14.707 5.936 209 HA TYR 30 HA TYR 30 113.187 -16.688 6.931 210 HB2 TYR 30 1HB TYR 30 110.862 -15.490 8.439 211 HB3 TYR 30 2HB TYR 30 111.944 -16.731 9.041 212 HD1 TYR 30 HD1 TYR 30 114.372 -16.170 9.432 213 HD2 TYR 30 HD2 TYR 30 111.424 -13.183 8.518 214 HE1 TYR 30 HE1 TYR 30 115.894 -14.407 10.285 215 HE2 TYR 30 HE2 TYR 30 112.945 -11.420 9.372 216 HH TYR 30 HH TYR 30 116.107 -11.750 9.754 217 H GLU 31 H GLU 31 112.544 -18.808 7.003 218 HA GLU 31 HA GLU 31 109.834 -19.424 5.963 219 HB2 GLU 31 1HB GLU 31 111.685 -19.850 4.330 220 HB3 GLU 31 2HB GLU 31 112.361 -21.013 5.470 221 HG2 GLU 31 1HG GLU 31 110.208 -22.262 5.425 222 HG3 GLU 31 2HG GLU 31 109.603 -21.135 4.219 223 H GLU 32 H GLU 32 108.743 -21.153 6.874 224 HA GLU 32 HA GLU 32 109.788 -22.089 9.454 225 HB2 GLU 32 1HB GLU 32 107.494 -21.115 9.333 226 HB3 GLU 32 2HB GLU 32 107.028 -22.441 8.269 227 HG2 GLU 32 1HG GLU 32 106.373 -23.070 10.493 228 HG3 GLU 32 2HG GLU 32 107.780 -24.040 10.071 229 H ASP 33 H ASP 33 110.114 -24.241 9.927 230 HA ASP 33 HA ASP 33 110.985 -25.829 7.747 231 HB2 ASP 33 1HB ASP 33 110.602 -26.515 10.663 232 HB3 ASP 33 2HB ASP 33 111.415 -27.549 9.492 233 H ASN 34 H ASN 34 108.124 -26.130 9.883 234 HA ASN 34 HA ASN 34 107.307 -28.499 8.315 235 HB2 ASN 34 1HB ASN 34 106.318 -27.518 10.994 236 HB3 ASN 34 2HB ASN 34 105.834 -29.012 10.193 237 HD21 ASN 34 1HD2 ASN 34 108.305 -29.960 9.235 238 HD22 ASN 34 2HD2 ASN 34 109.332 -30.280 10.548 239 H SER 35 H SER 35 106.453 -25.188 8.726 240 HA SER 35 HA SER 35 104.181 -25.620 6.938 241 HB2 SER 35 1HB SER 35 103.815 -23.873 9.369 242 HB3 SER 35 2HB SER 35 102.590 -24.476 8.258 243 HG SER 35 HG SER 35 102.588 -25.714 10.143 244 HA PRO 36 HA PRO 36 107.197 -22.182 6.191 245 HB2 PRO 36 1HB PRO 36 107.369 -22.401 3.454 246 HB3 PRO 36 2HB PRO 36 108.364 -23.328 4.590 247 HG2 PRO 36 1HG PRO 36 105.939 -24.160 3.092 248 HG3 PRO 36 2HG PRO 36 107.406 -25.078 3.473 249 HD2 PRO 36 1HD PRO 36 105.070 -25.402 4.846 250 HD3 PRO 36 2HD PRO 36 106.667 -25.657 5.583 251 H LEU 37 H LEU 37 106.646 -20.154 6.025 252 HA LEU 37 HA LEU 37 104.551 -19.306 4.120 253 HB2 LEU 37 1HB LEU 37 103.797 -19.100 6.499 254 HB3 LEU 37 2HB LEU 37 105.172 -18.039 6.805 255 HG LEU 37 HG LEU 37 104.313 -16.594 4.883 256 HD11 LEU 37 1HD1 LEU 37 101.970 -18.467 5.278 257 HD12 LEU 37 2HD1 LEU 37 102.820 -18.103 3.777 258 HD13 LEU 37 3HD1 LEU 37 101.798 -16.879 4.532 259 HD21 LEU 37 3HD2 LEU 37 102.495 -16.919 7.293 260 HD22 LEU 37 1HD2 LEU 37 102.681 -15.464 6.315 261 HD23 LEU 37 2HD2 LEU 37 104.025 -16.040 7.300 262 H GLY 38 H GLY 38 105.176 -17.547 2.776 263 HA2 GLY 38 1HA GLY 38 108.056 -16.968 2.935 264 HA3 GLY 38 2HA GLY 38 107.014 -16.680 1.540 265 H VAL 39 H VAL 39 108.637 -15.170 4.000 266 HA VAL 39 HA VAL 39 106.792 -12.841 3.942 267 HB VAL 39 HB VAL 39 108.660 -13.656 6.187 268 HG11 VAL 39 1HG1 VAL 39 107.534 -11.856 7.422 269 HG12 VAL 39 2HG1 VAL 39 106.537 -11.495 6.012 270 HG13 VAL 39 3HG1 VAL 39 108.277 -11.215 5.956 271 HG21 VAL 39 3HG2 VAL 39 106.784 -15.203 6.085 272 HG22 VAL 39 1HG2 VAL 39 105.647 -13.867 5.902 273 HG23 VAL 39 2HG2 VAL 39 106.515 -14.083 7.420 274 H ILE 40 H ILE 40 107.635 -11.054 3.102 275 HA ILE 40 HA ILE 40 110.593 -10.755 3.099 276 HB ILE 40 HB ILE 40 108.655 -9.740 0.999 277 HG12 ILE 40 1HG1 ILE 40 110.729 -11.948 0.821 278 HG13 ILE 40 2HG1 ILE 40 108.995 -12.225 0.975 279 HG21 ILE 40 1HG2 ILE 40 110.664 -9.060 -0.196 280 HG22 ILE 40 2HG2 ILE 40 111.688 -9.763 1.057 281 HG23 ILE 40 3HG2 ILE 40 110.700 -8.347 1.416 282 HD11 ILE 40 3HD1 ILE 40 110.547 -11.162 -1.354 283 HD12 ILE 40 1HD1 ILE 40 108.894 -10.594 -1.123 284 HD13 ILE 40 2HD1 ILE 40 109.214 -12.316 -1.329 285 H GLY 41 H GLY 41 111.284 -9.031 4.168 286 HA2 GLY 41 1HA GLY 41 109.478 -6.688 4.421 287 HA3 GLY 41 2HA GLY 41 110.491 -7.244 5.757 288 H SER 42 H SER 42 110.370 -4.815 3.719 289 HA SER 42 HA SER 42 113.287 -4.777 3.199 290 HB2 SER 42 1HB SER 42 112.951 -3.812 1.071 291 HB3 SER 42 2HB SER 42 111.782 -5.124 1.157 292 HG SER 42 HG SER 42 111.377 -2.341 1.490 293 H PHE 43 H PHE 43 114.359 -3.005 3.812 294 HA PHE 43 HA PHE 43 112.792 -0.698 4.808 295 HB2 PHE 43 1HB PHE 43 115.654 -1.516 5.350 296 HB3 PHE 43 2HB PHE 43 114.880 -0.076 5.984 297 HD1 PHE 43 HD2 PHE 43 113.205 -0.226 7.763 298 HD2 PHE 43 HD1 PHE 43 115.116 -3.737 6.192 299 HE1 PHE 43 HE2 PHE 43 112.386 -1.539 9.701 300 HE2 PHE 43 HE1 PHE 43 114.296 -5.050 8.130 301 HZ PHE 43 HZ PHE 43 112.931 -3.951 9.884 302 H THR 44 H THR 44 112.819 1.116 3.600 303 HA THR 44 HA THR 44 114.828 1.270 1.415 304 HB THR 44 HB THR 44 113.170 2.469 0.118 305 HG1 THR 44 HG1 THR 44 111.535 3.362 1.053 306 HG21 THR 44 3HG2 THR 44 111.919 0.641 -0.486 307 HG22 THR 44 1HG2 THR 44 111.473 0.264 1.176 308 HG23 THR 44 2HG2 THR 44 113.065 -0.185 0.567 309 H TYR 45 H TYR 45 116.088 3.002 1.305 310 HA TYR 45 HA TYR 45 115.342 5.421 2.849 311 HB2 TYR 45 1HB TYR 45 117.166 4.227 3.979 312 HB3 TYR 45 2HB TYR 45 118.091 4.212 2.490 313 HD1 TYR 45 HD1 TYR 45 116.671 6.399 5.129 314 HD2 TYR 45 HD2 TYR 45 119.406 6.093 1.834 315 HE1 TYR 45 HE1 TYR 45 117.660 8.588 5.749 316 HE2 TYR 45 HE2 TYR 45 120.396 8.281 2.451 317 HH TYR 45 HH TYR 45 120.596 9.686 4.530 318 H THR 46 H THR 46 115.072 7.108 1.519 319 HA THR 46 HA THR 46 116.670 7.207 -0.977 320 HB THR 46 HB THR 46 114.814 7.979 -2.240 321 HG1 THR 46 HG1 THR 46 113.613 9.246 -1.075 322 HG21 THR 46 3HG2 THR 46 114.019 5.899 -2.498 323 HG22 THR 46 1HG2 THR 46 113.023 6.101 -1.061 324 HG23 THR 46 2HG2 THR 46 114.647 5.434 -0.919 325 H GLU 47 H GLU 47 117.099 9.284 -1.788 326 HA GLU 47 HA GLU 47 116.647 11.526 0.083 327 HB2 GLU 47 1HB GLU 47 119.224 10.864 -1.365 328 HB3 GLU 47 2HB GLU 47 118.933 12.328 -0.426 329 HG2 GLU 47 1HG GLU 47 118.473 10.919 1.573 330 HG3 GLU 47 2HG GLU 47 118.866 9.488 0.629 331 H LYS 48 H LYS 48 116.643 13.601 -0.904 332 HA LYS 48 HA LYS 48 115.827 13.531 -3.732 333 HB2 LYS 48 1HB LYS 48 114.249 14.470 -2.034 334 HB3 LYS 48 2HB LYS 48 115.436 15.725 -1.684 335 HG2 LYS 48 1HG LYS 48 115.371 16.415 -4.075 336 HG3 LYS 48 2HG LYS 48 114.110 15.214 -4.362 337 HD2 LYS 48 1HD LYS 48 112.721 16.332 -2.600 338 HD3 LYS 48 2HD LYS 48 113.949 17.596 -2.495 339 HE2 LYS 48 1HE LYS 48 113.638 17.867 -5.037 340 HE3 LYS 48 2HE LYS 48 112.168 16.912 -4.835 341 HZ1 LYS 48 3HZ LYS 48 111.597 19.200 -4.665 342 HZ2 LYS 48 1HZ LYS 48 112.822 19.495 -3.530 343 HZ3 LYS 48 2HZ LYS 48 111.487 18.534 -3.107 344 H SER 49 H SER 49 116.897 14.685 -5.276 345 HA SER 49 HA SER 49 119.459 15.870 -4.484 346 HB2 SER 49 1HB SER 49 119.435 14.222 -6.327 347 HB3 SER 49 2HB SER 49 118.349 15.266 -7.235 348 HG SER 49 HG SER 49 120.948 15.946 -6.297 349 H ARG 50 H ARG 50 119.992 17.990 -4.806 350 HA ARG 50 HA ARG 50 117.989 19.771 -6.007 351 HB2 ARG 50 1HB ARG 50 118.046 21.281 -4.098 352 HB3 ARG 50 2HB ARG 50 117.514 19.682 -3.585 353 HG2 ARG 50 1HG ARG 50 119.894 19.198 -2.900 354 HG3 ARG 50 2HG ARG 50 120.270 20.889 -3.230 355 HD2 ARG 50 1HD ARG 50 118.481 21.553 -1.616 356 HD3 ARG 50 2HD ARG 50 118.250 19.852 -1.225 357 HE ARG 50 HE ARG 50 120.327 21.548 -0.251 358 HH11 ARG 50 1HH1 ARG 50 119.727 18.226 -1.220 359 HH12 ARG 50 2HH1 ARG 50 120.999 17.602 -0.224 360 HH21 ARG 50 1HH2 ARG 50 121.948 20.684 1.012 361 HH22 ARG 50 2HH2 ARG 50 122.240 18.977 1.024 362 H THR 51 H THR 51 118.801 21.873 -6.560 363 HA THR 51 HA THR 51 121.734 21.898 -6.972 364 HB THR 51 HB THR 51 119.603 23.402 -8.510 365 HG1 THR 51 HG1 THR 51 121.113 21.153 -9.321 366 HG21 THR 51 3HG2 THR 51 121.637 23.461 -10.148 367 HG22 THR 51 1HG2 THR 51 122.591 23.133 -8.702 368 HG23 THR 51 2HG2 THR 51 121.600 24.590 -8.793 369 H ALA 52 H ALA 52 122.914 23.679 -6.369 370 HA ALA 52 HA ALA 52 121.552 25.510 -4.521 371 HB1 ALA 52 1HB ALA 52 123.580 24.253 -3.773 372 HB2 ALA 52 2HB ALA 52 123.753 26.004 -3.653 373 HB3 ALA 52 3HB ALA 52 124.518 25.131 -4.981 374 H SER 53 H SER 53 121.463 27.677 -4.799 375 HA SER 53 HA SER 53 123.092 29.132 -6.635 376 HB2 SER 53 1HB SER 53 121.764 28.184 -8.378 377 HB3 SER 53 2HB SER 53 120.277 28.425 -7.467 378 HG SER 53 HG SER 53 120.289 30.496 -7.990 379 H SER 54 H SER 54 119.744 29.205 -5.398 380 HA SER 54 HA SER 54 119.707 31.962 -4.806 381 HB2 SER 54 1HB SER 54 117.695 31.487 -3.549 382 HB3 SER 54 2HB SER 54 117.697 30.509 -5.013 383 HG SER 54 HG SER 54 117.212 29.140 -3.354 384 H GLY 55 H GLY 55 120.992 29.247 -3.008 385 HA2 GLY 55 1HA GLY 55 122.612 29.586 -1.273 386 HA3 GLY 55 2HA GLY 55 121.824 31.103 -0.876 387 H ASP 56 H ASP 56 119.238 29.167 -1.238 388 HA ASP 56 HA ASP 56 119.066 28.575 1.610 389 HB2 ASP 56 1HB ASP 56 117.142 29.558 0.369 390 HB3 ASP 56 2HB ASP 56 117.046 28.083 -0.592 391 H TYR 57 H TYR 57 119.753 26.694 2.404 392 HA TYR 57 HA TYR 57 119.852 24.338 0.605 393 HB2 TYR 57 1HB TYR 57 121.526 24.966 3.039 394 HB3 TYR 57 2HB TYR 57 121.652 23.519 2.057 395 HD1 TYR 57 HD1 TYR 57 122.344 27.122 2.258 396 HD2 TYR 57 HD2 TYR 57 122.667 23.593 -0.169 397 HE1 TYR 57 HE1 TYR 57 123.961 28.286 0.780 398 HE2 TYR 57 HE2 TYR 57 124.284 24.757 -1.646 399 HH TYR 57 HH TYR 57 125.877 27.514 -0.814 400 H ASN 58 H ASN 58 118.794 22.538 1.173 401 HA ASN 58 HA ASN 58 117.925 22.173 3.950 402 HB2 ASN 58 1HB ASN 58 115.636 21.652 3.269 403 HB3 ASN 58 2HB ASN 58 116.053 23.300 2.807 404 HD21 ASN 58 1HD2 ASN 58 113.957 21.822 1.498 405 HD22 ASN 58 2HD2 ASN 58 114.437 21.543 -0.107 406 H LYS 59 H LYS 59 117.163 19.954 4.363 407 HA LYS 59 HA LYS 59 118.154 17.985 2.388 408 HB2 LYS 59 1HB LYS 59 119.797 18.320 4.247 409 HB3 LYS 59 2HB LYS 59 118.553 17.796 5.382 410 HG2 LYS 59 1HG LYS 59 118.359 15.650 4.143 411 HG3 LYS 59 2HG LYS 59 119.668 16.168 3.080 412 HD2 LYS 59 1HD LYS 59 121.126 16.426 5.111 413 HD3 LYS 59 2HD LYS 59 119.831 15.706 6.069 414 HE2 LYS 59 1HE LYS 59 121.138 13.837 5.561 415 HE3 LYS 59 2HE LYS 59 119.931 13.796 4.275 416 HZ1 LYS 59 3HZ LYS 59 121.448 14.281 2.726 417 HZ2 LYS 59 1HZ LYS 59 122.586 13.774 3.877 418 HZ3 LYS 59 2HZ LYS 59 122.239 15.427 3.698 419 H ASN 60 H ASN 60 116.664 16.535 1.874 420 HA ASN 60 HA ASN 60 114.392 16.095 3.727 421 HB2 ASN 60 1HB ASN 60 113.910 17.169 1.476 422 HB3 ASN 60 2HB ASN 60 114.392 15.641 0.741 423 HD21 ASN 60 1HD2 ASN 60 112.141 15.341 -0.027 424 HD22 ASN 60 2HD2 ASN 60 110.931 14.848 1.056 425 H GLN 61 H GLN 61 114.033 14.076 4.448 426 HA GLN 61 HA GLN 61 115.498 11.842 3.150 427 HB2 GLN 61 1HB GLN 61 115.032 12.322 6.104 428 HB3 GLN 61 2HB GLN 61 115.696 10.838 5.421 429 HG2 GLN 61 1HG GLN 61 117.588 12.066 4.490 430 HG3 GLN 61 2HG GLN 61 116.911 13.590 5.057 431 HE21 GLN 61 1HE2 GLN 61 119.514 12.579 5.872 432 HE22 GLN 61 2HE2 GLN 61 119.441 12.286 7.542 433 H TYR 62 H TYR 62 114.359 9.952 2.873 434 HA TYR 62 HA TYR 62 111.625 9.826 4.010 435 HB2 TYR 62 1HB TYR 62 111.566 10.483 1.633 436 HB3 TYR 62 2HB TYR 62 112.478 9.046 1.225 437 HD1 TYR 62 HD1 TYR 62 109.227 10.327 2.435 438 HD2 TYR 62 HD2 TYR 62 111.417 6.888 1.082 439 HE1 TYR 62 HE1 TYR 62 107.104 9.070 2.193 440 HE2 TYR 62 HE2 TYR 62 109.293 5.630 0.841 441 HH TYR 62 HH TYR 62 106.818 6.264 0.458 442 H TYR 63 H TYR 63 111.234 8.017 5.092 443 HA TYR 63 HA TYR 63 112.923 5.627 4.571 444 HB2 TYR 63 1HB TYR 63 111.669 6.376 7.214 445 HB3 TYR 63 2HB TYR 63 112.818 5.091 6.905 446 HD1 TYR 63 HD1 TYR 63 115.208 5.580 6.630 447 HD2 TYR 63 HD2 TYR 63 112.353 8.698 7.395 448 HE1 TYR 63 HE1 TYR 63 117.054 7.130 7.215 449 HE2 TYR 63 HE2 TYR 63 114.200 10.248 7.975 450 HH TYR 63 HH TYR 63 117.065 9.442 8.849 451 H GLY 64 H GLY 64 111.780 3.700 4.276 452 HA2 GLY 64 1HA GLY 64 108.872 3.756 4.852 453 HA3 GLY 64 2HA GLY 64 109.449 3.284 3.259 454 H ILE 65 H ILE 65 108.067 1.919 5.699 455 HA ILE 65 HA ILE 65 109.793 -0.492 5.692 456 HB ILE 65 HB ILE 65 108.526 -1.135 7.772 457 HG12 ILE 65 1HG1 ILE 65 106.755 0.684 7.383 458 HG13 ILE 65 2HG1 ILE 65 107.302 0.409 9.023 459 HG21 ILE 65 1HG2 ILE 65 110.810 -0.554 7.965 460 HG22 ILE 65 2HG2 ILE 65 109.972 0.331 9.240 461 HG23 ILE 65 3HG2 ILE 65 110.469 1.166 7.768 462 HD11 ILE 65 3HD1 ILE 65 108.041 2.533 9.220 463 HD12 ILE 65 1HD1 ILE 65 107.158 2.864 7.732 464 HD13 ILE 65 2HD1 ILE 65 108.876 2.485 7.671 465 H THR 66 H THR 66 108.909 -2.332 4.897 466 HA THR 66 HA THR 66 105.990 -2.461 4.573 467 HB THR 66 HB THR 66 106.912 -1.557 2.469 468 HG1 THR 66 HG1 THR 66 105.402 -2.664 1.580 469 HG21 THR 66 3HG2 THR 66 108.538 -2.617 1.203 470 HG22 THR 66 1HG2 THR 66 108.208 -4.197 1.912 471 HG23 THR 66 2HG2 THR 66 109.103 -2.987 2.831 472 H ALA 67 H ALA 67 105.175 -4.591 4.135 473 HA ALA 67 HA ALA 67 106.965 -6.858 4.367 474 HB1 ALA 67 1HB ALA 67 106.748 -6.490 6.704 475 HB2 ALA 67 2HB ALA 67 105.596 -7.770 6.328 476 HB3 ALA 67 3HB ALA 67 105.029 -6.117 6.560 477 H GLY 68 H GLY 68 105.953 -8.818 3.641 478 HA2 GLY 68 1HA GLY 68 103.088 -8.933 3.364 479 HA3 GLY 68 2HA GLY 68 103.893 -8.653 1.835 480 HA PRO 69 HA PRO 69 103.966 -13.289 2.990 481 HB2 PRO 69 1HB PRO 69 101.692 -14.255 1.890 482 HB3 PRO 69 2HB PRO 69 101.759 -13.648 3.558 483 HG2 PRO 69 1HG PRO 69 100.738 -12.318 1.102 484 HG3 PRO 69 2HG PRO 69 100.084 -12.306 2.750 485 HD2 PRO 69 1HD PRO 69 101.572 -10.248 1.697 486 HD3 PRO 69 2HD PRO 69 101.461 -10.601 3.434 487 H ALA 70 H ALA 70 104.238 -15.094 1.432 488 HA ALA 70 HA ALA 70 104.383 -14.211 -1.390 489 HB1 ALA 70 1HB ALA 70 106.547 -14.915 -1.643 490 HB2 ALA 70 2HB ALA 70 106.408 -16.158 -0.400 491 HB3 ALA 70 3HB ALA 70 106.620 -14.469 0.061 492 H TYR 71 H TYR 71 104.242 -15.978 -2.948 493 HA TYR 71 HA TYR 71 102.789 -18.321 -1.862 494 HB2 TYR 71 1HB TYR 71 102.221 -16.787 -4.403 495 HB3 TYR 71 2HB TYR 71 101.409 -18.258 -3.901 496 HD1 TYR 71 HD1 TYR 71 99.990 -18.234 -1.813 497 HD2 TYR 71 HD2 TYR 71 101.581 -14.655 -3.577 498 HE1 TYR 71 HE1 TYR 71 98.346 -16.878 -0.544 499 HE2 TYR 71 HE2 TYR 71 99.938 -13.299 -2.307 500 HH TYR 71 HH TYR 71 97.864 -14.745 0.142 501 H ARG 72 H ARG 72 103.559 -20.239 -2.481 502 HA ARG 72 HA ARG 72 105.590 -20.304 -4.635 503 HB2 ARG 72 1HB ARG 72 105.189 -22.102 -2.234 504 HB3 ARG 72 2HB ARG 72 106.375 -22.388 -3.510 505 HG2 ARG 72 1HG ARG 72 107.367 -20.148 -3.042 506 HG3 ARG 72 2HG ARG 72 106.241 -19.962 -1.697 507 HD2 ARG 72 1HD ARG 72 108.324 -22.144 -1.983 508 HD3 ARG 72 2HD ARG 72 108.402 -20.777 -0.876 509 HE ARG 72 HE ARG 72 106.959 -23.203 -0.471 510 HH11 ARG 72 1HH1 ARG 72 106.763 -19.756 0.168 511 HH12 ARG 72 2HH1 ARG 72 105.720 -19.968 1.535 512 HH21 ARG 72 1HH2 ARG 72 105.614 -23.411 1.296 513 HH22 ARG 72 2HH2 ARG 72 105.079 -22.011 2.164 514 H ILE 73 H ILE 73 105.243 -21.493 -6.375 515 HA ILE 73 HA ILE 73 102.932 -23.350 -6.419 516 HB ILE 73 HB ILE 73 103.980 -21.693 -8.730 517 HG12 ILE 73 1HG1 ILE 73 102.969 -20.204 -7.064 518 HG13 ILE 73 2HG1 ILE 73 101.924 -20.339 -8.473 519 HG21 ILE 73 1HG2 ILE 73 101.645 -23.563 -8.360 520 HG22 ILE 73 2HG2 ILE 73 102.897 -23.602 -9.601 521 HG23 ILE 73 3HG2 ILE 73 101.660 -22.345 -9.635 522 HD11 ILE 73 3HD1 ILE 73 100.541 -22.014 -7.276 523 HD12 ILE 73 1HD1 ILE 73 100.605 -20.483 -6.404 524 HD13 ILE 73 2HD1 ILE 73 101.580 -21.847 -5.862 525 H ASN 74 H ASN 74 103.188 -25.092 -8.096 526 HA ASN 74 HA ASN 74 105.421 -26.651 -7.743 527 HB2 ASN 74 1HB ASN 74 103.659 -26.513 -10.197 528 HB3 ASN 74 2HB ASN 74 104.750 -27.840 -9.804 529 HD21 ASN 74 1HD2 ASN 74 104.317 -28.136 -7.044 530 HD22 ASN 74 2HD2 ASN 74 102.700 -28.575 -6.770 531 H ASP 75 H ASP 75 104.972 -24.097 -10.143 532 HA ASP 75 HA ASP 75 107.466 -24.532 -11.484 533 HB2 ASP 75 1HB ASP 75 105.553 -23.252 -12.464 534 HB3 ASP 75 2HB ASP 75 105.853 -21.977 -11.283 535 H TRP 76 H TRP 76 109.454 -23.637 -11.080 536 HA TRP 76 HA TRP 76 110.241 -23.199 -8.468 537 HB2 TRP 76 1HB TRP 76 112.331 -22.374 -9.371 538 HB3 TRP 76 2HB TRP 76 111.769 -23.752 -10.297 539 HD1 TRP 76 HD1 TRP 76 112.596 -20.090 -10.559 540 HE1 TRP 76 HE1 TRP 76 112.427 -19.344 -13.021 541 HE3 TRP 76 HE3 TRP 76 110.426 -24.242 -12.590 542 HZ2 TRP 76 HZ2 TRP 76 111.493 -20.374 -15.525 543 HZ3 TRP 76 HZ3 TRP 76 109.908 -24.334 -15.010 544 HH2 TRP 76 HH2 TRP 76 110.437 -22.409 -16.479 545 H ALA 77 H ALA 77 109.034 -20.845 -10.791 546 HA ALA 77 HA ALA 77 109.957 -18.502 -9.532 547 HB1 ALA 77 1HB ALA 77 107.575 -19.043 -11.304 548 HB2 ALA 77 2HB ALA 77 109.122 -18.325 -11.754 549 HB3 ALA 77 3HB ALA 77 107.995 -17.427 -10.737 550 H SER 78 H SER 78 109.175 -17.234 -7.942 551 HA SER 78 HA SER 78 106.697 -18.078 -6.556 552 HB2 SER 78 1HB SER 78 109.218 -16.950 -5.304 553 HB3 SER 78 2HB SER 78 107.734 -17.360 -4.449 554 HG SER 78 HG SER 78 109.206 -19.074 -4.337 555 H ILE 79 H ILE 79 105.460 -16.331 -5.592 556 HA ILE 79 HA ILE 79 106.092 -13.675 -6.776 557 HB ILE 79 HB ILE 79 103.336 -14.916 -6.516 558 HG12 ILE 79 1HG1 ILE 79 104.936 -14.374 -9.034 559 HG13 ILE 79 2HG1 ILE 79 104.800 -15.964 -8.287 560 HG21 ILE 79 1HG2 ILE 79 102.674 -12.947 -7.894 561 HG22 ILE 79 2HG2 ILE 79 104.325 -12.339 -7.774 562 HG23 ILE 79 3HG2 ILE 79 103.330 -12.478 -6.325 563 HD11 ILE 79 3HD1 ILE 79 103.143 -15.678 -10.104 564 HD12 ILE 79 1HD1 ILE 79 102.469 -14.285 -9.259 565 HD13 ILE 79 2HD1 ILE 79 102.355 -15.892 -8.540 566 H TYR 80 H TYR 80 105.479 -11.870 -5.477 567 HA TYR 80 HA TYR 80 104.121 -12.453 -2.948 568 HB2 TYR 80 1HB TYR 80 105.797 -11.462 -1.572 569 HB3 TYR 80 2HB TYR 80 106.550 -12.719 -2.530 570 HD1 TYR 80 HD1 TYR 80 106.297 -9.107 -1.919 571 HD2 TYR 80 HD2 TYR 80 108.171 -12.165 -4.281 572 HE1 TYR 80 HE1 TYR 80 107.991 -7.469 -2.692 573 HE2 TYR 80 HE2 TYR 80 109.865 -10.526 -5.056 574 HH TYR 80 HH TYR 80 110.347 -8.302 -5.181 575 H GLY 81 H GLY 81 103.356 -10.577 -1.835 576 HA2 GLY 81 1HA GLY 81 103.461 -8.045 -3.358 577 HA3 GLY 81 2HA GLY 81 101.889 -8.692 -2.881 578 H VAL 82 H VAL 82 103.236 -6.169 -2.001 579 HA VAL 82 HA VAL 82 103.334 -6.711 0.892 580 HB VAL 82 HB VAL 82 105.391 -5.356 1.104 581 HG11 VAL 82 1HG1 VAL 82 106.938 -7.063 0.106 582 HG12 VAL 82 2HG1 VAL 82 105.549 -7.778 -0.710 583 HG13 VAL 82 3HG1 VAL 82 105.628 -7.769 1.051 584 HG21 VAL 82 3HG2 VAL 82 106.680 -4.749 -0.852 585 HG22 VAL 82 1HG2 VAL 82 105.046 -4.123 -1.074 586 HG23 VAL 82 2HG2 VAL 82 105.551 -5.588 -1.915 587 H VAL 83 H VAL 83 103.076 -4.883 2.220 588 HA VAL 83 HA VAL 83 102.276 -2.371 0.881 589 HB VAL 83 HB VAL 83 100.897 -3.570 3.303 590 HG11 VAL 83 1HG1 VAL 83 100.745 -1.216 3.450 591 HG12 VAL 83 2HG1 VAL 83 99.240 -1.692 2.663 592 HG13 VAL 83 3HG1 VAL 83 100.566 -1.033 1.705 593 HG21 VAL 83 3HG2 VAL 83 98.938 -3.511 1.508 594 HG22 VAL 83 1HG2 VAL 83 100.037 -4.886 1.590 595 HG23 VAL 83 2HG2 VAL 83 100.278 -3.640 0.369 596 H GLY 84 H GLY 84 102.737 -0.463 2.183 597 HA2 GLY 84 1HA GLY 84 104.063 -0.807 4.738 598 HA3 GLY 84 2HA GLY 84 105.146 -0.350 3.431 599 H VAL 85 H VAL 85 105.242 1.390 5.266 600 HA VAL 85 HA VAL 85 103.576 3.648 4.377 601 HB VAL 85 HB VAL 85 102.553 2.784 6.449 602 HG11 VAL 85 1HG1 VAL 85 104.892 1.915 7.253 603 HG12 VAL 85 2HG1 VAL 85 103.722 2.477 8.448 604 HG13 VAL 85 3HG1 VAL 85 105.049 3.528 7.951 605 HG21 VAL 85 3HG2 VAL 85 102.675 4.890 7.756 606 HG22 VAL 85 1HG2 VAL 85 102.510 5.203 6.028 607 HG23 VAL 85 2HG2 VAL 85 104.081 5.382 6.810 608 H GLY 86 H GLY 86 104.660 5.646 4.440 609 HA2 GLY 86 1HA GLY 86 107.522 5.516 5.190 610 HA3 GLY 86 2HA GLY 86 107.029 6.124 3.617 611 H TYR 87 H TYR 87 108.501 7.455 5.730 612 HA TYR 87 HA TYR 87 106.680 9.734 6.250 613 HB2 TYR 87 1HB TYR 87 109.017 8.880 7.963 614 HB3 TYR 87 2HB TYR 87 107.865 10.157 8.306 615 HD1 TYR 87 HD1 TYR 87 105.517 9.586 8.932 616 HD2 TYR 87 HD2 TYR 87 108.543 6.581 8.424 617 HE1 TYR 87 HE1 TYR 87 104.103 7.956 10.151 618 HE2 TYR 87 HE2 TYR 87 107.128 4.950 9.643 619 HH TYR 87 HH TYR 87 104.704 5.706 11.576 620 H GLY 88 H GLY 88 107.394 11.670 5.542 621 HA2 GLY 88 1HA GLY 88 110.212 11.887 4.634 622 HA3 GLY 88 2HA GLY 88 108.863 12.599 3.754 623 H LYS 89 H LYS 89 111.354 13.573 5.399 624 HA LYS 89 HA LYS 89 109.922 15.826 6.652 625 HB2 LYS 89 1HB LYS 89 110.535 14.176 8.423 626 HB3 LYS 89 2HB LYS 89 112.227 14.365 7.963 627 HG2 LYS 89 1HG LYS 89 112.051 16.804 8.426 628 HG3 LYS 89 2HG LYS 89 110.392 16.558 8.974 629 HD2 LYS 89 1HD LYS 89 111.259 14.927 10.672 630 HD3 LYS 89 2HD LYS 89 112.899 15.366 10.192 631 HE2 LYS 89 1HE LYS 89 112.554 16.811 11.987 632 HE3 LYS 89 2HE LYS 89 112.061 17.823 10.629 633 HZ1 LYS 89 3HZ LYS 89 110.067 16.106 11.932 634 HZ2 LYS 89 1HZ LYS 89 109.854 17.585 11.129 635 HZ3 LYS 89 2HZ LYS 89 110.525 17.555 12.690 636 H PHE 90 H PHE 90 110.873 17.779 6.320 637 HA PHE 90 HA PHE 90 113.633 17.850 5.292 638 HB2 PHE 90 1HB PHE 90 113.004 19.363 3.505 639 HB3 PHE 90 2HB PHE 90 112.130 17.850 3.349 640 HD1 PHE 90 HD1 PHE 90 109.706 17.742 3.924 641 HD2 PHE 90 HD2 PHE 90 111.885 21.444 3.900 642 HE1 PHE 90 HE1 PHE 90 107.569 19.000 3.875 643 HE2 PHE 90 HE2 PHE 90 109.748 22.702 3.852 644 HZ PHE 90 HZ PHE 90 107.590 21.480 3.840 645 H GLN 91 H GLN 91 114.657 19.925 5.504 646 HA GLN 91 HA GLN 91 113.520 21.508 7.715 647 HB2 GLN 91 1HB GLN 91 116.335 21.487 6.600 648 HB3 GLN 91 2HB GLN 91 115.791 22.343 8.040 649 HG2 GLN 91 1HG GLN 91 115.767 19.336 7.648 650 HG3 GLN 91 2HG GLN 91 116.898 20.235 8.653 651 HE21 GLN 91 1HE2 GLN 91 114.383 18.258 9.066 652 HE22 GLN 91 2HE2 GLN 91 113.618 18.974 10.402 653 H THR 92 H THR 92 112.686 23.450 7.329 654 HA THR 92 HA THR 92 113.685 25.056 5.098 655 HB THR 92 HB THR 92 111.815 23.766 4.158 656 HG1 THR 92 HG1 THR 92 110.640 25.581 3.461 657 HG21 THR 92 3HG2 THR 92 109.508 24.242 5.037 658 HG22 THR 92 1HG2 THR 92 110.256 25.027 6.427 659 HG23 THR 92 2HG2 THR 92 110.515 23.305 6.142 660 H THR 93 H THR 93 112.561 27.278 5.129 661 HA THR 93 HA THR 93 112.389 28.179 7.928 662 HB THR 93 HB THR 93 112.708 30.430 7.028 663 HG1 THR 93 HG1 THR 93 113.082 30.586 4.738 664 HG21 THR 93 3HG2 THR 93 114.969 30.205 6.427 665 HG22 THR 93 1HG2 THR 93 114.686 28.692 5.567 666 HG23 THR 93 2HG2 THR 93 114.647 28.726 7.330 667 H GLU 94 H GLU 94 110.643 29.634 8.549 668 HA GLU 94 HA GLU 94 108.276 29.898 7.010 669 HB2 GLU 94 1HB GLU 94 108.374 27.401 7.249 670 HB3 GLU 94 2HB GLU 94 108.216 27.615 8.991 671 HG2 GLU 94 1HG GLU 94 106.077 28.827 8.623 672 HG3 GLU 94 2HG GLU 94 106.228 28.534 6.896 673 H TYR 95 H TYR 95 106.664 31.004 8.090 674 HA TYR 95 HA TYR 95 107.359 32.232 10.615 675 HB2 TYR 95 1HB TYR 95 105.039 32.466 8.712 676 HB3 TYR 95 2HB TYR 95 104.976 33.199 10.304 677 HD1 TYR 95 HD1 TYR 95 106.793 34.892 10.928 678 HD2 TYR 95 HD2 TYR 95 106.135 33.516 6.913 679 HE1 TYR 95 HE1 TYR 95 108.022 36.860 10.052 680 HE2 TYR 95 HE2 TYR 95 107.364 35.484 6.037 681 HH TYR 95 HH TYR 95 108.347 37.412 6.548 682 HA PRO 96 HA PRO 96 106.040 29.248 13.249 683 HB2 PRO 96 1HB PRO 96 104.239 31.014 14.826 684 HB3 PRO 96 2HB PRO 96 105.679 30.115 15.340 685 HG2 PRO 96 1HG PRO 96 105.699 32.765 15.032 686 HG3 PRO 96 2HG PRO 96 107.115 31.761 14.676 687 HD2 PRO 96 1HD PRO 96 105.223 33.080 12.779 688 HD3 PRO 96 2HD PRO 96 106.962 32.749 12.601 689 H THR 97 H THR 97 104.666 27.623 13.260 690 HA THR 97 HA THR 97 101.938 28.036 12.201 691 HB THR 97 HB THR 97 103.730 25.632 11.786 692 HG1 THR 97 HG1 THR 97 103.011 27.699 9.986 693 HG21 THR 97 3HG2 THR 97 100.985 26.438 10.832 694 HG22 THR 97 1HG2 THR 97 101.484 24.925 11.588 695 HG23 THR 97 2HG2 THR 97 101.965 25.282 9.930 696 H TYR 98 H TYR 98 100.327 26.502 12.905 697 HA TYR 98 HA TYR 98 100.818 25.557 15.644 698 HB2 TYR 98 1HB TYR 98 98.250 25.774 14.063 699 HB3 TYR 98 2HB TYR 98 98.372 25.287 15.743 700 HD1 TYR 98 HD2 TYR 98 98.858 26.923 17.497 701 HD2 TYR 98 HD1 TYR 98 98.553 28.092 13.375 702 HE1 TYR 98 HE2 TYR 98 98.698 29.301 18.184 703 HE2 TYR 98 HE1 TYR 98 98.393 30.470 14.062 704 HH TYR 98 HH TYR 98 99.237 31.812 16.242 705 H LYS 99 H LYS 99 100.094 23.390 16.247 706 HA LYS 99 HA LYS 99 101.304 21.546 14.430 707 HB2 LYS 99 1HB LYS 99 99.876 21.050 17.050 708 HB3 LYS 99 2HB LYS 99 100.880 19.881 16.192 709 HG2 LYS 99 1HG LYS 99 102.770 21.565 16.315 710 HG3 LYS 99 2HG LYS 99 101.757 22.512 17.406 711 HD2 LYS 99 1HD LYS 99 102.545 19.621 17.869 712 HD3 LYS 99 2HD LYS 99 103.339 21.005 18.620 713 HE2 LYS 99 1HE LYS 99 100.415 20.256 18.920 714 HE3 LYS 99 2HE LYS 99 101.665 20.067 20.148 715 HZ1 LYS 99 3HZ LYS 99 100.418 22.522 19.128 716 HZ2 LYS 99 1HZ LYS 99 102.012 22.591 19.706 717 HZ3 LYS 99 2HZ LYS 99 100.760 22.068 20.729 718 H HIS 100 H HIS 100 100.455 20.033 13.159 719 HA HIS 100 HA HIS 100 97.763 19.078 13.353 720 HB2 HIS 100 1HB HIS 100 97.419 21.325 12.315 721 HB3 HIS 100 2HB HIS 100 98.439 20.822 10.980 722 HD1 HIS 100 HD1 HIS 100 97.414 19.250 9.228 723 HD2 HIS 100 HD2 HIS 100 94.834 20.083 12.393 724 HE1 HIS 100 HE1 HIS 100 95.136 18.388 8.539 725 H ASP 101 H ASP 101 100.318 19.664 10.929 726 HA ASP 101 HA ASP 101 100.800 16.796 10.732 727 HB2 ASP 101 1HB ASP 101 98.991 17.246 9.082 728 HB3 ASP 101 2HB ASP 101 100.045 18.414 8.286 729 H THR 102 H THR 102 102.798 17.511 11.685 730 HA THR 102 HA THR 102 104.484 19.422 10.399 731 HB THR 102 HB THR 102 104.687 18.939 12.790 732 HG1 THR 102 HG1 THR 102 106.954 18.178 11.266 733 HG21 THR 102 3HG2 THR 102 104.165 16.495 12.618 734 HG22 THR 102 1HG2 THR 102 105.601 16.832 13.581 735 HG23 THR 102 2HG2 THR 102 105.766 16.242 11.929 736 H SER 103 H SER 103 104.219 15.905 10.250 737 HA SER 103 HA SER 103 106.349 15.873 8.186 738 HB2 SER 103 1HB SER 103 105.458 13.714 10.109 739 HB3 SER 103 2HB SER 103 106.577 13.451 8.777 740 HG SER 103 HG SER 103 107.014 15.545 10.610 741 H ASP 104 H ASP 104 106.047 14.458 6.379 742 HA ASP 104 HA ASP 104 103.212 14.268 5.622 743 HB2 ASP 104 1HB ASP 104 105.742 14.041 3.975 744 HB3 ASP 104 2HB ASP 104 104.108 13.922 3.330 745 H TYR 105 H TYR 105 102.202 12.368 5.228 746 HA TYR 105 HA TYR 105 103.764 9.880 5.641 747 HB2 TYR 105 1HB TYR 105 100.848 10.378 6.252 748 HB3 TYR 105 2HB TYR 105 101.750 8.913 6.587 749 HD1 TYR 105 HD1 TYR 105 101.122 12.389 7.599 750 HD2 TYR 105 HD2 TYR 105 103.339 8.809 8.445 751 HE1 TYR 105 HE1 TYR 105 101.732 13.294 9.826 752 HE2 TYR 105 HE2 TYR 105 103.950 9.715 10.672 753 HH TYR 105 HH TYR 105 104.158 11.911 11.768 754 H GLY 106 H GLY 106 103.517 8.234 4.181 755 HA2 GLY 106 1HA GLY 106 101.408 8.493 2.129 756 HA3 GLY 106 2HA GLY 106 103.083 8.295 1.629 757 H PHE 107 H PHE 107 100.928 6.537 1.010 758 HA PHE 107 HA PHE 107 101.694 4.089 2.503 759 HB2 PHE 107 1HB PHE 107 99.166 4.683 0.961 760 HB3 PHE 107 2HB PHE 107 99.547 3.152 1.724 761 HD1 PHE 107 HD1 PHE 107 99.628 2.976 4.205 762 HD2 PHE 107 HD2 PHE 107 98.384 6.574 2.214 763 HE1 PHE 107 HE1 PHE 107 98.623 3.798 6.318 764 HE2 PHE 107 HE2 PHE 107 97.379 7.395 4.328 765 HZ PHE 107 HZ PHE 107 97.498 6.007 6.380 766 H SER 108 H SER 108 102.303 2.247 1.320 767 HA SER 108 HA SER 108 102.582 2.626 -1.608 768 HB2 SER 108 1HB SER 108 104.679 1.507 0.266 769 HB3 SER 108 2HB SER 108 104.804 1.591 -1.488 770 HG SER 108 HG SER 108 105.476 3.432 0.231 771 H TYR 109 H TYR 109 102.325 0.847 -2.865 772 HA TYR 109 HA TYR 109 102.000 -1.797 -1.612 773 HB2 TYR 109 1HB TYR 109 99.745 -0.810 -1.802 774 HB3 TYR 109 2HB TYR 109 100.016 -0.528 -3.510 775 HD1 TYR 109 HD1 TYR 109 100.244 -2.488 -5.068 776 HD2 TYR 109 HD2 TYR 109 99.058 -2.928 -0.964 777 HE1 TYR 109 HE1 TYR 109 99.358 -4.749 -5.567 778 HE2 TYR 109 HE2 TYR 109 98.177 -5.192 -1.461 779 HH TYR 109 HH TYR 109 98.913 -7.013 -3.641 780 H GLY 110 H GLY 110 102.677 -3.502 -2.977 781 HA2 GLY 110 1HA GLY 110 102.877 -3.178 -5.817 782 HA3 GLY 110 2HA GLY 110 104.451 -3.001 -5.053 783 H ALA 111 H ALA 111 104.457 -4.942 -6.726 784 HA ALA 111 HA ALA 111 104.462 -7.366 -5.073 785 HB1 ALA 111 1HB ALA 111 103.492 -7.595 -7.896 786 HB2 ALA 111 2HB ALA 111 102.354 -7.093 -6.645 787 HB3 ALA 111 3HB ALA 111 103.177 -8.647 -6.516 788 H GLY 112 H GLY 112 105.832 -9.080 -6.030 789 HA2 GLY 112 1HA GLY 112 107.757 -8.111 -8.026 790 HA3 GLY 112 2HA GLY 112 108.372 -8.535 -6.434 791 H LEU 113 H LEU 113 109.154 -9.754 -8.846 792 HA LEU 113 HA LEU 113 108.163 -12.518 -8.456 793 HB2 LEU 113 1HB LEU 113 109.222 -11.330 -11.034 794 HB3 LEU 113 2HB LEU 113 108.559 -12.945 -10.811 795 HG LEU 113 HG LEU 113 107.017 -10.358 -10.438 796 HD11 LEU 113 1HD1 LEU 113 107.427 -10.673 -12.781 797 HD12 LEU 113 2HD1 LEU 113 105.786 -11.244 -12.481 798 HD13 LEU 113 3HD1 LEU 113 107.102 -12.402 -12.670 799 HD21 LEU 113 3HD2 LEU 113 106.238 -13.282 -10.269 800 HD22 LEU 113 1HD2 LEU 113 105.060 -11.978 -10.424 801 HD23 LEU 113 2HD2 LEU 113 106.101 -12.063 -9.003 802 H GLN 114 H GLN 114 109.711 -14.085 -8.206 803 HA GLN 114 HA GLN 114 112.537 -13.188 -8.214 804 HB2 GLN 114 1HB GLN 114 111.608 -13.855 -5.997 805 HB3 GLN 114 2HB GLN 114 111.298 -15.464 -6.650 806 HG2 GLN 114 1HG GLN 114 113.737 -15.627 -7.228 807 HG3 GLN 114 2HG GLN 114 113.991 -14.103 -6.379 808 HE21 GLN 114 1HE2 GLN 114 114.761 -14.476 -4.303 809 HE22 GLN 114 2HE2 GLN 114 114.294 -15.768 -3.306 810 H PHE 115 H PHE 115 113.942 -14.206 -9.533 811 HA PHE 115 HA PHE 115 113.042 -16.700 -10.870 812 HB2 PHE 115 1HB PHE 115 114.643 -14.417 -12.033 813 HB3 PHE 115 2HB PHE 115 114.311 -15.934 -12.848 814 HD1 PHE 115 HD2 PHE 115 112.078 -16.440 -13.709 815 HD2 PHE 115 HD1 PHE 115 112.913 -12.731 -11.711 816 HE1 PHE 115 HE2 PHE 115 109.950 -15.499 -14.566 817 HE2 PHE 115 HE1 PHE 115 110.786 -11.789 -12.569 818 HZ PHE 115 HZ PHE 115 109.303 -13.173 -13.996 819 H ASN 116 H ASN 116 114.459 -18.352 -10.943 820 HA ASN 116 HA ASN 116 117.270 -17.884 -10.245 821 HB2 ASN 116 1HB ASN 116 115.870 -18.479 -8.177 822 HB3 ASN 116 2HB ASN 116 115.704 -20.079 -8.898 823 HD21 ASN 116 1HD2 ASN 116 117.163 -21.420 -7.820 824 HD22 ASN 116 2HD2 ASN 116 118.782 -21.027 -7.501 825 HA PRO 117 HA PRO 117 116.708 -20.968 -13.623 826 HB2 PRO 117 1HB PRO 117 118.573 -20.035 -15.352 827 HB3 PRO 117 2HB PRO 117 116.951 -19.323 -15.232 828 HG2 PRO 117 1HG PRO 117 119.531 -18.336 -14.151 829 HG3 PRO 117 2HG PRO 117 118.164 -17.432 -14.827 830 HD2 PRO 117 1HD PRO 117 118.665 -17.732 -12.110 831 HD3 PRO 117 2HD PRO 117 117.090 -17.309 -12.811 832 H MET 118 H MET 118 117.654 -22.364 -11.891 833 HA MET 118 HA MET 118 119.232 -23.845 -11.109 834 HB2 MET 118 1HB MET 118 120.306 -23.523 -13.922 835 HB3 MET 118 2HB MET 118 120.642 -24.866 -12.833 836 HG2 MET 118 1HG MET 118 117.920 -24.105 -13.935 837 HG3 MET 118 2HG MET 118 118.891 -25.484 -14.440 838 HE1 MET 118 3HE MET 118 119.926 -26.634 -11.249 839 HE2 MET 118 1HE MET 118 119.876 -27.023 -12.973 840 HE3 MET 118 2HE MET 118 118.922 -27.962 -11.826 841 H GLU 119 H GLU 119 119.820 -21.017 -10.677 842 HA GLU 119 HA GLU 119 122.779 -21.153 -10.541 843 HB2 GLU 119 1HB GLU 119 121.844 -19.462 -12.185 844 HB3 GLU 119 2HB GLU 119 121.129 -18.629 -10.806 845 HG2 GLU 119 1HG GLU 119 123.395 -18.423 -9.795 846 HG3 GLU 119 2HG GLU 119 124.080 -19.187 -11.222 847 H ASN 120 H ASN 120 123.726 -20.218 -8.648 848 HA ASN 120 HA ASN 120 122.069 -20.505 -6.293 849 HB2 ASN 120 1HB ASN 120 124.974 -19.737 -6.600 850 HB3 ASN 120 2HB ASN 120 124.171 -20.068 -5.068 851 HD21 ASN 120 1HD2 ASN 120 126.403 -21.627 -6.137 852 HD22 ASN 120 2HD2 ASN 120 125.825 -23.201 -6.406 853 H VAL 121 H VAL 121 122.199 -17.969 -8.329 854 HA VAL 121 HA VAL 121 121.836 -16.016 -6.134 855 HB VAL 121 HB VAL 121 122.837 -15.441 -8.938 856 HG11 VAL 121 1HG1 VAL 121 123.328 -13.192 -7.886 857 HG12 VAL 121 2HG1 VAL 121 122.385 -13.715 -6.489 858 HG13 VAL 121 3HG1 VAL 121 121.612 -13.557 -8.066 859 HG21 VAL 121 3HG2 VAL 121 124.316 -15.384 -6.288 860 HG22 VAL 121 1HG2 VAL 121 124.991 -14.980 -7.865 861 HG23 VAL 121 2HG2 VAL 121 124.501 -16.637 -7.516 862 H ALA 122 H ALA 122 119.964 -14.827 -6.193 863 HA ALA 122 HA ALA 122 118.047 -15.522 -8.351 864 HB1 ALA 122 1HB ALA 122 117.209 -16.469 -6.351 865 HB2 ALA 122 2HB ALA 122 116.319 -14.958 -6.542 866 HB3 ALA 122 3HB ALA 122 117.657 -15.055 -5.397 867 H LEU 123 H LEU 123 116.776 -13.905 -9.212 868 HA LEU 123 HA LEU 123 117.648 -11.138 -8.596 869 HB2 LEU 123 1HB LEU 123 116.575 -12.317 -11.173 870 HB3 LEU 123 2HB LEU 123 116.928 -10.609 -10.917 871 HG LEU 123 HG LEU 123 119.289 -11.516 -10.167 872 HD11 LEU 123 1HD1 LEU 123 119.769 -13.511 -11.810 873 HD12 LEU 123 2HD1 LEU 123 118.035 -13.800 -11.667 874 HD13 LEU 123 3HD1 LEU 123 119.058 -13.840 -10.231 875 HD21 LEU 123 3HD2 LEU 123 120.100 -11.127 -12.397 876 HD22 LEU 123 1HD2 LEU 123 118.688 -10.092 -12.189 877 HD23 LEU 123 2HD2 LEU 123 118.554 -11.593 -13.106 878 H ASP 124 H ASP 124 116.088 -9.584 -8.209 879 HA ASP 124 HA ASP 124 113.275 -10.527 -8.147 880 HB2 ASP 124 1HB ASP 124 114.636 -8.738 -6.119 881 HB3 ASP 124 2HB ASP 124 112.957 -9.275 -6.082 882 H PHE 125 H PHE 125 111.943 -9.313 -9.282 883 HA PHE 125 HA PHE 125 112.628 -6.463 -9.753 884 HB2 PHE 125 1HB PHE 125 111.153 -8.368 -11.581 885 HB3 PHE 125 2HB PHE 125 111.389 -6.656 -11.879 886 HD1 PHE 125 HD1 PHE 125 113.662 -5.774 -12.380 887 HD2 PHE 125 HD2 PHE 125 112.890 -9.979 -11.963 888 HE1 PHE 125 HE1 PHE 125 115.820 -6.280 -13.492 889 HE2 PHE 125 HE2 PHE 125 115.048 -10.486 -13.075 890 HZ PHE 125 HZ PHE 125 116.513 -8.637 -13.839 891 H SER 126 H SER 126 111.070 -5.011 -9.157 892 HA SER 126 HA SER 126 108.385 -6.055 -8.499 893 HB2 SER 126 1HB SER 126 110.072 -4.310 -6.693 894 HB3 SER 126 2HB SER 126 108.404 -4.789 -6.396 895 HG SER 126 HG SER 126 110.246 -6.090 -5.463 896 H TYR 127 H TYR 127 106.707 -4.616 -8.676 897 HA TYR 127 HA TYR 127 107.342 -1.943 -9.783 898 HB2 TYR 127 1HB TYR 127 104.810 -3.577 -10.043 899 HB3 TYR 127 2HB TYR 127 105.089 -1.998 -10.751 900 HD1 TYR 127 HD1 TYR 127 105.846 -5.588 -10.942 901 HD2 TYR 127 HD2 TYR 127 106.539 -1.733 -12.704 902 HE1 TYR 127 HE1 TYR 127 106.776 -6.681 -12.965 903 HE2 TYR 127 HE2 TYR 127 107.469 -2.825 -14.727 904 HH TYR 127 HH TYR 127 107.558 -6.377 -15.021 905 H GLU 128 H GLU 128 107.014 -0.320 -8.382 906 HA GLU 128 HA GLU 128 105.107 -0.751 -6.148 907 HB2 GLU 128 1HB GLU 128 107.519 -0.722 -5.487 908 HB3 GLU 128 2HB GLU 128 107.621 0.929 -6.101 909 HG2 GLU 128 1HG GLU 128 105.782 1.583 -4.555 910 HG3 GLU 128 2HG GLU 128 105.782 -0.049 -3.900 911 H GLN 129 H GLN 129 103.561 0.706 -5.854 912 HA GLN 129 HA GLN 129 103.826 3.364 -7.135 913 HB2 GLN 129 1HB GLN 129 101.327 1.679 -6.802 914 HB3 GLN 129 2HB GLN 129 101.351 3.345 -7.381 915 HG2 GLN 129 1HG GLN 129 102.743 2.702 -9.283 916 HG3 GLN 129 2HG GLN 129 102.827 1.045 -8.690 917 HE21 GLN 129 1HE2 GLN 129 101.766 1.659 -11.280 918 HE22 GLN 129 2HE2 GLN 129 100.107 1.302 -11.273 919 H SER 130 H SER 130 103.465 5.082 -5.795 920 HA SER 130 HA SER 130 102.417 4.511 -3.084 921 HB2 SER 130 1HB SER 130 104.828 6.216 -3.754 922 HB3 SER 130 2HB SER 130 104.127 6.007 -2.153 923 HG SER 130 HG SER 130 105.103 3.912 -3.811 924 H ARG 131 H ARG 131 101.212 6.095 -2.152 925 HA ARG 131 HA ARG 131 100.670 8.522 -3.768 926 HB2 ARG 131 1HB ARG 131 98.813 6.982 -1.933 927 HB3 ARG 131 2HB ARG 131 98.418 8.511 -2.719 928 HG2 ARG 131 1HG ARG 131 98.795 7.461 -4.931 929 HG3 ARG 131 2HG ARG 131 99.140 5.927 -4.133 930 HD2 ARG 131 1HD ARG 131 96.833 5.871 -4.821 931 HD3 ARG 131 2HD ARG 131 96.858 6.059 -3.070 932 HE ARG 131 HE ARG 131 96.759 8.575 -4.465 933 HH11 ARG 131 1HH1 ARG 131 94.772 5.943 -3.263 934 HH12 ARG 131 2HH1 ARG 131 93.353 6.930 -3.156 935 HH21 ARG 131 1HH2 ARG 131 94.899 9.797 -4.306 936 HH22 ARG 131 2HH2 ARG 131 93.425 9.084 -3.740 937 H ILE 132 H ILE 132 101.228 10.369 -2.836 938 HA ILE 132 HA ILE 132 101.501 10.493 0.104 939 HB ILE 132 HB ILE 132 103.433 11.704 -1.903 940 HG12 ILE 132 1HG1 ILE 132 103.887 9.448 0.074 941 HG13 ILE 132 2HG1 ILE 132 103.614 9.207 -1.652 942 HG21 ILE 132 1HG2 ILE 132 104.711 12.343 0.087 943 HG22 ILE 132 2HG2 ILE 132 103.510 11.581 1.128 944 HG23 ILE 132 3HG2 ILE 132 103.083 13.010 0.188 945 HD11 ILE 132 3HD1 ILE 132 105.586 10.676 -2.119 946 HD12 ILE 132 1HD1 ILE 132 106.009 9.208 -1.238 947 HD13 ILE 132 2HD1 ILE 132 105.895 10.747 -0.384 948 H ARG 133 H ARG 133 99.707 11.710 0.441 949 HA ARG 133 HA ARG 133 97.821 12.845 -0.465 950 HB2 ARG 133 1HB ARG 133 99.823 14.844 0.581 951 HB3 ARG 133 2HB ARG 133 98.102 15.166 0.368 952 HG2 ARG 133 1HG ARG 133 97.567 13.291 1.890 953 HG3 ARG 133 2HG ARG 133 99.290 12.998 2.124 954 HD2 ARG 133 1HD ARG 133 98.533 14.334 3.980 955 HD3 ARG 133 2HD ARG 133 99.502 15.373 2.940 956 HE ARG 133 HE ARG 133 97.606 16.619 2.501 957 HH11 ARG 133 1HH1 ARG 133 96.593 13.547 3.867 958 HH12 ARG 133 2HH1 ARG 133 94.935 14.034 3.988 959 HH21 ARG 133 1HH2 ARG 133 95.457 17.189 2.682 960 HH22 ARG 133 2HH2 ARG 133 94.301 16.071 3.324 961 H SER 134 H SER 134 97.727 12.614 -2.722 962 HA SER 134 HA SER 134 97.063 13.657 -4.648 963 HB2 SER 134 1HB SER 134 96.912 15.954 -4.853 964 HB3 SER 134 2HB SER 134 96.869 15.735 -3.110 965 HG SER 134 HG SER 134 98.896 16.485 -2.962 966 H VAL 135 H VAL 135 100.315 13.372 -3.643 967 HA VAL 135 HA VAL 135 101.281 13.948 -6.370 968 HB VAL 135 HB VAL 135 102.862 13.365 -3.849 969 HG11 VAL 135 1HG1 VAL 135 104.781 14.101 -5.141 970 HG12 VAL 135 2HG1 VAL 135 103.752 14.503 -6.515 971 HG13 VAL 135 3HG1 VAL 135 103.968 12.819 -6.038 972 HG21 VAL 135 3HG2 VAL 135 102.386 16.007 -5.265 973 HG22 VAL 135 1HG2 VAL 135 103.312 15.758 -3.785 974 HG23 VAL 135 2HG2 VAL 135 101.566 15.513 -3.784 975 H ASP 136 H ASP 136 102.005 12.335 -7.678 976 HA ASP 136 HA ASP 136 101.582 9.577 -6.692 977 HB2 ASP 136 1HB ASP 136 101.593 10.686 -9.507 978 HB3 ASP 136 2HB ASP 136 101.377 8.988 -9.094 979 H VAL 137 H VAL 137 103.297 8.249 -6.475 980 HA VAL 137 HA VAL 137 105.825 9.005 -7.838 981 HB VAL 137 HB VAL 137 105.527 7.657 -5.140 982 HG11 VAL 137 1HG1 VAL 137 108.019 8.321 -5.075 983 HG12 VAL 137 2HG1 VAL 137 107.880 8.529 -6.821 984 HG13 VAL 137 3HG1 VAL 137 107.580 6.950 -6.093 985 HG21 VAL 137 3HG2 VAL 137 106.120 10.512 -5.948 986 HG22 VAL 137 1HG2 VAL 137 106.583 9.868 -4.373 987 HG23 VAL 137 2HG2 VAL 137 104.882 9.934 -4.833 988 H GLY 138 H GLY 138 106.760 7.482 -9.058 989 HA2 GLY 138 1HA GLY 138 105.767 4.690 -8.840 990 HA3 GLY 138 2HA GLY 138 106.160 5.453 -10.380 991 H THR 139 H THR 139 107.324 3.246 -8.324 992 HA THR 139 HA THR 139 110.155 4.040 -8.731 993 HB THR 139 HB THR 139 109.041 2.458 -6.407 994 HG1 THR 139 HG1 THR 139 108.546 4.345 -5.673 995 HG21 THR 139 3HG2 THR 139 111.396 3.267 -5.542 996 HG22 THR 139 1HG2 THR 139 111.761 3.391 -7.263 997 HG23 THR 139 2HG2 THR 139 111.279 1.841 -6.573 998 H TRP 140 H TRP 140 111.468 2.598 -9.639 999 HA TRP 140 HA TRP 140 110.449 -0.130 -10.149 1000 HB2 TRP 140 1HB TRP 140 111.027 1.220 -12.142 1001 HB3 TRP 140 2HB TRP 140 112.656 1.414 -11.523 1002 HD1 TRP 140 HD1 TRP 140 114.121 -0.907 -11.309 1003 HE1 TRP 140 HE1 TRP 140 114.102 -2.979 -12.840 1004 HE3 TRP 140 HE3 TRP 140 109.634 -0.229 -13.651 1005 HZ2 TRP 140 HZ2 TRP 140 112.405 -4.190 -14.806 1006 HZ3 TRP 140 HZ3 TRP 140 108.843 -1.851 -15.345 1007 HH2 TRP 140 HH2 TRP 140 110.220 -3.829 -15.927 1008 H ILE 141 H ILE 141 111.353 -1.732 -8.988 1009 HA ILE 141 HA ILE 141 113.945 -1.189 -7.645 1010 HB ILE 141 HB ILE 141 111.688 -2.967 -6.685 1011 HG12 ILE 141 1HG1 ILE 141 112.583 -0.274 -5.614 1012 HG13 ILE 141 2HG1 ILE 141 111.169 -0.501 -6.645 1013 HG21 ILE 141 1HG2 ILE 141 114.183 -1.993 -5.263 1014 HG22 ILE 141 2HG2 ILE 141 114.010 -3.598 -5.975 1015 HG23 ILE 141 3HG2 ILE 141 112.977 -3.113 -4.629 1016 HD11 ILE 141 3HD1 ILE 141 110.504 -2.311 -4.859 1017 HD12 ILE 141 1HD1 ILE 141 110.214 -0.604 -4.519 1018 HD13 ILE 141 2HD1 ILE 141 111.615 -1.418 -3.820 1019 H ALA 142 H ALA 142 115.582 -2.475 -8.188 1020 HA ALA 142 HA ALA 142 115.002 -5.287 -8.863 1021 HB1 ALA 142 1HB ALA 142 117.110 -3.810 -10.404 1022 HB2 ALA 142 2HB ALA 142 115.426 -3.717 -10.918 1023 HB3 ALA 142 3HB ALA 142 116.239 -5.281 -10.836 1024 H GLY 143 H GLY 143 116.464 -6.728 -8.018 1025 HA2 GLY 143 1HA GLY 143 119.089 -5.864 -7.141 1026 HA3 GLY 143 2HA GLY 143 117.970 -6.179 -5.821 1027 H VAL 144 H VAL 144 119.920 -7.744 -5.525 1028 HA VAL 144 HA VAL 144 119.124 -10.351 -6.631 1029 HB VAL 144 HB VAL 144 121.500 -10.955 -6.986 1030 HG11 VAL 144 1HG1 VAL 144 119.991 -9.949 -8.791 1031 HG12 VAL 144 2HG1 VAL 144 121.727 -9.837 -9.084 1032 HG13 VAL 144 3HG1 VAL 144 120.837 -8.427 -8.509 1033 HG21 VAL 144 3HG2 VAL 144 121.930 -8.025 -6.326 1034 HG22 VAL 144 1HG2 VAL 144 123.148 -9.049 -7.086 1035 HG23 VAL 144 2HG2 VAL 144 122.582 -9.413 -5.457 1036 H GLY 145 H GLY 145 119.747 -12.144 -5.281 1037 HA2 GLY 145 1HA GLY 145 120.861 -11.458 -2.654 1038 HA3 GLY 145 2HA GLY 145 119.246 -12.155 -2.696 1039 H TYR 146 H TYR 146 121.210 -13.408 -1.299 1040 HA TYR 146 HA TYR 146 121.680 -15.851 -2.890 1041 HB2 TYR 146 1HB TYR 146 123.779 -14.506 -2.668 1042 HB3 TYR 146 2HB TYR 146 123.647 -14.668 -0.927 1043 HD1 TYR 146 HD1 TYR 146 124.074 -16.815 0.173 1044 HD2 TYR 146 HD2 TYR 146 124.397 -16.384 -4.088 1045 HE1 TYR 146 HE1 TYR 146 125.284 -18.975 0.047 1046 HE2 TYR 146 HE2 TYR 146 125.605 -18.545 -4.215 1047 HH TYR 146 HH TYR 146 127.132 -19.926 -2.038 1048 H ARG 147 H ARG 147 121.434 -17.768 -1.764 1049 HA ARG 147 HA ARG 147 120.066 -17.490 0.825 1050 HB2 ARG 147 1HB ARG 147 118.933 -18.665 -1.072 1051 HB3 ARG 147 2HB ARG 147 120.200 -19.890 -1.011 1052 HG2 ARG 147 1HG ARG 147 119.615 -20.358 1.355 1053 HG3 ARG 147 2HG ARG 147 118.310 -19.174 1.250 1054 HD2 ARG 147 1HD ARG 147 117.335 -20.487 -0.641 1055 HD3 ARG 147 2HD ARG 147 118.578 -21.708 -0.388 1056 HE ARG 147 HE ARG 147 117.032 -21.073 1.978 1057 HH11 ARG 147 1HH1 ARG 147 117.228 -23.146 -0.849 1058 HH12 ARG 147 2HH1 ARG 147 116.217 -24.365 -0.149 1059 HH21 ARG 147 1HH2 ARG 147 115.733 -22.677 2.825 1060 HH22 ARG 147 2HH2 ARG 147 115.382 -24.101 1.905 1061 H PHE 148 H PHE 148 120.783 -18.451 2.664 1062 HA PHE 148 HA PHE 148 123.240 -20.096 2.518 1063 HB2 PHE 148 1HB PHE 148 122.545 -17.962 4.543 1064 HB3 PHE 148 2HB PHE 148 123.901 -19.065 4.680 1065 HD1 PHE 148 HD1 PHE 148 125.761 -18.945 2.969 1066 HD2 PHE 148 HD2 PHE 148 122.654 -15.991 3.233 1067 HE1 PHE 148 HE1 PHE 148 127.159 -17.359 1.673 1068 HE2 PHE 148 HE2 PHE 148 124.050 -14.405 1.935 1069 HZ PHE 148 HZ PHE 148 126.304 -15.089 1.156 Start of MODEL 13 1 H1 ALA 1 3H ALA 1 115.366 -21.425 8.698 2 H2 ALA 1 2H ALA 1 116.039 -21.822 10.206 3 H3 ALA 1 HT3 ALA 1 114.639 -22.617 9.661 4 HA ALA 1 HA ALA 1 117.057 -23.667 9.453 5 HB1 ALA 1 2HB ALA 1 114.629 -24.463 8.781 6 HB2 ALA 1 3HB ALA 1 116.044 -25.262 8.095 7 HB3 ALA 1 1HB ALA 1 115.170 -24.053 7.154 8 H THR 2 H THR 2 115.545 -21.914 6.731 9 HA THR 2 HA THR 2 118.259 -21.394 5.654 10 HB THR 2 HB THR 2 115.717 -21.782 4.058 11 HG1 THR 2 HG1 THR 2 116.543 -23.781 3.583 12 HG21 THR 2 3HG2 THR 2 117.392 -20.309 3.011 13 HG22 THR 2 1HG2 THR 2 117.277 -21.843 2.149 14 HG23 THR 2 2HG2 THR 2 118.627 -21.545 3.244 15 H SER 3 H SER 3 118.700 -19.345 4.972 16 HA SER 3 HA SER 3 116.541 -17.330 5.183 17 HB2 SER 3 1HB SER 3 118.091 -15.796 6.261 18 HB3 SER 3 2HB SER 3 117.993 -17.281 7.200 19 HG SER 3 HG SER 3 120.117 -16.148 5.999 20 H THR 4 H THR 4 116.772 -15.508 3.845 21 HA THR 4 HA THR 4 118.850 -15.680 1.749 22 HB THR 4 HB THR 4 115.939 -14.995 1.274 23 HG1 THR 4 HG1 THR 4 115.815 -17.016 0.368 24 HG21 THR 4 3HG2 THR 4 118.259 -15.463 -0.621 25 HG22 THR 4 1HG2 THR 4 117.547 -13.894 -0.246 26 HG23 THR 4 2HG2 THR 4 116.596 -15.114 -1.095 27 H VAL 5 H VAL 5 119.833 -13.783 1.284 28 HA VAL 5 HA VAL 5 118.666 -11.303 2.430 29 HB VAL 5 HB VAL 5 121.609 -12.008 2.247 30 HG11 VAL 5 1HG1 VAL 5 120.177 -9.677 3.559 31 HG12 VAL 5 2HG1 VAL 5 121.075 -9.589 2.044 32 HG13 VAL 5 3HG1 VAL 5 121.918 -9.951 3.550 33 HG21 VAL 5 3HG2 VAL 5 120.703 -13.346 4.003 34 HG22 VAL 5 1HG2 VAL 5 119.632 -12.049 4.537 35 HG23 VAL 5 2HG2 VAL 5 121.371 -11.924 4.803 36 H THR 6 H THR 6 118.480 -9.629 1.030 37 HA THR 6 HA THR 6 120.025 -9.694 -1.466 38 HB THR 6 HB THR 6 117.875 -10.840 -1.905 39 HG1 THR 6 HG1 THR 6 117.269 -9.328 -3.627 40 HG21 THR 6 3HG2 THR 6 115.785 -9.795 -1.673 41 HG22 THR 6 1HG2 THR 6 116.503 -8.194 -1.495 42 HG23 THR 6 2HG2 THR 6 116.628 -9.367 -0.184 43 H GLY 7 H GLY 7 120.046 -7.681 -2.621 44 HA2 GLY 7 1HA GLY 7 118.966 -5.341 -1.206 45 HA3 GLY 7 2HA GLY 7 120.699 -5.381 -1.537 46 H GLY 8 H GLY 8 118.656 -3.527 -2.602 47 HA2 GLY 8 1HA GLY 8 119.345 -3.829 -5.425 48 HA3 GLY 8 2HA GLY 8 117.628 -3.880 -5.043 49 H TYR 9 H TYR 9 118.445 -1.992 -6.720 50 HA TYR 9 HA TYR 9 118.312 0.503 -5.135 51 HB2 TYR 9 1HB TYR 9 119.673 1.618 -6.767 52 HB3 TYR 9 2HB TYR 9 120.529 0.197 -6.203 53 HD1 TYR 9 HD2 TYR 9 120.909 -1.714 -7.687 54 HD2 TYR 9 HD1 TYR 9 118.814 1.783 -9.041 55 HE1 TYR 9 HE2 TYR 9 121.175 -2.464 -10.035 56 HE2 TYR 9 HE1 TYR 9 119.081 1.034 -11.389 57 HH TYR 9 HH TYR 9 119.430 -1.439 -12.500 58 H ALA 10 H ALA 10 116.883 2.062 -5.862 59 HA ALA 10 HA ALA 10 115.352 1.479 -8.311 60 HB1 ALA 10 1HB ALA 10 113.307 1.407 -7.276 61 HB2 ALA 10 2HB ALA 10 113.830 2.410 -5.923 62 HB3 ALA 10 3HB ALA 10 114.295 0.710 -5.993 63 H GLN 11 H GLN 11 114.554 3.246 -9.371 64 HA GLN 11 HA GLN 11 115.217 5.911 -8.261 65 HB2 GLN 11 1HB GLN 11 116.428 5.295 -10.357 66 HB3 GLN 11 2HB GLN 11 114.871 5.125 -11.167 67 HG2 GLN 11 1HG GLN 11 114.338 7.471 -10.687 68 HG3 GLN 11 2HG GLN 11 115.860 7.654 -9.821 69 HE21 GLN 11 1HE2 GLN 11 115.493 9.392 -11.909 70 HE22 GLN 11 2HE2 GLN 11 116.442 8.949 -13.245 71 H SER 12 H SER 12 113.584 7.500 -8.269 72 HA SER 12 HA SER 12 110.870 6.440 -8.853 73 HB2 SER 12 1HB SER 12 111.694 8.314 -6.624 74 HB3 SER 12 2HB SER 12 110.067 7.725 -6.942 75 HG SER 12 HG SER 12 110.750 6.239 -5.566 76 H ASP 13 H ASP 13 109.473 7.713 -9.900 77 HA ASP 13 HA ASP 13 110.391 10.395 -10.748 78 HB2 ASP 13 1HB ASP 13 110.130 8.730 -12.586 79 HB3 ASP 13 2HB ASP 13 108.436 8.542 -12.136 80 H ALA 14 H ALA 14 108.992 12.109 -10.474 81 HA ALA 14 HA ALA 14 106.662 11.560 -8.748 82 HB1 ALA 14 1HB ALA 14 107.129 13.479 -7.565 83 HB2 ALA 14 2HB ALA 14 107.901 14.270 -8.940 84 HB3 ALA 14 3HB ALA 14 108.764 13.022 -8.042 85 H GLN 15 H GLN 15 104.940 11.505 -10.013 86 HA GLN 15 HA GLN 15 104.570 13.327 -12.234 87 HB2 GLN 15 1HB GLN 15 102.717 11.309 -10.948 88 HB3 GLN 15 2HB GLN 15 102.317 12.254 -12.382 89 HG2 GLN 15 1HG GLN 15 104.211 11.288 -13.588 90 HG3 GLN 15 2HG GLN 15 104.702 10.399 -12.148 91 HE21 GLN 15 1HE2 GLN 15 104.066 9.055 -14.599 92 HE22 GLN 15 2HE2 GLN 15 102.651 8.148 -14.355 93 H GLY 16 H GLY 16 103.796 15.270 -12.090 94 HA2 GLY 16 1HA GLY 16 102.446 17.046 -11.392 95 HA3 GLY 16 2HA GLY 16 101.931 16.095 -10.008 96 H GLN 17 H GLN 17 104.979 15.551 -9.547 97 HA GLN 17 HA GLN 17 105.725 18.223 -8.517 98 HB2 GLN 17 1HB GLN 17 105.396 16.483 -6.756 99 HB3 GLN 17 2HB GLN 17 106.669 15.527 -7.512 100 HG2 GLN 17 1HG GLN 17 107.751 16.746 -5.780 101 HG3 GLN 17 2HG GLN 17 108.163 17.594 -7.268 102 HE21 GLN 17 1HE2 GLN 17 107.866 19.818 -7.151 103 HE22 GLN 17 2HE2 GLN 17 106.767 20.600 -6.119 104 H MET 18 H MET 18 107.736 19.038 -9.106 105 HA MET 18 HA MET 18 109.124 17.585 -11.237 106 HB2 MET 18 1HB MET 18 109.505 20.371 -10.120 107 HB3 MET 18 2HB MET 18 110.421 19.698 -11.469 108 HG2 MET 18 1HG MET 18 108.240 19.288 -12.656 109 HG3 MET 18 2HG MET 18 107.429 20.166 -11.359 110 HE1 MET 18 3HE MET 18 108.364 23.596 -11.411 111 HE2 MET 18 1HE MET 18 109.894 22.820 -10.984 112 HE3 MET 18 2HE MET 18 108.369 22.146 -10.412 113 H ASN 19 H ASN 19 110.310 15.965 -10.286 114 HA ASN 19 HA ASN 19 112.785 16.599 -9.088 115 HB2 ASN 19 1HB ASN 19 111.178 17.082 -7.157 116 HB3 ASN 19 2HB ASN 19 110.870 15.349 -7.123 117 HD21 ASN 19 1HD2 ASN 19 112.253 14.177 -5.793 118 HD22 ASN 19 2HD2 ASN 19 113.797 14.689 -5.308 119 H LYS 20 H LYS 20 114.104 14.795 -8.780 120 HA LYS 20 HA LYS 20 112.922 12.144 -9.383 121 HB2 LYS 20 1HB LYS 20 115.698 13.106 -10.132 122 HB3 LYS 20 2HB LYS 20 114.998 11.533 -10.510 123 HG2 LYS 20 1HG LYS 20 113.892 14.186 -11.477 124 HG3 LYS 20 2HG LYS 20 114.906 13.110 -12.440 125 HD2 LYS 20 1HD LYS 20 113.203 11.300 -12.098 126 HD3 LYS 20 2HD LYS 20 112.164 12.486 -11.309 127 HE2 LYS 20 1HE LYS 20 113.276 13.102 -14.028 128 HE3 LYS 20 2HE LYS 20 111.892 12.019 -13.888 129 HZ1 LYS 20 3HZ LYS 20 111.477 14.527 -14.116 130 HZ2 LYS 20 1HZ LYS 20 111.916 14.607 -12.479 131 HZ3 LYS 20 2HZ LYS 20 110.588 13.661 -12.955 132 H MET 21 H MET 21 113.708 10.405 -8.089 133 HA MET 21 HA MET 21 115.499 11.213 -5.864 134 HB2 MET 21 1HB MET 21 112.870 9.737 -5.624 135 HB3 MET 21 2HB MET 21 114.019 9.985 -4.308 136 HG2 MET 21 1HG MET 21 113.833 12.462 -4.703 137 HG3 MET 21 2HG MET 21 112.539 12.128 -5.852 138 HE1 MET 21 3HE MET 21 109.708 10.691 -4.000 139 HE2 MET 21 1HE MET 21 111.007 9.497 -4.106 140 HE3 MET 21 2HE MET 21 110.730 10.622 -5.434 141 H GLY 22 H GLY 22 116.495 9.422 -4.732 142 HA2 GLY 22 1HA GLY 22 116.480 6.859 -6.186 143 HA3 GLY 22 2HA GLY 22 118.016 7.694 -5.964 144 H GLY 23 H GLY 23 116.685 5.112 -4.842 145 HA2 GLY 23 1HA GLY 23 117.677 5.507 -2.113 146 HA3 GLY 23 2HA GLY 23 116.000 5.005 -2.287 147 H PHE 24 H PHE 24 117.664 3.418 -0.888 148 HA PHE 24 HA PHE 24 118.117 1.106 -2.690 149 HB2 PHE 24 1HB PHE 24 119.702 1.880 -0.240 150 HB3 PHE 24 2HB PHE 24 119.913 0.398 -1.152 151 HD1 PHE 24 HD2 PHE 24 120.972 0.416 -3.358 152 HD2 PHE 24 HD1 PHE 24 120.448 4.033 -1.101 153 HE1 PHE 24 HE2 PHE 24 122.568 1.582 -4.855 154 HE2 PHE 24 HE1 PHE 24 122.045 5.198 -2.598 155 HZ PHE 24 HZ PHE 24 123.105 3.973 -4.475 156 H ASN 25 H ASN 25 117.716 -0.971 -1.745 157 HA ASN 25 HA ASN 25 115.919 -0.904 0.608 158 HB2 ASN 25 1HB ASN 25 114.649 -0.938 -1.553 159 HB3 ASN 25 2HB ASN 25 115.426 -2.474 -1.929 160 HD21 ASN 25 1HD2 ASN 25 113.244 -3.486 -1.873 161 HD22 ASN 25 2HD2 ASN 25 112.519 -3.842 -0.381 162 H LEU 26 H LEU 26 116.143 -2.560 2.017 163 HA LEU 26 HA LEU 26 117.814 -4.875 1.216 164 HB2 LEU 26 1HB LEU 26 117.774 -3.266 3.765 165 HB3 LEU 26 2HB LEU 26 118.229 -4.963 3.807 166 HG LEU 26 HG LEU 26 120.186 -3.458 3.638 167 HD11 LEU 26 1HD1 LEU 26 119.962 -5.810 2.519 168 HD12 LEU 26 2HD1 LEU 26 121.358 -4.800 2.146 169 HD13 LEU 26 3HD1 LEU 26 120.010 -4.895 1.012 170 HD21 LEU 26 3HD2 LEU 26 118.744 -1.866 2.051 171 HD22 LEU 26 1HD2 LEU 26 119.542 -2.811 0.794 172 HD23 LEU 26 2HD2 LEU 26 120.503 -1.913 1.965 173 H LYS 27 H LYS 27 116.940 -6.887 1.705 174 HA LYS 27 HA LYS 27 114.318 -6.887 3.080 175 HB2 LYS 27 1HB LYS 27 113.999 -6.732 0.617 176 HB3 LYS 27 2HB LYS 27 114.889 -8.241 0.438 177 HG2 LYS 27 1HG LYS 27 113.231 -9.425 1.784 178 HG3 LYS 27 2HG LYS 27 112.361 -7.918 2.077 179 HD2 LYS 27 1HD LYS 27 111.233 -9.077 0.277 180 HD3 LYS 27 2HD LYS 27 112.071 -7.688 -0.415 181 HE2 LYS 27 1HE LYS 27 113.723 -9.005 -1.405 182 HE3 LYS 27 2HE LYS 27 113.476 -10.339 -0.278 183 HZ1 LYS 27 3HZ LYS 27 112.560 -10.470 -2.696 184 HZ2 LYS 27 1HZ LYS 27 111.280 -9.555 -2.061 185 HZ3 LYS 27 2HZ LYS 27 111.644 -11.077 -1.400 186 H TYR 28 H TYR 28 113.901 -8.618 4.313 187 HA TYR 28 HA TYR 28 115.793 -10.902 4.223 188 HB2 TYR 28 1HB TYR 28 116.064 -9.486 6.240 189 HB3 TYR 28 2HB TYR 28 114.376 -9.754 6.634 190 HD1 TYR 28 HD1 TYR 28 117.709 -11.337 6.349 191 HD2 TYR 28 HD2 TYR 28 113.638 -11.818 7.634 192 HE1 TYR 28 HE1 TYR 28 118.340 -13.397 7.578 193 HE2 TYR 28 HE2 TYR 28 114.270 -13.879 8.862 194 HH TYR 28 HH TYR 28 116.482 -14.787 9.910 195 H ARG 29 H ARG 29 114.921 -12.912 4.158 196 HA ARG 29 HA ARG 29 112.012 -13.209 4.500 197 HB2 ARG 29 1HB ARG 29 112.500 -12.841 2.088 198 HB3 ARG 29 2HB ARG 29 113.552 -14.256 2.114 199 HG2 ARG 29 1HG ARG 29 111.628 -15.648 2.847 200 HG3 ARG 29 2HG ARG 29 110.583 -14.229 2.734 201 HD2 ARG 29 1HD ARG 29 111.206 -14.014 0.327 202 HD3 ARG 29 2HD ARG 29 112.136 -15.502 0.464 203 HE ARG 29 HE ARG 29 109.392 -15.780 1.317 204 HH11 ARG 29 1HH1 ARG 29 111.517 -15.881 -1.476 205 HH12 ARG 29 2HH1 ARG 29 110.442 -16.892 -2.382 206 HH21 ARG 29 1HH2 ARG 29 108.050 -17.084 0.101 207 HH22 ARG 29 2HH2 ARG 29 108.506 -17.563 -1.500 208 H TYR 30 H TYR 30 111.373 -15.158 5.352 209 HA TYR 30 HA TYR 30 113.426 -17.267 5.642 210 HB2 TYR 30 1HB TYR 30 112.817 -17.661 7.915 211 HB3 TYR 30 2HB TYR 30 113.218 -15.966 7.743 212 HD1 TYR 30 HD1 TYR 30 110.539 -18.409 8.354 213 HD2 TYR 30 HD2 TYR 30 111.502 -14.240 7.975 214 HE1 TYR 30 HE1 TYR 30 108.361 -17.812 9.380 215 HE2 TYR 30 HE2 TYR 30 109.323 -13.643 8.998 216 HH TYR 30 HH TYR 30 107.666 -14.923 10.663 217 H GLU 31 H GLU 31 112.708 -19.360 5.527 218 HA GLU 31 HA GLU 31 109.848 -19.756 4.884 219 HB2 GLU 31 1HB GLU 31 111.241 -19.564 2.818 220 HB3 GLU 31 2HB GLU 31 112.170 -20.959 3.363 221 HG2 GLU 31 1HG GLU 31 110.079 -22.298 3.424 222 HG3 GLU 31 2HG GLU 31 109.192 -20.912 2.802 223 H GLU 32 H GLU 32 108.986 -21.771 5.411 224 HA GLU 32 HA GLU 32 110.549 -23.320 7.347 225 HB2 GLU 32 1HB GLU 32 108.214 -22.572 7.874 226 HB3 GLU 32 2HB GLU 32 107.638 -23.634 6.589 227 HG2 GLU 32 1HG GLU 32 108.735 -25.557 7.722 228 HG3 GLU 32 2HG GLU 32 109.214 -24.487 9.032 229 H ASP 33 H ASP 33 111.000 -25.499 7.128 230 HA ASP 33 HA ASP 33 111.624 -26.279 4.475 231 HB2 ASP 33 1HB ASP 33 111.722 -27.825 7.066 232 HB3 ASP 33 2HB ASP 33 112.406 -28.384 5.542 233 H ASN 34 H ASN 34 109.127 -27.480 6.750 234 HA ASN 34 HA ASN 34 108.253 -29.373 4.654 235 HB2 ASN 34 1HB ASN 34 107.682 -29.304 7.618 236 HB3 ASN 34 2HB ASN 34 107.048 -30.506 6.495 237 HD21 ASN 34 1HD2 ASN 34 108.841 -31.099 8.736 238 HD22 ASN 34 2HD2 ASN 34 110.272 -31.721 8.069 239 H SER 35 H SER 35 107.244 -26.437 6.142 240 HA SER 35 HA SER 35 104.795 -26.555 4.554 241 HB2 SER 35 1HB SER 35 103.638 -25.434 6.639 242 HB3 SER 35 2HB SER 35 103.736 -27.186 6.518 243 HG SER 35 HG SER 35 105.605 -27.084 7.827 244 HA PRO 36 HA PRO 36 107.414 -22.768 4.574 245 HB2 PRO 36 1HB PRO 36 107.505 -22.250 1.914 246 HB3 PRO 36 2HB PRO 36 108.522 -23.487 2.680 247 HG2 PRO 36 1HG PRO 36 106.014 -23.811 1.117 248 HG3 PRO 36 2HG PRO 36 107.488 -24.796 1.108 249 HD2 PRO 36 1HD PRO 36 105.207 -25.497 2.477 250 HD3 PRO 36 2HD PRO 36 106.839 -26.033 2.937 251 H LEU 37 H LEU 37 106.672 -20.823 4.994 252 HA LEU 37 HA LEU 37 104.538 -19.664 3.307 253 HB2 LEU 37 1HB LEU 37 103.766 -20.076 5.658 254 HB3 LEU 37 2HB LEU 37 105.068 -19.030 6.226 255 HG LEU 37 HG LEU 37 104.126 -17.228 4.696 256 HD11 LEU 37 1HD1 LEU 37 101.639 -17.592 4.211 257 HD12 LEU 37 2HD1 LEU 37 101.930 -19.302 4.532 258 HD13 LEU 37 3HD1 LEU 37 102.765 -18.498 3.202 259 HD21 LEU 37 3HD2 LEU 37 102.484 -16.538 6.321 260 HD22 LEU 37 1HD2 LEU 37 103.743 -17.406 7.198 261 HD23 LEU 37 2HD2 LEU 37 102.212 -18.203 6.834 262 H GLY 38 H GLY 38 105.069 -17.627 2.422 263 HA2 GLY 38 1HA GLY 38 107.898 -16.914 2.770 264 HA3 GLY 38 2HA GLY 38 106.845 -16.382 1.460 265 H VAL 39 H VAL 39 108.330 -15.400 4.281 266 HA VAL 39 HA VAL 39 106.476 -13.083 4.472 267 HB VAL 39 HB VAL 39 108.196 -14.243 6.684 268 HG11 VAL 39 1HG1 VAL 39 107.772 -11.756 6.712 269 HG12 VAL 39 2HG1 VAL 39 107.105 -12.612 8.102 270 HG13 VAL 39 3HG1 VAL 39 106.046 -12.108 6.785 271 HG21 VAL 39 3HG2 VAL 39 105.870 -14.702 7.684 272 HG22 VAL 39 1HG2 VAL 39 106.392 -15.766 6.378 273 HG23 VAL 39 2HG2 VAL 39 105.247 -14.466 6.052 274 H ILE 40 H ILE 40 107.382 -11.183 3.988 275 HA ILE 40 HA ILE 40 110.340 -10.970 4.105 276 HB ILE 40 HB ILE 40 110.249 -9.627 2.044 277 HG12 ILE 40 1HG1 ILE 40 107.372 -10.548 1.810 278 HG13 ILE 40 2HG1 ILE 40 107.814 -8.946 2.397 279 HG21 ILE 40 1HG2 ILE 40 110.478 -12.212 2.151 280 HG22 ILE 40 2HG2 ILE 40 110.128 -11.478 0.586 281 HG23 ILE 40 3HG2 ILE 40 108.833 -12.236 1.514 282 HD11 ILE 40 3HD1 ILE 40 108.657 -8.269 0.332 283 HD12 ILE 40 1HD1 ILE 40 107.303 -9.290 -0.152 284 HD13 ILE 40 2HD1 ILE 40 108.947 -9.923 -0.207 285 H GLY 41 H GLY 41 111.161 -9.117 4.837 286 HA2 GLY 41 1HA GLY 41 109.344 -6.823 5.291 287 HA3 GLY 41 2HA GLY 41 110.518 -7.320 6.513 288 H SER 42 H SER 42 110.118 -4.943 4.449 289 HA SER 42 HA SER 42 112.939 -4.894 3.547 290 HB2 SER 42 1HB SER 42 110.501 -3.950 2.028 291 HB3 SER 42 2HB SER 42 112.169 -3.698 1.525 292 HG SER 42 HG SER 42 112.297 -5.741 0.966 293 H PHE 43 H PHE 43 114.057 -3.072 3.905 294 HA PHE 43 HA PHE 43 112.582 -0.708 4.929 295 HB2 PHE 43 1HB PHE 43 114.034 -1.820 6.616 296 HB3 PHE 43 2HB PHE 43 115.411 -1.568 5.560 297 HD1 PHE 43 HD1 PHE 43 112.885 0.097 7.691 298 HD2 PHE 43 HD2 PHE 43 116.473 0.586 5.381 299 HE1 PHE 43 HE1 PHE 43 113.221 2.342 8.689 300 HE2 PHE 43 HE2 PHE 43 116.810 2.831 6.379 301 HZ PHE 43 HZ PHE 43 115.183 3.709 8.032 302 H THR 44 H THR 44 112.768 1.094 3.701 303 HA THR 44 HA THR 44 114.949 1.163 1.680 304 HB THR 44 HB THR 44 113.400 2.265 0.158 305 HG1 THR 44 HG1 THR 44 111.663 3.118 0.918 306 HG21 THR 44 3HG2 THR 44 111.736 0.373 -0.119 307 HG22 THR 44 1HG2 THR 44 112.385 -0.317 1.367 308 HG23 THR 44 2HG2 THR 44 113.425 -0.124 -0.043 309 H TYR 45 H TYR 45 116.012 3.053 1.404 310 HA TYR 45 HA TYR 45 114.978 5.458 2.775 311 HB2 TYR 45 1HB TYR 45 117.167 6.076 3.518 312 HB3 TYR 45 2HB TYR 45 116.820 4.463 4.103 313 HD1 TYR 45 HD1 TYR 45 118.821 6.470 1.743 314 HD2 TYR 45 HD2 TYR 45 118.091 2.547 3.334 315 HE1 TYR 45 HE1 TYR 45 120.951 5.671 0.752 316 HE2 TYR 45 HE2 TYR 45 120.217 1.748 2.340 317 HH TYR 45 HH TYR 45 122.621 3.477 1.515 318 H THR 46 H THR 46 114.884 7.180 1.523 319 HA THR 46 HA THR 46 116.275 7.137 -1.087 320 HB THR 46 HB THR 46 113.434 8.072 -0.637 321 HG1 THR 46 HG1 THR 46 112.786 6.117 -1.268 322 HG21 THR 46 3HG2 THR 46 113.309 8.145 -3.025 323 HG22 THR 46 1HG2 THR 46 114.858 7.322 -3.195 324 HG23 THR 46 2HG2 THR 46 114.799 8.975 -2.583 325 H GLU 47 H GLU 47 116.903 9.134 -1.896 326 HA GLU 47 HA GLU 47 116.485 11.480 -0.140 327 HB2 GLU 47 1HB GLU 47 119.069 10.640 -1.479 328 HB3 GLU 47 2HB GLU 47 118.819 12.152 -0.605 329 HG2 GLU 47 1HG GLU 47 118.233 10.843 1.429 330 HG3 GLU 47 2HG GLU 47 118.584 9.361 0.552 331 H LYS 48 H LYS 48 116.575 13.511 -1.212 332 HA LYS 48 HA LYS 48 115.758 13.352 -4.025 333 HB2 LYS 48 1HB LYS 48 115.635 15.614 -2.013 334 HB3 LYS 48 2HB LYS 48 115.058 15.716 -3.678 335 HG2 LYS 48 1HG LYS 48 113.435 13.953 -3.280 336 HG3 LYS 48 2HG LYS 48 114.071 13.684 -1.656 337 HD2 LYS 48 1HD LYS 48 112.093 15.043 -1.434 338 HD3 LYS 48 2HD LYS 48 113.484 16.082 -1.124 339 HE2 LYS 48 1HE LYS 48 113.390 16.961 -3.396 340 HE3 LYS 48 2HE LYS 48 112.081 15.851 -3.801 341 HZ1 LYS 48 3HZ LYS 48 112.020 18.304 -2.249 342 HZ2 LYS 48 1HZ LYS 48 111.071 17.032 -1.651 343 HZ3 LYS 48 2HZ LYS 48 110.822 17.606 -3.230 344 H SER 49 H SER 49 116.905 14.252 -5.676 345 HA SER 49 HA SER 49 119.579 15.307 -5.004 346 HB2 SER 49 1HB SER 49 119.468 13.336 -6.512 347 HB3 SER 49 2HB SER 49 118.511 14.283 -7.647 348 HG SER 49 HG SER 49 120.570 14.550 -8.316 349 H ARG 50 H ARG 50 120.060 17.376 -5.346 350 HA ARG 50 HA ARG 50 118.476 18.939 -7.264 351 HB2 ARG 50 1HB ARG 50 118.239 20.780 -5.645 352 HB3 ARG 50 2HB ARG 50 117.414 19.323 -5.105 353 HG2 ARG 50 1HG ARG 50 118.510 19.769 -3.150 354 HG3 ARG 50 2HG ARG 50 119.823 18.906 -3.943 355 HD2 ARG 50 1HD ARG 50 120.787 21.037 -4.703 356 HD3 ARG 50 2HD ARG 50 119.440 21.915 -3.989 357 HE ARG 50 HE ARG 50 120.510 21.748 -1.960 358 HH11 ARG 50 1HH1 ARG 50 121.762 19.199 -4.024 359 HH12 ARG 50 2HH1 ARG 50 122.961 18.718 -2.871 360 HH21 ARG 50 1HH2 ARG 50 122.081 21.090 -0.520 361 HH22 ARG 50 2HH2 ARG 50 123.139 19.776 -0.912 362 H THR 51 H THR 51 119.522 20.911 -7.941 363 HA THR 51 HA THR 51 122.332 20.597 -8.306 364 HB THR 51 HB THR 51 120.644 23.064 -8.790 365 HG1 THR 51 HG1 THR 51 121.260 20.853 -10.457 366 HG21 THR 51 3HG2 THR 51 122.384 23.597 -10.434 367 HG22 THR 51 1HG2 THR 51 123.247 22.114 -10.022 368 HG23 THR 51 2HG2 THR 51 123.100 23.408 -8.832 369 H ALA 52 H ALA 52 124.028 21.507 -7.254 370 HA ALA 52 HA ALA 52 123.565 22.487 -4.597 371 HB1 ALA 52 1HB ALA 52 126.103 22.783 -4.648 372 HB2 ALA 52 2HB ALA 52 126.044 22.094 -6.270 373 HB3 ALA 52 3HB ALA 52 125.499 21.143 -4.889 374 H SER 53 H SER 53 123.572 24.521 -3.845 375 HA SER 53 HA SER 53 124.519 26.698 -5.591 376 HB2 SER 53 1HB SER 53 122.048 26.504 -5.844 377 HB3 SER 53 2HB SER 53 121.880 26.732 -4.107 378 HG SER 53 HG SER 53 122.273 28.554 -6.064 379 H SER 54 H SER 54 125.473 28.385 -4.513 380 HA SER 54 HA SER 54 126.403 27.907 -1.867 381 HB2 SER 54 1HB SER 54 126.479 30.451 -3.508 382 HB3 SER 54 2HB SER 54 127.412 30.143 -2.048 383 HG SER 54 HG SER 54 128.375 29.693 -4.244 384 H GLY 55 H GLY 55 125.863 28.873 0.065 385 HA2 GLY 55 1HA GLY 55 124.658 30.105 1.600 386 HA3 GLY 55 2HA GLY 55 123.949 30.996 0.264 387 H ASP 56 H ASP 56 123.270 27.916 -0.585 388 HA ASP 56 HA ASP 56 120.771 27.832 1.009 389 HB2 ASP 56 1HB ASP 56 121.159 27.180 -1.921 390 HB3 ASP 56 2HB ASP 56 119.670 26.921 -1.016 391 H TYR 57 H TYR 57 120.928 26.146 2.348 392 HA TYR 57 HA TYR 57 121.749 23.544 1.211 393 HB2 TYR 57 1HB TYR 57 123.589 24.483 2.575 394 HB3 TYR 57 2HB TYR 57 122.499 24.590 3.944 395 HD1 TYR 57 HD2 TYR 57 124.450 22.342 1.787 396 HD2 TYR 57 HD1 TYR 57 121.783 22.583 5.146 397 HE1 TYR 57 HE2 TYR 57 125.023 20.011 2.409 398 HE2 TYR 57 HE1 TYR 57 122.356 20.252 5.767 399 HH TYR 57 HH TYR 57 123.714 18.524 5.362 400 H ASN 58 H ASN 58 120.281 22.003 1.524 401 HA ASN 58 HA ASN 58 118.634 22.011 3.936 402 HB2 ASN 58 1HB ASN 58 116.539 21.810 2.705 403 HB3 ASN 58 2HB ASN 58 117.334 23.327 2.298 404 HD21 ASN 58 1HD2 ASN 58 115.411 22.118 0.546 405 HD22 ASN 58 2HD2 ASN 58 116.216 21.621 -0.864 406 H LYS 59 H LYS 59 117.614 19.961 4.342 407 HA LYS 59 HA LYS 59 118.630 17.730 2.684 408 HB2 LYS 59 1HB LYS 59 120.004 18.021 4.751 409 HB3 LYS 59 2HB LYS 59 118.547 17.762 5.709 410 HG2 LYS 59 1HG LYS 59 119.590 15.631 5.598 411 HG3 LYS 59 2HG LYS 59 118.284 15.556 4.416 412 HD2 LYS 59 1HD LYS 59 119.845 16.027 2.599 413 HD3 LYS 59 2HD LYS 59 121.164 16.233 3.752 414 HE2 LYS 59 1HE LYS 59 121.354 14.007 2.867 415 HE3 LYS 59 2HE LYS 59 120.736 13.854 4.511 416 HZ1 LYS 59 3HZ LYS 59 119.242 13.635 1.966 417 HZ2 LYS 59 1HZ LYS 59 118.457 13.874 3.450 418 HZ3 LYS 59 2HZ LYS 59 119.392 12.478 3.201 419 H ASN 60 H ASN 60 117.059 16.450 2.011 420 HA ASN 60 HA ASN 60 114.584 16.223 3.629 421 HB2 ASN 60 1HB ASN 60 114.250 17.411 1.464 422 HB3 ASN 60 2HB ASN 60 114.847 15.983 0.622 423 HD21 ASN 60 1HD2 ASN 60 112.277 16.985 2.937 424 HD22 ASN 60 2HD2 ASN 60 111.155 15.823 2.415 425 H GLN 61 H GLN 61 114.077 14.205 4.294 426 HA GLN 61 HA GLN 61 115.446 11.921 2.977 427 HB2 GLN 61 1HB GLN 61 115.139 12.406 5.949 428 HB3 GLN 61 2HB GLN 61 115.723 10.906 5.229 429 HG2 GLN 61 1HG GLN 61 117.600 12.088 4.206 430 HG3 GLN 61 2HG GLN 61 116.998 13.625 4.821 431 HE21 GLN 61 1HE2 GLN 61 119.609 12.612 5.500 432 HE22 GLN 61 2HE2 GLN 61 119.619 12.270 7.162 433 H TYR 62 H TYR 62 114.242 10.081 2.740 434 HA TYR 62 HA TYR 62 111.605 9.963 4.078 435 HB2 TYR 62 1HB TYR 62 111.370 10.698 1.719 436 HB3 TYR 62 2HB TYR 62 112.185 9.234 1.204 437 HD1 TYR 62 HD1 TYR 62 109.115 10.614 2.736 438 HD2 TYR 62 HD2 TYR 62 111.029 7.120 1.131 439 HE1 TYR 62 HE1 TYR 62 106.930 9.440 2.686 440 HE2 TYR 62 HE2 TYR 62 108.846 5.946 1.083 441 HH TYR 62 HH TYR 62 105.933 7.426 2.444 442 H TYR 63 H TYR 63 111.201 8.050 5.043 443 HA TYR 63 HA TYR 63 112.800 5.687 4.234 444 HB2 TYR 63 1HB TYR 63 112.085 6.493 7.059 445 HB3 TYR 63 2HB TYR 63 112.923 5.026 6.592 446 HD1 TYR 63 HD1 TYR 63 115.229 5.190 5.577 447 HD2 TYR 63 HD2 TYR 63 113.222 8.561 7.327 448 HE1 TYR 63 HE1 TYR 63 117.392 6.394 5.739 449 HE2 TYR 63 HE2 TYR 63 115.385 9.764 7.489 450 HH TYR 63 HH TYR 63 118.036 8.768 7.623 451 H GLY 64 H GLY 64 111.679 3.702 4.282 452 HA2 GLY 64 1HA GLY 64 108.820 3.828 5.015 453 HA3 GLY 64 2HA GLY 64 109.267 3.354 3.381 454 H ILE 65 H ILE 65 108.004 1.959 5.839 455 HA ILE 65 HA ILE 65 109.774 -0.423 5.822 456 HB ILE 65 HB ILE 65 107.788 0.400 7.959 457 HG12 ILE 65 1HG1 ILE 65 110.821 0.398 8.051 458 HG13 ILE 65 2HG1 ILE 65 109.841 1.847 7.821 459 HG21 ILE 65 1HG2 ILE 65 108.173 -2.063 7.651 460 HG22 ILE 65 2HG2 ILE 65 108.708 -1.462 9.221 461 HG23 ILE 65 3HG2 ILE 65 109.889 -1.788 7.951 462 HD11 ILE 65 3HD1 ILE 65 110.422 1.624 10.185 463 HD12 ILE 65 1HD1 ILE 65 109.755 -0.008 10.218 464 HD13 ILE 65 2HD1 ILE 65 108.689 1.375 9.976 465 H THR 66 H THR 66 108.928 -2.195 4.888 466 HA THR 66 HA THR 66 105.991 -2.353 4.543 467 HB THR 66 HB THR 66 106.342 -3.247 2.283 468 HG1 THR 66 HG1 THR 66 108.488 -4.009 2.731 469 HG21 THR 66 3HG2 THR 66 107.534 -1.046 1.369 470 HG22 THR 66 1HG2 THR 66 107.293 -0.514 3.031 471 HG23 THR 66 2HG2 THR 66 105.910 -0.996 2.050 472 H ALA 67 H ALA 67 105.179 -4.507 4.187 473 HA ALA 67 HA ALA 67 106.944 -6.780 4.453 474 HB1 ALA 67 1HB ALA 67 106.644 -6.099 6.822 475 HB2 ALA 67 2HB ALA 67 105.920 -7.672 6.488 476 HB3 ALA 67 3HB ALA 67 104.898 -6.242 6.622 477 H GLY 68 H GLY 68 105.780 -8.828 4.064 478 HA2 GLY 68 1HA GLY 68 102.974 -8.908 3.674 479 HA3 GLY 68 2HA GLY 68 103.746 -8.582 2.138 480 HA PRO 69 HA PRO 69 103.782 -13.239 3.096 481 HB2 PRO 69 1HB PRO 69 101.595 -14.118 1.765 482 HB3 PRO 69 2HB PRO 69 101.538 -13.595 3.461 483 HG2 PRO 69 1HG PRO 69 100.732 -12.127 1.004 484 HG3 PRO 69 2HG PRO 69 99.948 -12.188 2.594 485 HD2 PRO 69 1HD PRO 69 101.535 -10.102 1.775 486 HD3 PRO 69 2HD PRO 69 101.294 -10.548 3.476 487 H ALA 70 H ALA 70 104.170 -14.989 1.486 488 HA ALA 70 HA ALA 70 104.386 -14.065 -1.300 489 HB1 ALA 70 1HB ALA 70 106.624 -14.262 -1.409 490 HB2 ALA 70 2HB ALA 70 106.626 -15.793 -0.540 491 HB3 ALA 70 3HB ALA 70 106.613 -14.274 0.352 492 H TYR 71 H TYR 71 104.390 -15.820 -2.856 493 HA TYR 71 HA TYR 71 103.164 -18.289 -1.771 494 HB2 TYR 71 1HB TYR 71 102.400 -16.790 -4.279 495 HB3 TYR 71 2HB TYR 71 101.722 -18.322 -3.759 496 HD1 TYR 71 HD1 TYR 71 101.832 -14.695 -3.176 497 HD2 TYR 71 HD2 TYR 71 100.157 -18.432 -1.881 498 HE1 TYR 71 HE1 TYR 71 100.126 -13.473 -1.855 499 HE2 TYR 71 HE2 TYR 71 98.451 -17.210 -0.559 500 HH TYR 71 HH TYR 71 98.170 -14.996 0.478 501 H ARG 72 H ARG 72 104.125 -20.125 -2.404 502 HA ARG 72 HA ARG 72 106.113 -20.008 -4.557 503 HB2 ARG 72 1HB ARG 72 106.705 -21.092 -2.397 504 HB3 ARG 72 2HB ARG 72 105.424 -22.272 -2.663 505 HG2 ARG 72 1HG ARG 72 107.396 -23.342 -3.426 506 HG3 ARG 72 2HG ARG 72 106.595 -22.794 -4.897 507 HD2 ARG 72 1HD ARG 72 108.034 -20.766 -4.895 508 HD3 ARG 72 2HD ARG 72 108.860 -21.376 -3.465 509 HE ARG 72 HE ARG 72 108.969 -23.374 -5.421 510 HH11 ARG 72 1HH1 ARG 72 110.229 -20.130 -4.965 511 HH12 ARG 72 2HH1 ARG 72 111.621 -20.424 -5.953 512 HH21 ARG 72 1HH2 ARG 72 110.779 -23.694 -6.682 513 HH22 ARG 72 2HH2 ARG 72 111.928 -22.419 -6.912 514 H ILE 73 H ILE 73 105.386 -20.364 -6.553 515 HA ILE 73 HA ILE 73 103.342 -22.460 -6.975 516 HB ILE 73 HB ILE 73 102.309 -20.233 -7.148 517 HG12 ILE 73 1HG1 ILE 73 102.566 -21.230 -9.969 518 HG13 ILE 73 2HG1 ILE 73 101.834 -22.267 -8.744 519 HG21 ILE 73 1HG2 ILE 73 103.086 -18.542 -8.543 520 HG22 ILE 73 2HG2 ILE 73 103.965 -19.662 -9.584 521 HG23 ILE 73 3HG2 ILE 73 104.603 -19.251 -7.992 522 HD11 ILE 73 3HD1 ILE 73 100.158 -20.863 -9.963 523 HD12 ILE 73 1HD1 ILE 73 100.955 -19.425 -9.326 524 HD13 ILE 73 2HD1 ILE 73 100.177 -20.561 -8.226 525 H ASN 74 H ASN 74 103.652 -23.790 -8.711 526 HA ASN 74 HA ASN 74 106.251 -24.255 -9.601 527 HB2 ASN 74 1HB ASN 74 103.643 -25.033 -10.923 528 HB3 ASN 74 2HB ASN 74 105.219 -25.737 -11.283 529 HD21 ASN 74 1HD2 ASN 74 106.308 -26.020 -8.701 530 HD22 ASN 74 2HD2 ASN 74 105.351 -27.100 -7.805 531 H ASP 75 H ASP 75 103.659 -22.367 -11.103 532 HA ASP 75 HA ASP 75 105.002 -21.904 -13.566 533 HB2 ASP 75 1HB ASP 75 102.857 -20.277 -12.181 534 HB3 ASP 75 2HB ASP 75 103.356 -20.085 -13.862 535 H TRP 76 H TRP 76 106.413 -20.359 -14.181 536 HA TRP 76 HA TRP 76 108.035 -18.769 -14.022 537 HB2 TRP 76 1HB TRP 76 106.155 -17.582 -11.976 538 HB3 TRP 76 2HB TRP 76 107.520 -16.755 -12.699 539 HD1 TRP 76 HD1 TRP 76 103.923 -17.575 -13.213 540 HE1 TRP 76 HE1 TRP 76 103.113 -16.628 -15.468 541 HE3 TRP 76 HE3 TRP 76 108.406 -16.285 -15.288 542 HZ2 TRP 76 HZ2 TRP 76 104.222 -15.473 -17.843 543 HZ3 TRP 76 HZ3 TRP 76 108.502 -15.266 -17.542 544 HH2 TRP 76 HH2 TRP 76 106.419 -14.857 -18.822 545 H ALA 77 H ALA 77 107.178 -18.463 -10.579 546 HA ALA 77 HA ALA 77 108.890 -20.414 -9.565 547 HB1 ALA 77 1HB ALA 77 110.228 -17.877 -10.301 548 HB2 ALA 77 2HB ALA 77 110.892 -19.502 -10.138 549 HB3 ALA 77 3HB ALA 77 110.616 -18.516 -8.703 550 H SER 78 H SER 78 109.220 -17.242 -8.050 551 HA SER 78 HA SER 78 106.979 -17.928 -6.239 552 HB2 SER 78 1HB SER 78 109.622 -16.650 -5.492 553 HB3 SER 78 2HB SER 78 108.276 -16.950 -4.399 554 HG SER 78 HG SER 78 108.760 -19.019 -4.374 555 H ILE 79 H ILE 79 105.786 -16.136 -5.409 556 HA ILE 79 HA ILE 79 106.432 -13.509 -6.611 557 HB ILE 79 HB ILE 79 104.642 -14.556 -7.948 558 HG12 ILE 79 1HG1 ILE 79 103.403 -12.413 -6.217 559 HG13 ILE 79 2HG1 ILE 79 104.712 -12.054 -7.344 560 HG21 ILE 79 1HG2 ILE 79 102.889 -14.468 -5.496 561 HG22 ILE 79 2HG2 ILE 79 103.806 -15.916 -5.913 562 HG23 ILE 79 3HG2 ILE 79 102.596 -15.285 -7.031 563 HD11 ILE 79 3HD1 ILE 79 102.834 -11.665 -8.673 564 HD12 ILE 79 1HD1 ILE 79 101.913 -12.973 -7.929 565 HD13 ILE 79 2HD1 ILE 79 103.207 -13.342 -9.069 566 H TYR 80 H TYR 80 105.783 -11.713 -5.353 567 HA TYR 80 HA TYR 80 104.570 -12.283 -2.741 568 HB2 TYR 80 1HB TYR 80 106.312 -11.148 -1.523 569 HB3 TYR 80 2HB TYR 80 107.009 -12.471 -2.437 570 HD1 TYR 80 HD1 TYR 80 108.426 -12.029 -4.408 571 HD2 TYR 80 HD2 TYR 80 106.834 -8.838 -2.014 572 HE1 TYR 80 HE1 TYR 80 110.036 -10.450 -5.441 573 HE2 TYR 80 HE2 TYR 80 108.445 -7.259 -3.046 574 HH TYR 80 HH TYR 80 110.271 -8.057 -5.827 575 H GLY 81 H GLY 81 103.655 -10.481 -1.717 576 HA2 GLY 81 1HA GLY 81 103.726 -7.923 -3.202 577 HA3 GLY 81 2HA GLY 81 102.170 -8.619 -2.742 578 H VAL 82 H VAL 82 103.496 -6.086 -1.850 579 HA VAL 82 HA VAL 82 103.399 -6.598 1.043 580 HB VAL 82 HB VAL 82 105.440 -5.255 1.395 581 HG11 VAL 82 1HG1 VAL 82 105.825 -7.620 -0.468 582 HG12 VAL 82 2HG1 VAL 82 105.552 -7.728 1.272 583 HG13 VAL 82 3HG1 VAL 82 107.027 -6.982 0.655 584 HG21 VAL 82 3HG2 VAL 82 106.897 -4.765 -0.532 585 HG22 VAL 82 1HG2 VAL 82 105.336 -3.967 -0.720 586 HG23 VAL 82 2HG2 VAL 82 105.690 -5.438 -1.627 587 H VAL 83 H VAL 83 103.047 -4.774 2.326 588 HA VAL 83 HA VAL 83 102.415 -2.246 0.951 589 HB VAL 83 HB VAL 83 100.273 -3.390 1.404 590 HG11 VAL 83 1HG1 VAL 83 101.125 -3.306 4.312 591 HG12 VAL 83 2HG1 VAL 83 101.085 -4.763 3.319 592 HG13 VAL 83 3HG1 VAL 83 99.588 -3.905 3.687 593 HG21 VAL 83 3HG2 VAL 83 100.569 -0.878 1.664 594 HG22 VAL 83 1HG2 VAL 83 100.678 -1.154 3.403 595 HG23 VAL 83 2HG2 VAL 83 99.199 -1.568 2.534 596 H GLY 84 H GLY 84 102.755 -0.369 2.340 597 HA2 GLY 84 1HA GLY 84 103.754 -0.743 5.021 598 HA3 GLY 84 2HA GLY 84 105.029 -0.398 3.860 599 H VAL 85 H VAL 85 105.152 1.424 5.514 600 HA VAL 85 HA VAL 85 103.618 3.722 4.503 601 HB VAL 85 HB VAL 85 102.451 2.949 6.533 602 HG11 VAL 85 1HG1 VAL 85 104.526 1.910 7.558 603 HG12 VAL 85 2HG1 VAL 85 103.537 2.853 8.673 604 HG13 VAL 85 3HG1 VAL 85 105.023 3.539 8.016 605 HG21 VAL 85 3HG2 VAL 85 102.588 5.373 6.019 606 HG22 VAL 85 1HG2 VAL 85 104.055 5.483 6.992 607 HG23 VAL 85 2HG2 VAL 85 102.519 5.076 7.756 608 H GLY 86 H GLY 86 104.783 5.638 4.503 609 HA2 GLY 86 1HA GLY 86 107.550 5.499 5.547 610 HA3 GLY 86 2HA GLY 86 107.238 6.022 3.896 611 H TYR 87 H TYR 87 108.542 7.515 5.945 612 HA TYR 87 HA TYR 87 106.672 9.791 6.242 613 HB2 TYR 87 1HB TYR 87 108.816 8.933 8.192 614 HB3 TYR 87 2HB TYR 87 107.791 10.346 8.348 615 HD1 TYR 87 HD1 TYR 87 105.310 10.038 8.700 616 HD2 TYR 87 HD2 TYR 87 108.096 6.773 8.867 617 HE1 TYR 87 HE1 TYR 87 103.627 8.663 9.896 618 HE2 TYR 87 HE2 TYR 87 106.414 5.398 10.063 619 HH TYR 87 HH TYR 87 104.369 5.882 11.549 620 H GLY 88 H GLY 88 107.538 11.815 5.873 621 HA2 GLY 88 1HA GLY 88 110.330 11.920 4.891 622 HA3 GLY 88 2HA GLY 88 109.009 12.683 4.013 623 H LYS 89 H LYS 89 111.503 13.670 5.461 624 HA LYS 89 HA LYS 89 110.165 15.825 6.990 625 HB2 LYS 89 1HB LYS 89 112.795 14.459 7.622 626 HB3 LYS 89 2HB LYS 89 112.184 15.895 8.442 627 HG2 LYS 89 1HG LYS 89 110.153 14.611 9.107 628 HG3 LYS 89 2HG LYS 89 110.856 13.170 8.369 629 HD2 LYS 89 1HD LYS 89 112.835 13.415 9.875 630 HD3 LYS 89 2HD LYS 89 112.024 14.764 10.668 631 HE2 LYS 89 1HE LYS 89 110.490 12.211 10.441 632 HE3 LYS 89 2HE LYS 89 111.832 12.250 11.583 633 HZ1 LYS 89 3HZ LYS 89 110.883 13.998 12.763 634 HZ2 LYS 89 1HZ LYS 89 109.568 12.982 12.421 635 HZ3 LYS 89 2HZ LYS 89 109.806 14.397 11.511 636 H PHE 90 H PHE 90 110.690 17.833 6.347 637 HA PHE 90 HA PHE 90 113.003 18.175 4.525 638 HB2 PHE 90 1HB PHE 90 110.787 18.469 3.441 639 HB3 PHE 90 2HB PHE 90 110.422 19.744 4.588 640 HD1 PHE 90 HD1 PHE 90 112.570 18.760 1.737 641 HD2 PHE 90 HD2 PHE 90 111.331 21.956 4.327 642 HE1 PHE 90 HE1 PHE 90 113.654 20.403 0.229 643 HE2 PHE 90 HE2 PHE 90 112.416 23.598 2.819 644 HZ PHE 90 HZ PHE 90 113.577 22.822 0.770 645 H GLN 91 H GLN 91 114.423 19.821 4.962 646 HA GLN 91 HA GLN 91 114.049 21.189 7.539 647 HB2 GLN 91 1HB GLN 91 116.488 20.843 5.781 648 HB3 GLN 91 2HB GLN 91 116.472 21.729 7.306 649 HG2 GLN 91 1HG GLN 91 115.785 19.717 8.509 650 HG3 GLN 91 2HG GLN 91 115.692 18.817 6.998 651 HE21 GLN 91 1HE2 GLN 91 117.413 17.986 9.131 652 HE22 GLN 91 2HE2 GLN 91 119.021 18.171 8.619 653 H THR 92 H THR 92 113.299 23.188 7.543 654 HA THR 92 HA THR 92 114.235 25.095 5.531 655 HB THR 92 HB THR 92 112.117 24.227 4.637 656 HG1 THR 92 HG1 THR 92 111.801 26.182 4.020 657 HG21 THR 92 3HG2 THR 92 111.022 25.131 7.312 658 HG22 THR 92 1HG2 THR 92 110.989 23.502 6.635 659 HG23 THR 92 2HG2 THR 92 110.008 24.777 5.913 660 H THR 93 H THR 93 113.648 27.373 6.158 661 HA THR 93 HA THR 93 113.656 27.654 9.093 662 HB THR 93 HB THR 93 115.442 28.825 7.858 663 HG1 THR 93 HG1 THR 93 113.441 30.378 9.108 664 HG21 THR 93 3HG2 THR 93 114.056 29.228 5.777 665 HG22 THR 93 1HG2 THR 93 114.971 30.626 6.338 666 HG23 THR 93 2HG2 THR 93 113.241 30.520 6.657 667 H GLU 94 H GLU 94 111.903 28.322 10.149 668 HA GLU 94 HA GLU 94 109.796 29.827 8.832 669 HB2 GLU 94 1HB GLU 94 109.315 26.998 9.795 670 HB3 GLU 94 2HB GLU 94 108.047 28.140 9.358 671 HG2 GLU 94 1HG GLU 94 109.056 28.304 7.071 672 HG3 GLU 94 2HG GLU 94 110.204 27.053 7.526 673 H TYR 95 H TYR 95 108.387 30.819 10.280 674 HA TYR 95 HA TYR 95 109.098 30.782 13.083 675 HB2 TYR 95 1HB TYR 95 108.237 32.795 11.780 676 HB3 TYR 95 2HB TYR 95 106.665 32.022 11.792 677 HD1 TYR 95 HD1 TYR 95 105.360 31.860 13.859 678 HD2 TYR 95 HD2 TYR 95 109.218 33.745 13.792 679 HE1 TYR 95 HE1 TYR 95 104.904 32.874 16.076 680 HE2 TYR 95 HE2 TYR 95 108.762 34.758 16.009 681 HH TYR 95 HH TYR 95 106.882 35.346 17.407 682 HA PRO 96 HA PRO 96 107.032 27.115 13.901 683 HB2 PRO 96 1HB PRO 96 105.839 28.155 16.420 684 HB3 PRO 96 2HB PRO 96 106.932 26.783 16.164 685 HG2 PRO 96 1HG PRO 96 107.748 29.083 17.256 686 HG3 PRO 96 2HG PRO 96 108.801 28.076 16.249 687 HD2 PRO 96 1HD PRO 96 107.486 30.663 15.585 688 HD3 PRO 96 2HD PRO 96 109.011 29.974 14.989 689 H THR 97 H THR 97 105.273 26.209 13.162 690 HA THR 97 HA THR 97 102.665 27.585 13.368 691 HB THR 97 HB THR 97 103.562 25.632 11.231 692 HG1 THR 97 HG1 THR 97 103.265 27.734 10.013 693 HG21 THR 97 3HG2 THR 97 101.033 27.142 11.818 694 HG22 THR 97 1HG2 THR 97 101.236 25.463 11.318 695 HG23 THR 97 2HG2 THR 97 101.457 26.764 10.149 696 H TYR 98 H TYR 98 100.804 26.175 13.714 697 HA TYR 98 HA TYR 98 101.522 23.668 15.082 698 HB2 TYR 98 1HB TYR 98 99.990 25.265 16.206 699 HB3 TYR 98 2HB TYR 98 98.861 25.088 14.878 700 HD1 TYR 98 HD1 TYR 98 100.438 23.388 17.759 701 HD2 TYR 98 HD2 TYR 98 97.438 23.149 14.695 702 HE1 TYR 98 HE1 TYR 98 99.423 21.435 18.904 703 HE2 TYR 98 HE2 TYR 98 96.423 21.198 15.840 704 HH TYR 98 HH TYR 98 97.984 19.452 18.227 705 H LYS 99 H LYS 99 101.388 21.810 14.040 706 HA LYS 99 HA LYS 99 99.810 21.675 11.538 707 HB2 LYS 99 1HB LYS 99 102.352 20.230 12.315 708 HB3 LYS 99 2HB LYS 99 101.443 19.945 10.830 709 HG2 LYS 99 1HG LYS 99 101.789 22.242 10.115 710 HG3 LYS 99 2HG LYS 99 102.565 22.639 11.648 711 HD2 LYS 99 1HD LYS 99 104.320 22.271 10.042 712 HD3 LYS 99 2HD LYS 99 104.302 20.879 11.123 713 HE2 LYS 99 1HE LYS 99 104.490 20.200 8.742 714 HE3 LYS 99 2HE LYS 99 103.013 19.589 9.485 715 HZ1 LYS 99 3HZ LYS 99 103.101 20.959 7.181 716 HZ2 LYS 99 1HZ LYS 99 102.774 22.207 8.284 717 HZ3 LYS 99 2HZ LYS 99 101.735 20.867 8.188 718 H HIS 100 H HIS 100 98.755 19.699 11.034 719 HA HIS 100 HA HIS 100 97.511 18.292 13.115 720 HB2 HIS 100 1HB HIS 100 96.717 18.337 10.771 721 HB3 HIS 100 2HB HIS 100 98.081 17.339 10.305 722 HD1 HIS 100 HD1 HIS 100 95.169 17.146 12.771 723 HD2 HIS 100 HD2 HIS 100 97.433 14.664 10.302 724 HE1 HIS 100 HE1 HIS 100 94.159 14.832 12.964 725 H ASP 101 H ASP 101 100.437 17.547 11.247 726 HA ASP 101 HA ASP 101 101.320 15.823 13.446 727 HB2 ASP 101 1HB ASP 101 102.077 14.083 11.866 728 HB3 ASP 101 2HB ASP 101 100.328 14.269 11.859 729 H THR 102 H THR 102 103.611 15.506 13.509 730 HA THR 102 HA THR 102 105.071 17.847 12.848 731 HB THR 102 HB THR 102 106.164 15.142 13.652 732 HG1 THR 102 HG1 THR 102 104.857 15.655 15.273 733 HG21 THR 102 3HG2 THR 102 108.049 16.439 14.496 734 HG22 THR 102 1HG2 THR 102 107.261 17.943 14.020 735 HG23 THR 102 2HG2 THR 102 107.809 16.806 12.788 736 H SER 103 H SER 103 104.885 14.636 11.380 737 HA SER 103 HA SER 103 106.589 15.601 9.153 738 HB2 SER 103 1HB SER 103 106.438 12.803 10.298 739 HB3 SER 103 2HB SER 103 107.397 13.295 8.907 740 HG SER 103 HG SER 103 108.247 14.938 10.510 741 H ASP 104 H ASP 104 106.196 14.468 7.085 742 HA ASP 104 HA ASP 104 103.297 14.078 6.720 743 HB2 ASP 104 1HB ASP 104 105.500 14.469 4.676 744 HB3 ASP 104 2HB ASP 104 103.776 14.366 4.323 745 H TYR 105 H TYR 105 102.473 12.195 5.703 746 HA TYR 105 HA TYR 105 104.385 9.958 5.419 747 HB2 TYR 105 1HB TYR 105 102.985 8.491 6.682 748 HB3 TYR 105 2HB TYR 105 103.333 9.901 7.660 749 HD1 TYR 105 HD1 TYR 105 100.749 8.039 5.826 750 HD2 TYR 105 HD2 TYR 105 101.572 11.504 8.228 751 HE1 TYR 105 HE1 TYR 105 98.317 8.369 6.184 752 HE2 TYR 105 HE2 TYR 105 99.139 11.834 8.585 753 HH TYR 105 HH TYR 105 97.090 10.622 8.504 754 H GLY 106 H GLY 106 103.664 8.205 4.154 755 HA2 GLY 106 1HA GLY 106 101.223 8.562 2.566 756 HA3 GLY 106 2HA GLY 106 102.755 8.497 1.698 757 H PHE 107 H PHE 107 100.949 6.610 1.066 758 HA PHE 107 HA PHE 107 101.746 4.174 2.569 759 HB2 PHE 107 1HB PHE 107 99.246 4.710 0.962 760 HB3 PHE 107 2HB PHE 107 99.652 3.179 1.714 761 HD1 PHE 107 HD1 PHE 107 99.686 2.975 4.196 762 HD2 PHE 107 HD2 PHE 107 98.366 6.553 2.219 763 HE1 PHE 107 HE1 PHE 107 98.605 3.736 6.294 764 HE2 PHE 107 HE2 PHE 107 97.285 7.314 4.317 765 HZ PHE 107 HZ PHE 107 97.405 5.905 6.355 766 H SER 108 H SER 108 102.402 2.339 1.401 767 HA SER 108 HA SER 108 102.737 2.704 -1.518 768 HB2 SER 108 1HB SER 108 104.861 3.292 -0.415 769 HB3 SER 108 2HB SER 108 104.869 1.729 0.395 770 HG SER 108 HG SER 108 105.322 2.393 -2.277 771 H TYR 109 H TYR 109 102.583 0.879 -2.744 772 HA TYR 109 HA TYR 109 102.493 -1.748 -1.447 773 HB2 TYR 109 1HB TYR 109 100.161 -0.956 -1.456 774 HB3 TYR 109 2HB TYR 109 100.263 -0.677 -3.184 775 HD1 TYR 109 HD1 TYR 109 100.185 -3.254 -0.534 776 HD2 TYR 109 HD2 TYR 109 100.085 -2.494 -4.759 777 HE1 TYR 109 HE1 TYR 109 99.470 -5.595 -0.937 778 HE2 TYR 109 HE2 TYR 109 99.371 -4.834 -5.163 779 HH TYR 109 HH TYR 109 98.146 -6.645 -3.783 780 H GLY 110 H GLY 110 102.950 -3.479 -2.898 781 HA2 GLY 110 1HA GLY 110 103.016 -3.166 -5.724 782 HA3 GLY 110 2HA GLY 110 104.632 -2.939 -5.068 783 H ALA 111 H ALA 111 104.545 -4.926 -6.725 784 HA ALA 111 HA ALA 111 104.774 -7.302 -5.026 785 HB1 ALA 111 1HB ALA 111 102.961 -7.034 -7.409 786 HB2 ALA 111 2HB ALA 111 102.633 -7.772 -5.842 787 HB3 ALA 111 3HB ALA 111 103.675 -8.595 -7.002 788 H GLY 112 H GLY 112 106.118 -8.965 -5.986 789 HA2 GLY 112 1HA GLY 112 107.687 -8.150 -8.326 790 HA3 GLY 112 2HA GLY 112 108.547 -8.323 -6.801 791 H LEU 113 H LEU 113 109.308 -9.822 -8.914 792 HA LEU 113 HA LEU 113 108.468 -12.554 -8.163 793 HB2 LEU 113 1HB LEU 113 109.091 -11.600 -10.971 794 HB3 LEU 113 2HB LEU 113 108.657 -13.243 -10.502 795 HG LEU 113 HG LEU 113 106.877 -10.822 -10.086 796 HD11 LEU 113 1HD1 LEU 113 106.806 -13.004 -12.195 797 HD12 LEU 113 2HD1 LEU 113 107.146 -11.297 -12.477 798 HD13 LEU 113 3HD1 LEU 113 105.541 -11.801 -11.946 799 HD21 LEU 113 3HD2 LEU 113 106.487 -13.810 -9.742 800 HD22 LEU 113 1HD2 LEU 113 105.158 -12.650 -9.745 801 HD23 LEU 113 2HD2 LEU 113 106.394 -12.573 -8.490 802 H GLN 114 H GLN 114 110.140 -14.165 -8.423 803 HA GLN 114 HA GLN 114 112.873 -13.048 -8.701 804 HB2 GLN 114 1HB GLN 114 113.628 -14.620 -6.994 805 HB3 GLN 114 2HB GLN 114 112.364 -13.577 -6.348 806 HG2 GLN 114 1HG GLN 114 110.696 -15.361 -6.756 807 HG3 GLN 114 2HG GLN 114 111.976 -16.408 -7.368 808 HE21 GLN 114 1HE2 GLN 114 113.341 -17.460 -5.831 809 HE22 GLN 114 2HE2 GLN 114 113.129 -17.309 -4.154 810 H PHE 115 H PHE 115 114.339 -14.214 -9.872 811 HA PHE 115 HA PHE 115 113.415 -16.753 -11.072 812 HB2 PHE 115 1HB PHE 115 114.572 -14.365 -12.497 813 HB3 PHE 115 2HB PHE 115 114.507 -15.967 -13.208 814 HD1 PHE 115 HD1 PHE 115 112.555 -13.034 -12.147 815 HD2 PHE 115 HD2 PHE 115 112.380 -16.961 -13.880 816 HE1 PHE 115 HE1 PHE 115 110.233 -12.599 -12.902 817 HE2 PHE 115 HE2 PHE 115 110.059 -16.526 -14.635 818 HZ PHE 115 HZ PHE 115 108.984 -14.344 -14.144 819 H ASN 116 H ASN 116 115.124 -18.063 -11.964 820 HA ASN 116 HA ASN 116 117.142 -19.120 -11.907 821 HB2 ASN 116 1HB ASN 116 117.910 -16.635 -12.381 822 HB3 ASN 116 2HB ASN 116 118.534 -16.748 -10.737 823 HD21 ASN 116 1HD2 ASN 116 120.388 -18.082 -10.369 824 HD22 ASN 116 2HD2 ASN 116 121.204 -18.887 -11.621 825 HA PRO 117 HA PRO 117 116.893 -19.590 -7.320 826 HB2 PRO 117 1HB PRO 117 115.176 -21.643 -7.059 827 HB3 PRO 117 2HB PRO 117 114.604 -19.979 -7.290 828 HG2 PRO 117 1HG PRO 117 114.676 -22.230 -9.200 829 HG3 PRO 117 2HG PRO 117 113.542 -20.874 -9.085 830 HD2 PRO 117 1HD PRO 117 115.741 -21.088 -10.867 831 HD3 PRO 117 2HD PRO 117 114.737 -19.651 -10.582 832 H MET 118 H MET 118 117.312 -21.899 -9.927 833 HA MET 118 HA MET 118 118.196 -24.148 -8.529 834 HB2 MET 118 1HB MET 118 119.054 -23.112 -11.240 835 HB3 MET 118 2HB MET 118 119.395 -24.731 -10.628 836 HG2 MET 118 1HG MET 118 116.920 -25.061 -10.320 837 HG3 MET 118 2HG MET 118 116.666 -23.518 -11.135 838 HE1 MET 118 3HE MET 118 119.327 -26.538 -11.962 839 HE2 MET 118 1HE MET 118 118.083 -27.506 -12.763 840 HE3 MET 118 2HE MET 118 117.857 -26.978 -11.097 841 H GLU 119 H GLU 119 119.949 -21.224 -9.460 842 HA GLU 119 HA GLU 119 122.446 -22.308 -8.376 843 HB2 GLU 119 1HB GLU 119 121.844 -19.661 -9.718 844 HB3 GLU 119 2HB GLU 119 123.444 -20.211 -9.221 845 HG2 GLU 119 1HG GLU 119 121.643 -21.638 -11.198 846 HG3 GLU 119 2HG GLU 119 123.027 -20.640 -11.628 847 H ASN 120 H ASN 120 123.739 -20.600 -7.044 848 HA ASN 120 HA ASN 120 122.142 -20.041 -4.698 849 HB2 ASN 120 1HB ASN 120 125.064 -19.515 -5.259 850 HB3 ASN 120 2HB ASN 120 124.279 -19.374 -3.687 851 HD21 ASN 120 1HD2 ASN 120 126.402 -21.343 -4.836 852 HD22 ASN 120 2HD2 ASN 120 125.785 -22.866 -4.412 853 H VAL 121 H VAL 121 122.469 -18.268 -7.468 854 HA VAL 121 HA VAL 121 122.102 -15.731 -5.981 855 HB VAL 121 HB VAL 121 123.332 -16.055 -8.734 856 HG11 VAL 121 1HG1 VAL 121 122.166 -13.945 -8.534 857 HG12 VAL 121 2HG1 VAL 121 123.892 -13.625 -8.362 858 HG13 VAL 121 3HG1 VAL 121 122.855 -13.662 -6.936 859 HG21 VAL 121 3HG2 VAL 121 125.419 -15.301 -7.608 860 HG22 VAL 121 1HG2 VAL 121 124.859 -16.853 -6.985 861 HG23 VAL 121 2HG2 VAL 121 124.589 -15.379 -6.054 862 H ALA 122 H ALA 122 120.257 -14.657 -6.412 863 HA ALA 122 HA ALA 122 118.665 -15.468 -8.773 864 HB1 ALA 122 1HB ALA 122 117.751 -16.606 -6.797 865 HB2 ALA 122 2HB ALA 122 116.632 -15.375 -7.385 866 HB3 ALA 122 3HB ALA 122 117.621 -15.060 -5.959 867 H LEU 123 H LEU 123 117.164 -13.867 -9.509 868 HA LEU 123 HA LEU 123 117.978 -11.113 -8.762 869 HB2 LEU 123 1HB LEU 123 116.978 -12.187 -11.412 870 HB3 LEU 123 2HB LEU 123 117.295 -10.488 -11.067 871 HG LEU 123 HG LEU 123 119.658 -11.392 -10.316 872 HD11 LEU 123 1HD1 LEU 123 120.204 -13.292 -12.050 873 HD12 LEU 123 2HD1 LEU 123 118.473 -13.617 -11.952 874 HD13 LEU 123 3HD1 LEU 123 119.472 -13.714 -10.502 875 HD21 LEU 123 3HD2 LEU 123 119.154 -11.432 -13.283 876 HD22 LEU 123 1HD2 LEU 123 120.495 -10.708 -12.397 877 HD23 LEU 123 2HD2 LEU 123 118.905 -9.945 -12.369 878 H ASP 124 H ASP 124 116.363 -9.591 -8.385 879 HA ASP 124 HA ASP 124 113.574 -10.592 -8.454 880 HB2 ASP 124 1HB ASP 124 114.880 -9.063 -6.191 881 HB3 ASP 124 2HB ASP 124 113.183 -9.524 -6.277 882 H PHE 125 H PHE 125 112.076 -9.147 -9.123 883 HA PHE 125 HA PHE 125 112.791 -6.295 -9.198 884 HB2 PHE 125 1HB PHE 125 111.950 -6.065 -11.481 885 HB3 PHE 125 2HB PHE 125 113.337 -7.135 -11.419 886 HD1 PHE 125 HD1 PHE 125 113.060 -9.570 -11.741 887 HD2 PHE 125 HD2 PHE 125 109.754 -6.851 -12.101 888 HE1 PHE 125 HE1 PHE 125 111.744 -11.324 -12.896 889 HE2 PHE 125 HE2 PHE 125 108.436 -8.607 -13.256 890 HZ PHE 125 HZ PHE 125 109.431 -10.844 -13.653 891 H SER 126 H SER 126 111.028 -4.912 -8.997 892 HA SER 126 HA SER 126 108.365 -6.128 -8.748 893 HB2 SER 126 1HB SER 126 109.302 -6.261 -6.499 894 HB3 SER 126 2HB SER 126 109.738 -4.557 -6.555 895 HG SER 126 HG SER 126 107.802 -4.519 -5.597 896 H TYR 127 H TYR 127 106.645 -4.658 -8.926 897 HA TYR 127 HA TYR 127 107.381 -1.961 -9.887 898 HB2 TYR 127 1HB TYR 127 104.794 -3.497 -10.196 899 HB3 TYR 127 2HB TYR 127 105.131 -1.911 -10.863 900 HD1 TYR 127 HD1 TYR 127 106.896 -1.673 -12.652 901 HD2 TYR 127 HD2 TYR 127 105.485 -5.492 -11.282 902 HE1 TYR 127 HE1 TYR 127 107.815 -2.745 -14.691 903 HE2 TYR 127 HE2 TYR 127 106.403 -6.563 -13.321 904 HH TYR 127 HH TYR 127 108.544 -5.676 -15.057 905 H GLU 128 H GLU 128 107.202 -0.410 -8.407 906 HA GLU 128 HA GLU 128 105.299 -0.790 -6.166 907 HB2 GLU 128 1HB GLU 128 107.731 -0.828 -5.582 908 HB3 GLU 128 2HB GLU 128 107.855 0.827 -6.177 909 HG2 GLU 128 1HG GLU 128 106.088 1.506 -4.560 910 HG3 GLU 128 2HG GLU 128 106.068 -0.134 -3.926 911 H GLN 129 H GLN 129 103.860 0.769 -5.712 912 HA GLN 129 HA GLN 129 104.174 3.414 -6.982 913 HB2 GLN 129 1HB GLN 129 101.777 3.469 -7.478 914 HB3 GLN 129 2HB GLN 129 102.542 2.109 -8.297 915 HG2 GLN 129 1HG GLN 129 101.786 0.604 -6.479 916 HG3 GLN 129 2HG GLN 129 100.990 1.967 -5.695 917 HE21 GLN 129 1HE2 GLN 129 98.951 2.651 -6.530 918 HE22 GLN 129 2HE2 GLN 129 98.177 1.877 -7.827 919 H SER 130 H SER 130 103.578 5.135 -5.708 920 HA SER 130 HA SER 130 102.488 4.522 -3.027 921 HB2 SER 130 1HB SER 130 104.850 6.323 -3.607 922 HB3 SER 130 2HB SER 130 104.108 6.070 -2.032 923 HG SER 130 HG SER 130 105.825 4.672 -2.193 924 H ARG 131 H ARG 131 101.252 6.107 -2.094 925 HA ARG 131 HA ARG 131 100.603 8.458 -3.779 926 HB2 ARG 131 1HB ARG 131 98.831 6.909 -1.869 927 HB3 ARG 131 2HB ARG 131 98.366 8.390 -2.708 928 HG2 ARG 131 1HG ARG 131 98.736 7.287 -4.880 929 HG3 ARG 131 2HG ARG 131 99.212 5.806 -4.049 930 HD2 ARG 131 1HD ARG 131 96.907 5.555 -4.681 931 HD3 ARG 131 2HD ARG 131 96.946 5.799 -2.940 932 HE ARG 131 HE ARG 131 95.965 7.680 -4.958 933 HH11 ARG 131 1HH1 ARG 131 96.745 7.156 -1.571 934 HH12 ARG 131 2HH1 ARG 131 95.748 8.467 -1.042 935 HH21 ARG 131 1HH2 ARG 131 94.706 9.356 -4.209 936 HH22 ARG 131 2HH2 ARG 131 94.612 9.697 -2.514 937 H ILE 132 H ILE 132 101.164 10.342 -2.917 938 HA ILE 132 HA ILE 132 101.421 10.580 0.016 939 HB ILE 132 HB ILE 132 103.367 11.707 -2.024 940 HG12 ILE 132 1HG1 ILE 132 103.796 9.545 0.062 941 HG13 ILE 132 2HG1 ILE 132 103.546 9.228 -1.655 942 HG21 ILE 132 1HG2 ILE 132 102.918 13.060 0.073 943 HG22 ILE 132 2HG2 ILE 132 104.592 12.539 -0.124 944 HG23 ILE 132 3HG2 ILE 132 103.531 11.690 1.001 945 HD11 ILE 132 3HD1 ILE 132 105.522 10.741 -2.123 946 HD12 ILE 132 1HD1 ILE 132 105.923 9.240 -1.287 947 HD13 ILE 132 2HD1 ILE 132 105.832 10.754 -0.386 948 H ARG 133 H ARG 133 99.620 11.794 0.298 949 HA ARG 133 HA ARG 133 97.734 12.903 -0.628 950 HB2 ARG 133 1HB ARG 133 98.797 14.064 1.302 951 HB3 ARG 133 2HB ARG 133 99.665 15.085 0.156 952 HG2 ARG 133 1HG ARG 133 97.542 15.891 -0.771 953 HG3 ARG 133 2HG ARG 133 96.647 14.831 0.319 954 HD2 ARG 133 1HD ARG 133 96.664 17.025 1.311 955 HD3 ARG 133 2HD ARG 133 97.758 16.014 2.249 956 HE ARG 133 HE ARG 133 99.462 17.112 0.510 957 HH11 ARG 133 1HH1 ARG 133 96.907 18.642 2.368 958 HH12 ARG 133 2HH1 ARG 133 97.730 20.165 2.434 959 HH21 ARG 133 1HH2 ARG 133 100.475 19.097 0.631 960 HH22 ARG 133 2HH2 ARG 133 99.725 20.418 1.463 961 H SER 134 H SER 134 97.636 12.554 -2.881 962 HA SER 134 HA SER 134 96.952 13.503 -4.846 963 HB2 SER 134 1HB SER 134 96.748 15.790 -5.131 964 HB3 SER 134 2HB SER 134 96.702 15.624 -3.383 965 HG SER 134 HG SER 134 98.178 17.198 -3.799 966 H VAL 135 H VAL 135 100.209 13.299 -3.857 967 HA VAL 135 HA VAL 135 101.145 13.817 -6.608 968 HB VAL 135 HB VAL 135 102.753 13.351 -4.080 969 HG11 VAL 135 1HG1 VAL 135 103.873 12.741 -6.233 970 HG12 VAL 135 2HG1 VAL 135 104.647 14.102 -5.419 971 HG13 VAL 135 3HG1 VAL 135 103.592 14.387 -6.805 972 HG21 VAL 135 3HG2 VAL 135 102.134 15.917 -5.579 973 HG22 VAL 135 1HG2 VAL 135 103.200 15.776 -4.181 974 HG23 VAL 135 2HG2 VAL 135 101.472 15.469 -4.008 975 H ASP 136 H ASP 136 101.812 12.155 -7.883 976 HA ASP 136 HA ASP 136 101.508 9.436 -6.746 977 HB2 ASP 136 1HB ASP 136 100.007 10.033 -8.630 978 HB3 ASP 136 2HB ASP 136 101.422 10.305 -9.642 979 H VAL 137 H VAL 137 103.303 8.270 -6.433 980 HA VAL 137 HA VAL 137 105.750 9.034 -7.932 981 HB VAL 137 HB VAL 137 105.555 7.703 -5.217 982 HG11 VAL 137 1HG1 VAL 137 108.008 8.338 -5.169 983 HG12 VAL 137 2HG1 VAL 137 107.869 8.724 -6.884 984 HG13 VAL 137 3HG1 VAL 137 107.597 7.073 -6.326 985 HG21 VAL 137 3HG2 VAL 137 104.801 10.040 -5.115 986 HG22 VAL 137 1HG2 VAL 137 106.242 10.557 -5.989 987 HG23 VAL 137 2HG2 VAL 137 106.389 9.884 -4.366 988 H GLY 138 H GLY 138 106.708 7.527 -9.156 989 HA2 GLY 138 1HA GLY 138 105.771 4.718 -8.922 990 HA3 GLY 138 2HA GLY 138 106.107 5.493 -10.470 991 H THR 139 H THR 139 107.357 3.288 -8.487 992 HA THR 139 HA THR 139 110.160 4.076 -9.044 993 HB THR 139 HB THR 139 109.163 2.678 -6.553 994 HG1 THR 139 HG1 THR 139 109.745 5.352 -7.181 995 HG21 THR 139 3HG2 THR 139 111.365 1.995 -6.742 996 HG22 THR 139 1HG2 THR 139 111.587 3.524 -5.892 997 HG23 THR 139 2HG2 THR 139 111.850 3.439 -7.634 998 H TRP 140 H TRP 140 111.347 2.592 -10.043 999 HA TRP 140 HA TRP 140 110.365 -0.200 -10.145 1000 HB2 TRP 140 1HB TRP 140 112.248 1.289 -11.985 1001 HB3 TRP 140 2HB TRP 140 111.837 -0.409 -12.132 1002 HD1 TRP 140 HD1 TRP 140 109.132 -0.902 -12.574 1003 HE1 TRP 140 HE1 TRP 140 107.496 0.426 -14.055 1004 HE3 TRP 140 HE3 TRP 140 111.650 3.526 -12.913 1005 HZ2 TRP 140 HZ2 TRP 140 107.282 3.030 -15.232 1006 HZ3 TRP 140 HZ3 TRP 140 110.712 5.409 -14.216 1007 HH2 TRP 140 HH2 TRP 140 108.535 5.170 -15.375 1008 H ILE 141 H ILE 141 111.574 -1.746 -9.176 1009 HA ILE 141 HA ILE 141 114.278 -0.988 -8.220 1010 HB ILE 141 HB ILE 141 112.625 -0.827 -6.404 1011 HG12 ILE 141 1HG1 ILE 141 114.278 -3.316 -5.963 1012 HG13 ILE 141 2HG1 ILE 141 115.022 -1.723 -6.097 1013 HG21 ILE 141 1HG2 ILE 141 112.200 -3.802 -6.730 1014 HG22 ILE 141 2HG2 ILE 141 111.108 -2.609 -7.432 1015 HG23 ILE 141 3HG2 ILE 141 111.323 -2.686 -5.683 1016 HD11 ILE 141 3HD1 ILE 141 114.683 -1.869 -3.798 1017 HD12 ILE 141 1HD1 ILE 141 113.183 -2.779 -3.974 1018 HD13 ILE 141 2HD1 ILE 141 113.209 -1.048 -4.310 1019 H ALA 142 H ALA 142 115.844 -2.429 -8.496 1020 HA ALA 142 HA ALA 142 115.146 -5.257 -8.956 1021 HB1 ALA 142 1HB ALA 142 117.179 -3.749 -10.617 1022 HB2 ALA 142 2HB ALA 142 115.546 -4.129 -11.163 1023 HB3 ALA 142 3HB ALA 142 116.685 -5.430 -10.814 1024 H GLY 143 H GLY 143 116.680 -6.727 -8.156 1025 HA2 GLY 143 1HA GLY 143 119.209 -5.766 -7.106 1026 HA3 GLY 143 2HA GLY 143 118.025 -6.174 -5.871 1027 H VAL 144 H VAL 144 120.019 -7.640 -5.488 1028 HA VAL 144 HA VAL 144 119.497 -10.241 -6.769 1029 HB VAL 144 HB VAL 144 121.465 -9.253 -7.876 1030 HG11 VAL 144 1HG1 VAL 144 123.528 -8.869 -6.561 1031 HG12 VAL 144 2HG1 VAL 144 122.633 -9.200 -5.078 1032 HG13 VAL 144 3HG1 VAL 144 122.227 -7.791 -6.057 1033 HG21 VAL 144 3HG2 VAL 144 122.924 -11.144 -7.611 1034 HG22 VAL 144 1HG2 VAL 144 121.279 -11.731 -7.372 1035 HG23 VAL 144 2HG2 VAL 144 122.327 -11.451 -5.980 1036 H GLY 145 H GLY 145 119.855 -12.033 -5.421 1037 HA2 GLY 145 1HA GLY 145 120.610 -11.465 -2.627 1038 HA3 GLY 145 2HA GLY 145 119.052 -12.213 -2.958 1039 H TYR 146 H TYR 146 120.917 -13.440 -1.355 1040 HA TYR 146 HA TYR 146 121.520 -15.843 -2.943 1041 HB2 TYR 146 1HB TYR 146 123.669 -16.110 -1.904 1042 HB3 TYR 146 2HB TYR 146 123.604 -14.530 -2.657 1043 HD1 TYR 146 HD1 TYR 146 123.406 -12.484 -1.252 1044 HD2 TYR 146 HD2 TYR 146 123.905 -16.388 0.467 1045 HE1 TYR 146 HE1 TYR 146 124.058 -11.450 0.906 1046 HE2 TYR 146 HE2 TYR 146 124.557 -15.355 2.626 1047 HH TYR 146 HH TYR 146 125.654 -12.572 3.071 1048 H ARG 147 H ARG 147 121.219 -17.775 -1.842 1049 HA ARG 147 HA ARG 147 120.027 -17.526 0.861 1050 HB2 ARG 147 1HB ARG 147 118.537 -19.355 0.282 1051 HB3 ARG 147 2HB ARG 147 118.366 -18.052 -0.891 1052 HG2 ARG 147 1HG ARG 147 119.980 -19.292 -2.383 1053 HG3 ARG 147 2HG ARG 147 119.901 -20.641 -1.248 1054 HD2 ARG 147 1HD ARG 147 117.420 -20.691 -1.554 1055 HD3 ARG 147 2HD ARG 147 117.581 -19.440 -2.784 1056 HE ARG 147 HE ARG 147 119.262 -21.318 -3.712 1057 HH11 ARG 147 1HH1 ARG 147 115.971 -21.624 -2.527 1058 HH12 ARG 147 2HH1 ARG 147 115.628 -22.989 -3.536 1059 HH21 ARG 147 1HH2 ARG 147 118.763 -23.079 -4.987 1060 HH22 ARG 147 2HH2 ARG 147 117.190 -23.801 -4.912 1061 H PHE 148 H PHE 148 120.555 -19.002 2.398 1062 HA PHE 148 HA PHE 148 122.142 -21.341 1.808 1063 HB2 PHE 148 1HB PHE 148 123.831 -19.531 1.718 1064 HB3 PHE 148 2HB PHE 148 123.401 -19.075 3.356 1065 HD1 PHE 148 HD1 PHE 148 124.951 -21.694 1.251 1066 HD2 PHE 148 HD2 PHE 148 124.195 -20.328 5.253 1067 HE1 PHE 148 HE1 PHE 148 126.588 -23.340 2.122 1068 HE2 PHE 148 HE2 PHE 148 125.833 -21.974 6.124 1069 HZ PHE 148 HZ PHE 148 127.030 -23.480 4.559 Start of MODEL 14 1 H1 ALA 1 3H ALA 1 115.874 -24.947 7.943 2 H2 ALA 1 2H ALA 1 116.448 -25.148 9.529 3 H3 ALA 1 HT3 ALA 1 117.542 -25.029 8.234 4 HA ALA 1 HA ALA 1 115.665 -22.832 8.800 5 HB1 ALA 1 2HB ALA 1 117.023 -21.923 10.458 6 HB2 ALA 1 3HB ALA 1 118.438 -22.843 9.946 7 HB3 ALA 1 1HB ALA 1 117.140 -23.642 10.835 8 H THR 2 H THR 2 115.742 -21.807 6.893 9 HA THR 2 HA THR 2 118.389 -21.388 5.620 10 HB THR 2 HB THR 2 117.260 -21.390 3.453 11 HG1 THR 2 HG1 THR 2 115.237 -20.803 3.713 12 HG21 THR 2 3HG2 THR 2 116.556 -23.791 3.417 13 HG22 THR 2 1HG2 THR 2 116.634 -23.800 5.179 14 HG23 THR 2 2HG2 THR 2 118.098 -23.531 4.234 15 H SER 3 H SER 3 118.869 -19.341 4.937 16 HA SER 3 HA SER 3 116.839 -17.236 5.415 17 HB2 SER 3 1HB SER 3 118.519 -17.298 7.250 18 HB3 SER 3 2HB SER 3 119.793 -17.059 6.058 19 HG SER 3 HG SER 3 118.097 -15.267 7.183 20 H THR 4 H THR 4 116.770 -15.596 3.938 21 HA THR 4 HA THR 4 118.728 -15.664 1.718 22 HB THR 4 HB THR 4 115.753 -15.171 1.441 23 HG1 THR 4 HG1 THR 4 116.371 -17.362 1.932 24 HG21 THR 4 3HG2 THR 4 116.215 -15.232 -0.946 25 HG22 THR 4 1HG2 THR 4 117.912 -15.602 -0.642 26 HG23 THR 4 2HG2 THR 4 117.259 -14.025 -0.195 27 H VAL 5 H VAL 5 119.565 -13.722 1.166 28 HA VAL 5 HA VAL 5 118.259 -11.290 2.260 29 HB VAL 5 HB VAL 5 120.236 -11.878 3.611 30 HG11 VAL 5 1HG1 VAL 5 121.790 -11.531 1.032 31 HG12 VAL 5 2HG1 VAL 5 121.470 -13.081 1.809 32 HG13 VAL 5 3HG1 VAL 5 122.465 -11.874 2.625 33 HG21 VAL 5 3HG2 VAL 5 119.702 -9.520 3.349 34 HG22 VAL 5 1HG2 VAL 5 120.558 -9.462 1.808 35 HG23 VAL 5 2HG2 VAL 5 121.455 -9.712 3.306 36 H THR 6 H THR 6 118.023 -9.641 0.855 37 HA THR 6 HA THR 6 119.412 -9.799 -1.749 38 HB THR 6 HB THR 6 116.510 -9.019 -1.531 39 HG1 THR 6 HG1 THR 6 117.691 -11.558 -1.651 40 HG21 THR 6 3HG2 THR 6 116.517 -9.087 -3.830 41 HG22 THR 6 1HG2 THR 6 117.761 -10.332 -3.896 42 HG23 THR 6 2HG2 THR 6 118.207 -8.657 -3.571 43 H GLY 7 H GLY 7 119.851 -7.819 -2.720 44 HA2 GLY 7 1HA GLY 7 118.930 -5.383 -1.322 45 HA3 GLY 7 2HA GLY 7 120.642 -5.586 -1.698 46 H GLY 8 H GLY 8 118.780 -3.530 -2.710 47 HA2 GLY 8 1HA GLY 8 119.330 -3.878 -5.548 48 HA3 GLY 8 2HA GLY 8 117.625 -3.858 -5.122 49 H TYR 9 H TYR 9 118.475 -2.013 -6.825 50 HA TYR 9 HA TYR 9 118.541 0.496 -5.246 51 HB2 TYR 9 1HB TYR 9 120.623 0.113 -6.539 52 HB3 TYR 9 2HB TYR 9 119.672 0.014 -8.007 53 HD1 TYR 9 HD2 TYR 9 121.004 2.230 -5.395 54 HD2 TYR 9 HD1 TYR 9 118.672 2.017 -8.997 55 HE1 TYR 9 HE2 TYR 9 121.168 4.692 -5.647 56 HE2 TYR 9 HE1 TYR 9 118.836 4.480 -9.248 57 HH TYR 9 HH TYR 9 119.313 6.419 -8.056 58 H ALA 10 H ALA 10 117.088 2.094 -5.837 59 HA ALA 10 HA ALA 10 115.336 1.568 -8.147 60 HB1 ALA 10 1HB ALA 10 114.104 2.505 -5.585 61 HB2 ALA 10 2HB ALA 10 114.414 0.784 -5.813 62 HB3 ALA 10 3HB ALA 10 113.363 1.648 -6.937 63 H GLN 11 H GLN 11 114.408 3.376 -9.076 64 HA GLN 11 HA GLN 11 115.275 6.008 -8.026 65 HB2 GLN 11 1HB GLN 11 114.759 5.146 -10.885 66 HB3 GLN 11 2HB GLN 11 115.113 6.799 -10.380 67 HG2 GLN 11 1HG GLN 11 117.283 6.100 -9.497 68 HG3 GLN 11 2HG GLN 11 116.931 4.422 -9.901 69 HE21 GLN 11 1HE2 GLN 11 119.212 5.790 -10.981 70 HE22 GLN 11 2HE2 GLN 11 118.982 5.962 -12.654 71 H SER 12 H SER 12 113.696 7.631 -7.862 72 HA SER 12 HA SER 12 110.912 6.661 -8.220 73 HB2 SER 12 1HB SER 12 111.544 6.842 -5.855 74 HB3 SER 12 2HB SER 12 112.046 8.510 -6.109 75 HG SER 12 HG SER 12 109.953 8.533 -5.354 76 H ASP 13 H ASP 13 109.606 7.852 -9.437 77 HA ASP 13 HA ASP 13 110.480 10.560 -10.245 78 HB2 ASP 13 1HB ASP 13 108.549 8.670 -11.621 79 HB3 ASP 13 2HB ASP 13 109.053 10.252 -12.214 80 H ALA 14 H ALA 14 109.040 12.265 -9.973 81 HA ALA 14 HA ALA 14 106.685 11.649 -8.285 82 HB1 ALA 14 1HB ALA 14 107.308 13.222 -6.765 83 HB2 ALA 14 2HB ALA 14 108.058 14.264 -7.975 84 HB3 ALA 14 3HB ALA 14 108.917 12.846 -7.376 85 H GLN 15 H GLN 15 105.001 11.927 -9.569 86 HA GLN 15 HA GLN 15 104.856 14.105 -11.488 87 HB2 GLN 15 1HB GLN 15 102.830 12.025 -10.632 88 HB3 GLN 15 2HB GLN 15 102.556 13.221 -11.900 89 HG2 GLN 15 1HG GLN 15 104.447 12.345 -13.178 90 HG3 GLN 15 2HG GLN 15 104.811 11.196 -11.895 91 HE21 GLN 15 1HE2 GLN 15 104.221 10.332 -14.561 92 HE22 GLN 15 2HE2 GLN 15 102.745 9.494 -14.534 93 H GLY 16 H GLY 16 104.179 16.049 -11.028 94 HA2 GLY 16 1HA GLY 16 102.927 17.759 -10.047 95 HA3 GLY 16 2HA GLY 16 102.276 16.603 -8.895 96 H GLN 17 H GLN 17 105.259 15.761 -8.431 97 HA GLN 17 HA GLN 17 106.106 18.117 -6.855 98 HB2 GLN 17 1HB GLN 17 105.554 16.108 -5.489 99 HB3 GLN 17 2HB GLN 17 106.796 15.214 -6.357 100 HG2 GLN 17 1HG GLN 17 108.474 16.915 -5.612 101 HG3 GLN 17 2HG GLN 17 107.214 17.673 -4.640 102 HE21 GLN 17 1HE2 GLN 17 107.330 17.014 -2.497 103 HE22 GLN 17 2HE2 GLN 17 107.809 15.471 -1.976 104 H MET 18 H MET 18 108.318 18.710 -6.977 105 HA MET 18 HA MET 18 109.544 17.957 -9.521 106 HB2 MET 18 1HB MET 18 110.369 20.037 -7.478 107 HB3 MET 18 2HB MET 18 111.058 19.843 -9.087 108 HG2 MET 18 1HG MET 18 108.175 20.546 -8.461 109 HG3 MET 18 2HG MET 18 109.398 21.655 -9.075 110 HE1 MET 18 3HE MET 18 110.672 21.383 -11.091 111 HE2 MET 18 1HE MET 18 110.163 20.571 -12.577 112 HE3 MET 18 2HE MET 18 110.948 19.654 -11.293 113 H ASN 19 H ASN 19 111.870 17.586 -9.630 114 HA ASN 19 HA ASN 19 113.854 16.625 -9.053 115 HB2 ASN 19 1HB ASN 19 112.955 17.007 -6.192 116 HB3 ASN 19 2HB ASN 19 114.592 16.661 -6.740 117 HD21 ASN 19 1HD2 ASN 19 113.199 19.154 -5.427 118 HD22 ASN 19 2HD2 ASN 19 113.754 20.437 -6.390 119 H LYS 20 H LYS 20 114.059 14.588 -9.595 120 HA LYS 20 HA LYS 20 112.514 12.472 -8.373 121 HB2 LYS 20 1HB LYS 20 113.680 10.997 -9.891 122 HB3 LYS 20 2HB LYS 20 113.176 12.432 -10.776 123 HG2 LYS 20 1HG LYS 20 115.474 13.377 -10.454 124 HG3 LYS 20 2HG LYS 20 115.955 11.853 -9.707 125 HD2 LYS 20 1HD LYS 20 115.146 10.701 -11.833 126 HD3 LYS 20 2HD LYS 20 115.044 12.308 -12.555 127 HE2 LYS 20 1HE LYS 20 117.213 11.295 -13.083 128 HE3 LYS 20 2HE LYS 20 117.439 12.682 -12.018 129 HZ1 LYS 20 3HZ LYS 20 117.089 10.016 -10.837 130 HZ2 LYS 20 1HZ LYS 20 117.944 11.355 -10.241 131 HZ3 LYS 20 2HZ LYS 20 118.596 10.426 -11.505 132 H MET 21 H MET 21 113.693 10.516 -7.426 133 HA MET 21 HA MET 21 115.962 11.430 -5.752 134 HB2 MET 21 1HB MET 21 113.474 10.047 -4.719 135 HB3 MET 21 2HB MET 21 114.898 10.477 -3.768 136 HG2 MET 21 1HG MET 21 114.526 12.877 -4.426 137 HG3 MET 21 2HG MET 21 113.004 12.382 -5.166 138 HE1 MET 21 3HE MET 21 114.162 12.450 -0.742 139 HE2 MET 21 1HE MET 21 115.109 12.956 -2.147 140 HE3 MET 21 2HE MET 21 114.869 11.243 -1.812 141 H GLY 22 H GLY 22 117.030 9.582 -4.593 142 HA2 GLY 22 1HA GLY 22 116.748 7.038 -6.096 143 HA3 GLY 22 2HA GLY 22 118.333 7.759 -5.811 144 H GLY 23 H GLY 23 117.019 5.176 -4.843 145 HA2 GLY 23 1HA GLY 23 117.787 5.514 -2.035 146 HA3 GLY 23 2HA GLY 23 116.155 4.947 -2.361 147 H PHE 24 H PHE 24 117.785 3.440 -0.859 148 HA PHE 24 HA PHE 24 118.525 1.173 -2.623 149 HB2 PHE 24 1HB PHE 24 119.753 1.973 0.020 150 HB3 PHE 24 2HB PHE 24 120.153 0.525 -0.884 151 HD1 PHE 24 HD1 PHE 24 121.392 0.684 -3.023 152 HD2 PHE 24 HD2 PHE 24 120.577 4.145 -0.615 153 HE1 PHE 24 HE1 PHE 24 123.103 1.963 -4.283 154 HE2 PHE 24 HE2 PHE 24 122.288 5.424 -1.875 155 HZ PHE 24 HZ PHE 24 123.551 4.333 -3.709 156 H ASN 25 H ASN 25 118.003 -0.918 -1.844 157 HA ASN 25 HA ASN 25 115.969 -0.952 0.314 158 HB2 ASN 25 1HB ASN 25 115.107 -1.106 -2.091 159 HB3 ASN 25 2HB ASN 25 115.889 -2.684 -2.153 160 HD21 ASN 25 1HD2 ASN 25 114.543 -4.376 -1.557 161 HD22 ASN 25 2HD2 ASN 25 113.212 -4.241 -0.511 162 H LEU 26 H LEU 26 116.138 -2.551 1.789 163 HA LEU 26 HA LEU 26 118.104 -4.715 1.302 164 HB2 LEU 26 1HB LEU 26 118.472 -2.747 3.122 165 HB3 LEU 26 2HB LEU 26 117.510 -3.847 4.096 166 HG LEU 26 HG LEU 26 119.855 -4.323 4.449 167 HD11 LEU 26 1HD1 LEU 26 118.061 -6.230 3.956 168 HD12 LEU 26 2HD1 LEU 26 119.753 -6.611 4.270 169 HD13 LEU 26 3HD1 LEU 26 119.153 -6.570 2.614 170 HD21 LEU 26 3HD2 LEU 26 120.186 -4.983 1.530 171 HD22 LEU 26 1HD2 LEU 26 121.431 -4.692 2.744 172 HD23 LEU 26 2HD2 LEU 26 120.467 -3.348 2.131 173 H LYS 27 H LYS 27 117.397 -6.785 1.816 174 HA LYS 27 HA LYS 27 114.570 -7.004 2.680 175 HB2 LYS 27 1HB LYS 27 114.811 -7.099 0.207 176 HB3 LYS 27 2HB LYS 27 115.885 -8.482 0.395 177 HG2 LYS 27 1HG LYS 27 114.053 -9.712 1.550 178 HG3 LYS 27 2HG LYS 27 112.979 -8.343 1.246 179 HD2 LYS 27 1HD LYS 27 113.454 -8.582 -1.203 180 HD3 LYS 27 2HD LYS 27 114.372 -10.043 -0.841 181 HE2 LYS 27 1HE LYS 27 111.557 -9.789 0.167 182 HE3 LYS 27 2HE LYS 27 111.839 -10.236 -1.515 183 HZ1 LYS 27 3HZ LYS 27 112.655 -11.666 0.935 184 HZ2 LYS 27 1HZ LYS 27 113.448 -11.941 -0.539 185 HZ3 LYS 27 2HZ LYS 27 111.784 -12.253 -0.400 186 H TYR 28 H TYR 28 114.154 -8.575 4.124 187 HA TYR 28 HA TYR 28 116.111 -10.785 4.421 188 HB2 TYR 28 1HB TYR 28 114.516 -9.438 6.606 189 HB3 TYR 28 2HB TYR 28 115.584 -10.814 6.816 190 HD1 TYR 28 HD1 TYR 28 118.062 -10.523 6.433 191 HD2 TYR 28 HD2 TYR 28 115.332 -7.208 6.551 192 HE1 TYR 28 HE1 TYR 28 119.962 -8.972 6.795 193 HE2 TYR 28 HE2 TYR 28 117.233 -5.656 6.914 194 HH TYR 28 HH TYR 28 119.866 -5.803 6.295 195 H ARG 29 H ARG 29 115.258 -12.834 4.546 196 HA ARG 29 HA ARG 29 112.319 -13.100 4.573 197 HB2 ARG 29 1HB ARG 29 113.141 -13.047 2.218 198 HB3 ARG 29 2HB ARG 29 114.131 -14.462 2.570 199 HG2 ARG 29 1HG ARG 29 112.138 -15.758 3.137 200 HG3 ARG 29 2HG ARG 29 111.118 -14.340 2.888 201 HD2 ARG 29 1HD ARG 29 110.995 -15.666 0.881 202 HD3 ARG 29 2HD ARG 29 111.968 -14.244 0.517 203 HE ARG 29 HE ARG 29 113.723 -16.250 1.349 204 HH11 ARG 29 1HH1 ARG 29 111.508 -15.724 -1.325 205 HH12 ARG 29 2HH1 ARG 29 112.432 -16.706 -2.412 206 HH21 ARG 29 1HH2 ARG 29 114.869 -17.502 -0.099 207 HH22 ARG 29 2HH2 ARG 29 114.309 -17.699 -1.726 208 H TYR 30 H TYR 30 111.550 -14.911 5.571 209 HA TYR 30 HA TYR 30 113.527 -16.913 6.505 210 HB2 TYR 30 1HB TYR 30 112.806 -15.355 8.313 211 HB3 TYR 30 2HB TYR 30 111.151 -15.877 8.056 212 HD1 TYR 30 HD1 TYR 30 114.503 -16.897 9.238 213 HD2 TYR 30 HD2 TYR 30 110.368 -18.007 8.882 214 HE1 TYR 30 HE1 TYR 30 114.874 -18.780 10.808 215 HE2 TYR 30 HE2 TYR 30 110.740 -19.891 10.451 216 HH TYR 30 HH TYR 30 112.184 -20.906 11.793 217 H GLU 31 H GLU 31 112.874 -19.045 6.466 218 HA GLU 31 HA GLU 31 110.177 -19.609 5.386 219 HB2 GLU 31 1HB GLU 31 111.916 -19.619 3.584 220 HB3 GLU 31 2HB GLU 31 112.734 -20.924 4.444 221 HG2 GLU 31 1HG GLU 31 110.651 -22.280 4.303 222 HG3 GLU 31 2HG GLU 31 109.902 -20.994 3.367 223 H GLU 32 H GLU 32 109.240 -21.537 6.031 224 HA GLU 32 HA GLU 32 110.441 -22.840 8.354 225 HB2 GLU 32 1HB GLU 32 107.752 -23.232 7.019 226 HB3 GLU 32 2HB GLU 32 108.264 -24.000 8.520 227 HG2 GLU 32 1HG GLU 32 108.070 -21.010 8.072 228 HG3 GLU 32 2HG GLU 32 106.884 -21.980 8.935 229 H ASP 33 H ASP 33 110.879 -25.078 8.466 230 HA ASP 33 HA ASP 33 112.095 -26.044 6.070 231 HB2 ASP 33 1HB ASP 33 111.713 -27.348 8.766 232 HB3 ASP 33 2HB ASP 33 112.712 -27.998 7.470 233 H ASN 34 H ASN 34 109.240 -27.147 7.938 234 HA ASN 34 HA ASN 34 108.805 -29.223 5.879 235 HB2 ASN 34 1HB ASN 34 108.966 -29.759 8.383 236 HB3 ASN 34 2HB ASN 34 107.357 -29.049 8.504 237 HD21 ASN 34 1HD2 ASN 34 106.488 -31.220 9.042 238 HD22 ASN 34 2HD2 ASN 34 106.270 -32.376 7.818 239 H SER 35 H SER 35 107.498 -26.210 6.891 240 HA SER 35 HA SER 35 105.324 -26.558 4.968 241 HB2 SER 35 1HB SER 35 104.483 -27.130 7.324 242 HB3 SER 35 2HB SER 35 104.730 -25.430 7.706 243 HG SER 35 HG SER 35 102.796 -25.250 6.868 244 HA PRO 36 HA PRO 36 107.821 -22.686 4.995 245 HB2 PRO 36 1HB PRO 36 108.044 -22.301 2.302 246 HB3 PRO 36 2HB PRO 36 109.094 -23.398 3.220 247 HG2 PRO 36 1HG PRO 36 106.735 -24.024 1.524 248 HG3 PRO 36 2HG PRO 36 108.272 -24.891 1.688 249 HD2 PRO 36 1HD PRO 36 105.975 -25.700 2.934 250 HD3 PRO 36 2HD PRO 36 107.598 -26.020 3.584 251 H LEU 37 H LEU 37 107.007 -20.753 5.257 252 HA LEU 37 HA LEU 37 104.902 -19.755 3.436 253 HB2 LEU 37 1HB LEU 37 104.409 -20.176 6.038 254 HB3 LEU 37 2HB LEU 37 105.231 -18.632 6.198 255 HG LEU 37 HG LEU 37 102.846 -18.250 6.046 256 HD11 LEU 37 1HD1 LEU 37 104.628 -16.877 4.615 257 HD12 LEU 37 2HD1 LEU 37 102.904 -16.521 4.542 258 HD13 LEU 37 3HD1 LEU 37 103.657 -17.491 3.277 259 HD21 LEU 37 3HD2 LEU 37 102.548 -20.476 4.720 260 HD22 LEU 37 1HD2 LEU 37 102.771 -19.462 3.296 261 HD23 LEU 37 2HD2 LEU 37 101.438 -19.143 4.406 262 H GLY 38 H GLY 38 105.419 -17.714 2.493 263 HA2 GLY 38 1HA GLY 38 108.231 -16.977 2.911 264 HA3 GLY 38 2HA GLY 38 107.226 -16.506 1.543 265 H VAL 39 H VAL 39 108.620 -15.412 4.350 266 HA VAL 39 HA VAL 39 106.777 -13.083 4.414 267 HB VAL 39 HB VAL 39 108.406 -14.187 6.721 268 HG11 VAL 39 1HG1 VAL 39 106.364 -11.950 6.530 269 HG12 VAL 39 2HG1 VAL 39 108.094 -11.760 6.824 270 HG13 VAL 39 3HG1 VAL 39 107.074 -12.541 8.033 271 HG21 VAL 39 3HG2 VAL 39 106.209 -14.808 7.676 272 HG22 VAL 39 1HG2 VAL 39 106.503 -15.656 6.157 273 HG23 VAL 39 2HG2 VAL 39 105.417 -14.268 6.196 274 H ILE 40 H ILE 40 107.710 -11.211 3.909 275 HA ILE 40 HA ILE 40 110.657 -10.991 4.140 276 HB ILE 40 HB ILE 40 110.660 -9.697 2.057 277 HG12 ILE 40 1HG1 ILE 40 107.755 -10.540 1.804 278 HG13 ILE 40 2HG1 ILE 40 108.274 -8.916 2.255 279 HG21 ILE 40 1HG2 ILE 40 109.336 -12.418 1.829 280 HG22 ILE 40 2HG2 ILE 40 111.068 -12.121 1.974 281 HG23 ILE 40 3HG2 ILE 40 110.201 -11.596 0.531 282 HD11 ILE 40 3HD1 ILE 40 108.763 -10.356 -0.357 283 HD12 ILE 40 1HD1 ILE 40 109.652 -8.905 0.105 284 HD13 ILE 40 2HD1 ILE 40 107.903 -8.839 -0.099 285 H GLY 41 H GLY 41 111.456 -9.141 4.888 286 HA2 GLY 41 1HA GLY 41 109.599 -6.882 5.382 287 HA3 GLY 41 2HA GLY 41 110.850 -7.350 6.540 288 H SER 42 H SER 42 110.284 -4.977 4.507 289 HA SER 42 HA SER 42 113.056 -4.866 3.467 290 HB2 SER 42 1HB SER 42 111.369 -5.405 1.689 291 HB3 SER 42 2HB SER 42 110.609 -3.853 2.021 292 HG SER 42 HG SER 42 112.039 -3.247 0.564 293 H PHE 43 H PHE 43 114.132 -3.020 3.753 294 HA PHE 43 HA PHE 43 112.643 -0.677 4.801 295 HB2 PHE 43 1HB PHE 43 115.504 -1.513 5.311 296 HB3 PHE 43 2HB PHE 43 114.763 -0.034 5.893 297 HD1 PHE 43 HD1 PHE 43 112.980 -0.129 7.631 298 HD2 PHE 43 HD2 PHE 43 115.119 -3.632 6.364 299 HE1 PHE 43 HE1 PHE 43 112.201 -1.336 9.653 300 HE2 PHE 43 HE2 PHE 43 114.339 -4.839 8.386 301 HZ PHE 43 HZ PHE 43 112.880 -3.691 10.030 302 H THR 44 H THR 44 112.714 1.107 3.551 303 HA THR 44 HA THR 44 114.765 1.209 1.400 304 HB THR 44 HB THR 44 111.952 2.322 1.305 305 HG1 THR 44 HG1 THR 44 112.047 0.022 1.304 306 HG21 THR 44 3HG2 THR 44 112.478 2.545 -1.113 307 HG22 THR 44 1HG2 THR 44 114.121 1.993 -0.787 308 HG23 THR 44 2HG2 THR 44 113.552 3.518 -0.108 309 H TYR 45 H TYR 45 115.995 2.962 1.308 310 HA TYR 45 HA TYR 45 115.168 5.376 2.824 311 HB2 TYR 45 1HB TYR 45 117.044 4.297 3.935 312 HB3 TYR 45 2HB TYR 45 117.930 4.215 2.426 313 HD1 TYR 45 HD1 TYR 45 115.968 7.074 3.828 314 HD2 TYR 45 HD2 TYR 45 119.845 5.517 2.833 315 HE1 TYR 45 HE1 TYR 45 116.980 9.282 4.320 316 HE2 TYR 45 HE2 TYR 45 120.858 7.726 3.324 317 HH TYR 45 HH TYR 45 119.178 10.196 4.953 318 H THR 46 H THR 46 114.865 7.099 1.556 319 HA THR 46 HA THR 46 116.217 7.178 -1.083 320 HB THR 46 HB THR 46 113.403 8.069 -0.432 321 HG1 THR 46 HG1 THR 46 112.863 6.119 -0.912 322 HG21 THR 46 3HG2 THR 46 113.444 7.945 -3.090 323 HG22 THR 46 1HG2 THR 46 115.162 8.259 -2.843 324 HG23 THR 46 2HG2 THR 46 113.960 9.398 -2.233 325 H GLU 47 H GLU 47 117.015 9.145 -1.734 326 HA GLU 47 HA GLU 47 116.542 11.549 -0.183 327 HB2 GLU 47 1HB GLU 47 118.179 10.163 1.164 328 HB3 GLU 47 2HB GLU 47 119.310 10.327 -0.175 329 HG2 GLU 47 1HG GLU 47 119.184 12.798 0.049 330 HG3 GLU 47 2HG GLU 47 118.096 12.606 1.416 331 H LYS 48 H LYS 48 117.505 13.415 -1.174 332 HA LYS 48 HA LYS 48 118.956 12.969 -3.691 333 HB2 LYS 48 1HB LYS 48 116.569 13.325 -4.259 334 HB3 LYS 48 2HB LYS 48 116.616 14.871 -3.413 335 HG2 LYS 48 1HG LYS 48 116.956 15.383 -5.718 336 HG3 LYS 48 2HG LYS 48 118.545 15.509 -4.968 337 HD2 LYS 48 1HD LYS 48 119.143 13.281 -5.753 338 HD3 LYS 48 2HD LYS 48 117.522 13.042 -6.404 339 HE2 LYS 48 1HE LYS 48 118.753 13.701 -8.294 340 HE3 LYS 48 2HE LYS 48 118.003 15.208 -7.767 341 HZ1 LYS 48 3HZ LYS 48 119.976 15.946 -6.812 342 HZ2 LYS 48 1HZ LYS 48 120.480 15.240 -8.270 343 HZ3 LYS 48 2HZ LYS 48 120.677 14.397 -6.809 344 H SER 49 H SER 49 120.627 14.336 -3.974 345 HA SER 49 HA SER 49 120.970 16.498 -1.980 346 HB2 SER 49 1HB SER 49 122.640 14.657 -1.889 347 HB3 SER 49 2HB SER 49 123.082 15.009 -3.556 348 HG SER 49 HG SER 49 124.377 16.419 -2.681 349 H ARG 50 H ARG 50 121.590 18.526 -2.640 350 HA ARG 50 HA ARG 50 121.596 19.031 -5.563 351 HB2 ARG 50 1HB ARG 50 120.410 20.714 -3.343 352 HB3 ARG 50 2HB ARG 50 120.540 21.219 -5.028 353 HG2 ARG 50 1HG ARG 50 119.205 19.213 -5.690 354 HG3 ARG 50 2HG ARG 50 118.989 18.835 -3.980 355 HD2 ARG 50 1HD ARG 50 118.082 21.369 -5.373 356 HD3 ARG 50 2HD ARG 50 117.041 20.062 -4.817 357 HE ARG 50 HE ARG 50 118.616 21.052 -2.667 358 HH11 ARG 50 1HH1 ARG 50 115.831 21.927 -4.617 359 HH12 ARG 50 2HH1 ARG 50 115.140 22.907 -3.368 360 HH21 ARG 50 1HH2 ARG 50 117.676 22.326 -1.096 361 HH22 ARG 50 2HH2 ARG 50 116.172 23.129 -1.399 362 H THR 51 H THR 51 122.979 20.655 -6.319 363 HA THR 51 HA THR 51 125.375 21.008 -4.742 364 HB THR 51 HB THR 51 126.267 22.116 -6.731 365 HG1 THR 51 HG1 THR 51 124.975 22.637 -8.403 366 HG21 THR 51 3HG2 THR 51 125.930 20.252 -8.356 367 HG22 THR 51 1HG2 THR 51 124.630 19.636 -7.334 368 HG23 THR 51 2HG2 THR 51 126.285 19.679 -6.727 369 H ALA 52 H ALA 52 126.254 22.961 -4.033 370 HA ALA 52 HA ALA 52 124.339 24.898 -3.134 371 HB1 ALA 52 1HB ALA 52 126.586 26.092 -2.464 372 HB2 ALA 52 2HB ALA 52 127.298 24.530 -2.868 373 HB3 ALA 52 3HB ALA 52 126.066 24.640 -1.610 374 H SER 53 H SER 53 124.047 26.999 -3.783 375 HA SER 53 HA SER 53 125.704 28.374 -5.628 376 HB2 SER 53 1HB SER 53 124.029 28.404 -7.529 377 HB3 SER 53 2HB SER 53 124.890 26.884 -7.312 378 HG SER 53 HG SER 53 123.048 25.968 -6.885 379 H SER 54 H SER 54 122.163 28.120 -5.277 380 HA SER 54 HA SER 54 121.670 30.873 -5.092 381 HB2 SER 54 1HB SER 54 120.061 28.627 -3.855 382 HB3 SER 54 2HB SER 54 119.485 30.252 -4.210 383 HG SER 54 HG SER 54 119.021 28.608 -5.835 384 H GLY 55 H GLY 55 122.602 28.549 -2.619 385 HA2 GLY 55 1HA GLY 55 123.724 29.247 -0.619 386 HA3 GLY 55 2HA GLY 55 122.832 30.758 -0.685 387 H ASP 56 H ASP 56 120.445 28.667 -1.347 388 HA ASP 56 HA ASP 56 119.692 28.335 1.467 389 HB2 ASP 56 1HB ASP 56 118.052 29.273 -0.160 390 HB3 ASP 56 2HB ASP 56 118.102 27.748 -1.043 391 H TYR 57 H TYR 57 120.290 26.503 2.453 392 HA TYR 57 HA TYR 57 120.552 24.037 0.822 393 HB2 TYR 57 1HB TYR 57 122.658 24.950 1.800 394 HB3 TYR 57 2HB TYR 57 121.964 24.737 3.395 395 HD1 TYR 57 HD1 TYR 57 123.194 22.992 0.372 396 HD2 TYR 57 HD2 TYR 57 121.856 22.568 4.432 397 HE1 TYR 57 HE1 TYR 57 124.018 20.652 0.399 398 HE2 TYR 57 HE2 TYR 57 122.679 20.229 4.459 399 HH TYR 57 HH TYR 57 124.517 18.897 1.752 400 H ASN 58 H ASN 58 119.029 22.591 1.193 401 HA ASN 58 HA ASN 58 118.118 22.141 3.955 402 HB2 ASN 58 1HB ASN 58 116.298 22.412 1.549 403 HB3 ASN 58 2HB ASN 58 115.790 21.895 3.156 404 HD21 ASN 58 1HD2 ASN 58 115.146 24.424 1.515 405 HD22 ASN 58 2HD2 ASN 58 115.496 25.698 2.581 406 H LYS 59 H LYS 59 117.206 20.001 4.281 407 HA LYS 59 HA LYS 59 118.081 18.042 2.230 408 HB2 LYS 59 1HB LYS 59 118.129 17.792 5.246 409 HB3 LYS 59 2HB LYS 59 118.502 16.488 4.120 410 HG2 LYS 59 1HG LYS 59 120.318 17.899 3.146 411 HG3 LYS 59 2HG LYS 59 119.988 19.117 4.379 412 HD2 LYS 59 1HD LYS 59 120.427 17.399 6.139 413 HD3 LYS 59 2HD LYS 59 120.881 16.262 4.869 414 HE2 LYS 59 1HE LYS 59 122.531 18.122 4.105 415 HE3 LYS 59 2HE LYS 59 122.282 18.790 5.719 416 HZ1 LYS 59 3HZ LYS 59 124.186 17.228 5.531 417 HZ2 LYS 59 1HZ LYS 59 123.084 15.980 5.204 418 HZ3 LYS 59 2HZ LYS 59 123.038 16.781 6.702 419 H ASN 60 H ASN 60 116.538 16.779 1.450 420 HA ASN 60 HA ASN 60 114.091 16.325 3.063 421 HB2 ASN 60 1HB ASN 60 113.695 17.699 1.022 422 HB3 ASN 60 2HB ASN 60 114.328 16.376 0.045 423 HD21 ASN 60 1HD2 ASN 60 112.180 16.143 -0.988 424 HD22 ASN 60 2HD2 ASN 60 110.908 15.394 -0.151 425 H GLN 61 H GLN 61 113.837 14.267 3.683 426 HA GLN 61 HA GLN 61 114.642 12.119 1.875 427 HB2 GLN 61 1HB GLN 61 116.045 10.984 3.501 428 HB3 GLN 61 2HB GLN 61 116.680 12.596 3.192 429 HG2 GLN 61 1HG GLN 61 115.391 13.367 5.250 430 HG3 GLN 61 2HG GLN 61 115.107 11.664 5.602 431 HE21 GLN 61 1HE2 GLN 61 116.496 11.356 7.398 432 HE22 GLN 61 2HE2 GLN 61 118.170 11.639 7.348 433 H TYR 62 H TYR 62 113.807 10.010 2.511 434 HA TYR 62 HA TYR 62 111.935 9.988 4.741 435 HB2 TYR 62 1HB TYR 62 110.015 9.333 3.458 436 HB3 TYR 62 2HB TYR 62 110.606 10.877 2.884 437 HD1 TYR 62 HD1 TYR 62 111.609 11.082 0.655 438 HD2 TYR 62 HD2 TYR 62 110.106 7.327 2.105 439 HE1 TYR 62 HE1 TYR 62 111.623 10.184 -1.656 440 HE2 TYR 62 HE2 TYR 62 110.124 6.428 -0.207 441 HH TYR 62 HH TYR 62 110.484 6.874 -2.348 442 H TYR 63 H TYR 63 111.132 7.917 5.286 443 HA TYR 63 HA TYR 63 112.741 5.664 4.231 444 HB2 TYR 63 1HB TYR 63 111.951 6.117 7.115 445 HB3 TYR 63 2HB TYR 63 112.892 4.778 6.492 446 HD1 TYR 63 HD1 TYR 63 112.899 8.462 7.017 447 HD2 TYR 63 HD2 TYR 63 115.248 4.947 6.258 448 HE1 TYR 63 HE1 TYR 63 114.972 9.758 7.433 449 HE2 TYR 63 HE2 TYR 63 117.321 6.244 6.671 450 HH TYR 63 HH TYR 63 118.132 8.431 6.767 451 H GLY 64 H GLY 64 111.617 3.697 4.048 452 HA2 GLY 64 1HA GLY 64 108.728 3.783 4.736 453 HA3 GLY 64 2HA GLY 64 109.291 3.207 3.171 454 H ILE 65 H ILE 65 107.923 2.008 5.694 455 HA ILE 65 HA ILE 65 109.657 -0.393 5.876 456 HB ILE 65 HB ILE 65 107.626 0.595 7.900 457 HG12 ILE 65 1HG1 ILE 65 110.655 0.545 8.073 458 HG13 ILE 65 2HG1 ILE 65 109.709 1.994 7.728 459 HG21 ILE 65 1HG2 ILE 65 109.653 -1.661 8.014 460 HG22 ILE 65 2HG2 ILE 65 107.912 -1.868 7.821 461 HG23 ILE 65 3HG2 ILE 65 108.559 -1.189 9.315 462 HD11 ILE 65 3HD1 ILE 65 109.723 0.340 10.256 463 HD12 ILE 65 1HD1 ILE 65 108.434 1.489 9.896 464 HD13 ILE 65 2HD1 ILE 65 110.096 2.054 10.075 465 H THR 66 H THR 66 108.815 -2.186 4.978 466 HA THR 66 HA THR 66 105.895 -2.424 4.734 467 HB THR 66 HB THR 66 106.714 -1.400 2.648 468 HG1 THR 66 HG1 THR 66 105.293 -2.564 1.675 469 HG21 THR 66 3HG2 THR 66 108.146 -2.736 1.136 470 HG22 THR 66 1HG2 THR 66 108.346 -3.940 2.408 471 HG23 THR 66 2HG2 THR 66 108.987 -2.311 2.626 472 H ALA 67 H ALA 67 105.161 -4.569 4.210 473 HA ALA 67 HA ALA 67 107.102 -6.751 4.488 474 HB1 ALA 67 1HB ALA 67 106.290 -6.215 6.795 475 HB2 ALA 67 2HB ALA 67 105.851 -7.838 6.262 476 HB3 ALA 67 3HB ALA 67 104.646 -6.550 6.252 477 H GLY 68 H GLY 68 106.229 -8.809 3.739 478 HA2 GLY 68 1HA GLY 68 103.624 -8.692 2.430 479 HA3 GLY 68 2HA GLY 68 105.013 -8.835 1.377 480 HA PRO 69 HA PRO 69 104.171 -13.210 3.032 481 HB2 PRO 69 1HB PRO 69 101.873 -14.075 1.866 482 HB3 PRO 69 2HB PRO 69 101.918 -13.404 3.510 483 HG2 PRO 69 1HG PRO 69 101.079 -12.116 0.968 484 HG3 PRO 69 2HG PRO 69 100.384 -11.974 2.593 485 HD2 PRO 69 1HD PRO 69 102.045 -10.083 1.490 486 HD3 PRO 69 2HD PRO 69 101.870 -10.345 3.238 487 H ALA 70 H ALA 70 104.433 -15.119 1.513 488 HA ALA 70 HA ALA 70 104.459 -14.405 -1.331 489 HB1 ALA 70 1HB ALA 70 106.694 -14.631 -1.678 490 HB2 ALA 70 2HB ALA 70 106.889 -15.836 -0.409 491 HB3 ALA 70 3HB ALA 70 106.779 -14.127 0.008 492 H TYR 71 H TYR 71 104.500 -16.203 -2.751 493 HA TYR 71 HA TYR 71 103.807 -18.790 -1.485 494 HB2 TYR 71 1HB TYR 71 101.852 -17.595 -2.492 495 HB3 TYR 71 2HB TYR 71 102.669 -17.652 -4.042 496 HD1 TYR 71 HD1 TYR 71 101.108 -19.696 -1.372 497 HD2 TYR 71 HD2 TYR 71 102.674 -19.647 -5.372 498 HE1 TYR 71 HE1 TYR 71 100.130 -21.938 -1.781 499 HE2 TYR 71 HE2 TYR 71 101.697 -21.890 -5.781 500 HH TYR 71 HH TYR 71 100.382 -23.815 -3.226 501 H ARG 72 H ARG 72 104.980 -20.498 -2.182 502 HA ARG 72 HA ARG 72 106.859 -20.022 -4.425 503 HB2 ARG 72 1HB ARG 72 107.114 -21.858 -2.031 504 HB3 ARG 72 2HB ARG 72 108.305 -21.685 -3.320 505 HG2 ARG 72 1HG ARG 72 108.502 -19.264 -2.776 506 HG3 ARG 72 2HG ARG 72 107.384 -19.499 -1.431 507 HD2 ARG 72 1HD ARG 72 108.969 -21.256 -0.542 508 HD3 ARG 72 2HD ARG 72 110.116 -20.756 -1.780 509 HE ARG 72 HE ARG 72 109.097 -18.631 -0.068 510 HH11 ARG 72 1HH1 ARG 72 111.699 -20.918 -0.638 511 HH12 ARG 72 2HH1 ARG 72 112.821 -20.037 0.345 512 HH21 ARG 72 1HH2 ARG 72 110.584 -17.544 1.188 513 HH22 ARG 72 2HH2 ARG 72 112.197 -18.150 1.364 514 H ILE 73 H ILE 73 106.905 -21.399 -6.104 515 HA ILE 73 HA ILE 73 105.305 -23.887 -5.938 516 HB ILE 73 HB ILE 73 105.699 -22.170 -8.401 517 HG12 ILE 73 1HG1 ILE 73 103.067 -22.003 -7.975 518 HG13 ILE 73 2HG1 ILE 73 103.555 -22.263 -6.301 519 HG21 ILE 73 1HG2 ILE 73 103.796 -24.474 -7.910 520 HG22 ILE 73 2HG2 ILE 73 105.374 -24.676 -8.670 521 HG23 ILE 73 3HG2 ILE 73 104.143 -23.678 -9.444 522 HD11 ILE 73 3HD1 ILE 73 103.424 -19.817 -7.279 523 HD12 ILE 73 1HD1 ILE 73 105.011 -20.214 -7.934 524 HD13 ILE 73 2HD1 ILE 73 104.738 -20.264 -6.192 525 H ASN 74 H ASN 74 106.233 -25.730 -6.739 526 HA ASN 74 HA ASN 74 109.033 -25.898 -6.676 527 HB2 ASN 74 1HB ASN 74 107.023 -27.829 -7.848 528 HB3 ASN 74 2HB ASN 74 108.711 -28.205 -7.504 529 HD21 ASN 74 1HD2 ASN 74 109.080 -26.965 -5.012 530 HD22 ASN 74 2HD2 ASN 74 108.051 -27.680 -3.867 531 H ASP 75 H ASP 75 106.807 -25.823 -9.465 532 HA ASP 75 HA ASP 75 109.100 -25.963 -11.279 533 HB2 ASP 75 1HB ASP 75 107.481 -26.273 -13.050 534 HB3 ASP 75 2HB ASP 75 107.118 -27.371 -11.724 535 H TRP 76 H TRP 76 106.699 -23.655 -10.174 536 HA TRP 76 HA TRP 76 107.677 -21.680 -12.141 537 HB2 TRP 76 1HB TRP 76 105.229 -22.111 -12.024 538 HB3 TRP 76 2HB TRP 76 105.242 -21.563 -10.359 539 HD1 TRP 76 HD1 TRP 76 104.892 -19.068 -9.970 540 HE1 TRP 76 HE1 TRP 76 104.813 -16.978 -11.475 541 HE3 TRP 76 HE3 TRP 76 106.382 -21.117 -14.402 542 HZ2 TRP 76 HZ2 TRP 76 105.315 -16.266 -14.204 543 HZ3 TRP 76 HZ3 TRP 76 106.573 -19.716 -16.434 544 HH2 TRP 76 HH2 TRP 76 106.043 -17.297 -16.343 545 H ALA 77 H ALA 77 108.321 -19.612 -11.462 546 HA ALA 77 HA ALA 77 109.921 -19.460 -9.180 547 HB1 ALA 77 1HB ALA 77 110.473 -17.833 -10.712 548 HB2 ALA 77 2HB ALA 77 109.498 -16.864 -9.608 549 HB3 ALA 77 3HB ALA 77 108.792 -17.479 -11.102 550 H SER 78 H SER 78 109.472 -17.370 -7.638 551 HA SER 78 HA SER 78 106.928 -18.029 -6.274 552 HB2 SER 78 1HB SER 78 108.001 -17.266 -4.229 553 HB3 SER 78 2HB SER 78 109.027 -18.465 -5.009 554 HG SER 78 HG SER 78 110.320 -16.819 -5.774 555 H ILE 79 H ILE 79 105.673 -16.323 -5.390 556 HA ILE 79 HA ILE 79 106.221 -13.651 -6.572 557 HB ILE 79 HB ILE 79 103.506 -14.969 -6.262 558 HG12 ILE 79 1HG1 ILE 79 105.005 -14.319 -8.815 559 HG13 ILE 79 2HG1 ILE 79 104.989 -15.927 -8.085 560 HG21 ILE 79 1HG2 ILE 79 103.421 -12.534 -6.043 561 HG22 ILE 79 2HG2 ILE 79 102.752 -13.009 -7.604 562 HG23 ILE 79 3HG2 ILE 79 104.384 -12.345 -7.508 563 HD11 ILE 79 3HD1 ILE 79 102.382 -15.602 -8.102 564 HD12 ILE 79 1HD1 ILE 79 103.208 -16.075 -9.588 565 HD13 ILE 79 2HD1 ILE 79 102.729 -14.395 -9.341 566 H TYR 80 H TYR 80 105.592 -11.873 -5.279 567 HA TYR 80 HA TYR 80 104.330 -12.452 -2.699 568 HB2 TYR 80 1HB TYR 80 106.030 -11.354 -1.410 569 HB3 TYR 80 2HB TYR 80 106.769 -12.642 -2.338 570 HD1 TYR 80 HD2 TYR 80 108.309 -12.152 -4.171 571 HD2 TYR 80 HD1 TYR 80 106.484 -9.006 -1.886 572 HE1 TYR 80 HE2 TYR 80 109.942 -10.534 -5.096 573 HE2 TYR 80 HE1 TYR 80 108.119 -7.386 -2.811 574 HH TYR 80 HH TYR 80 110.203 -8.184 -5.447 575 H GLY 81 H GLY 81 103.514 -10.583 -1.627 576 HA2 GLY 81 1HA GLY 81 103.475 -8.098 -3.244 577 HA3 GLY 81 2HA GLY 81 101.971 -8.765 -2.607 578 H VAL 82 H VAL 82 103.325 -6.180 -2.001 579 HA VAL 82 HA VAL 82 103.697 -6.530 0.908 580 HB VAL 82 HB VAL 82 105.624 -4.975 0.823 581 HG11 VAL 82 1HG1 VAL 82 107.186 -6.626 -0.426 582 HG12 VAL 82 2HG1 VAL 82 105.732 -7.593 -0.663 583 HG13 VAL 82 3HG1 VAL 82 106.289 -7.222 0.969 584 HG21 VAL 82 3HG2 VAL 82 105.117 -3.834 -1.278 585 HG22 VAL 82 1HG2 VAL 82 105.316 -5.341 -2.173 586 HG23 VAL 82 2HG2 VAL 82 106.706 -4.590 -1.391 587 H VAL 83 H VAL 83 103.200 -4.776 2.167 588 HA VAL 83 HA VAL 83 102.412 -2.268 0.845 589 HB VAL 83 HB VAL 83 100.326 -3.506 1.307 590 HG11 VAL 83 1HG1 VAL 83 99.696 -3.975 3.661 591 HG12 VAL 83 2HG1 VAL 83 101.308 -3.478 4.175 592 HG13 VAL 83 3HG1 VAL 83 101.108 -4.905 3.158 593 HG21 VAL 83 3HG2 VAL 83 99.208 -1.759 2.591 594 HG22 VAL 83 1HG2 VAL 83 100.416 -1.022 1.540 595 HG23 VAL 83 2HG2 VAL 83 100.749 -1.225 3.260 596 H GLY 84 H GLY 84 102.689 -0.395 2.243 597 HA2 GLY 84 1HA GLY 84 103.680 -0.697 4.920 598 HA3 GLY 84 2HA GLY 84 104.983 -0.400 3.777 599 H VAL 85 H VAL 85 105.091 1.478 5.370 600 HA VAL 85 HA VAL 85 103.492 3.739 4.324 601 HB VAL 85 HB VAL 85 104.197 3.296 7.239 602 HG11 VAL 85 1HG1 VAL 85 102.479 5.404 5.894 603 HG12 VAL 85 2HG1 VAL 85 104.118 5.672 6.488 604 HG13 VAL 85 3HG1 VAL 85 102.822 5.284 7.619 605 HG21 VAL 85 3HG2 VAL 85 101.627 3.205 7.407 606 HG22 VAL 85 1HG2 VAL 85 102.431 1.779 6.751 607 HG23 VAL 85 2HG2 VAL 85 101.643 2.924 5.666 608 H GLY 86 H GLY 86 104.640 5.609 4.008 609 HA2 GLY 86 1HA GLY 86 107.520 5.547 4.729 610 HA3 GLY 86 2HA GLY 86 106.950 6.113 3.161 611 H TYR 87 H TYR 87 108.337 7.397 5.614 612 HA TYR 87 HA TYR 87 106.575 9.774 5.718 613 HB2 TYR 87 1HB TYR 87 107.143 10.126 8.022 614 HB3 TYR 87 2HB TYR 87 106.498 8.508 7.846 615 HD1 TYR 87 HD1 TYR 87 108.021 6.537 7.973 616 HD2 TYR 87 HD2 TYR 87 109.394 10.535 8.739 617 HE1 TYR 87 HE1 TYR 87 110.049 5.629 9.074 618 HE2 TYR 87 HE2 TYR 87 111.423 9.627 9.839 619 HH TYR 87 HH TYR 87 111.859 7.100 11.089 620 H GLY 88 H GLY 88 107.569 11.721 5.461 621 HA2 GLY 88 1HA GLY 88 110.505 11.704 5.063 622 HA3 GLY 88 2HA GLY 88 109.417 12.458 3.902 623 H LYS 89 H LYS 89 111.553 13.708 5.342 624 HA LYS 89 HA LYS 89 110.053 15.764 6.823 625 HB2 LYS 89 1HB LYS 89 112.645 14.502 7.750 626 HB3 LYS 89 2HB LYS 89 111.815 15.847 8.532 627 HG2 LYS 89 1HG LYS 89 109.791 14.342 8.759 628 HG3 LYS 89 2HG LYS 89 110.810 13.008 8.217 629 HD2 LYS 89 1HD LYS 89 111.412 14.761 10.616 630 HD3 LYS 89 2HD LYS 89 110.672 13.163 10.705 631 HE2 LYS 89 1HE LYS 89 112.706 12.294 9.431 632 HE3 LYS 89 2HE LYS 89 113.449 13.864 9.734 633 HZ1 LYS 89 3HZ LYS 89 112.423 12.002 11.807 634 HZ2 LYS 89 1HZ LYS 89 113.128 13.516 12.104 635 HZ3 LYS 89 2HZ LYS 89 114.059 12.264 11.431 636 H PHE 90 H PHE 90 110.742 17.815 6.487 637 HA PHE 90 HA PHE 90 113.045 18.210 4.673 638 HB2 PHE 90 1HB PHE 90 110.709 20.031 5.280 639 HB3 PHE 90 2HB PHE 90 112.011 20.384 4.163 640 HD1 PHE 90 HD1 PHE 90 112.134 19.275 1.981 641 HD2 PHE 90 HD2 PHE 90 108.952 18.437 4.744 642 HE1 PHE 90 HE1 PHE 90 110.840 18.189 0.165 643 HE2 PHE 90 HE2 PHE 90 107.661 17.350 2.928 644 HZ PHE 90 HZ PHE 90 108.604 17.227 0.637 645 H GLN 91 H GLN 91 114.734 19.510 5.322 646 HA GLN 91 HA GLN 91 114.620 20.518 8.098 647 HB2 GLN 91 1HB GLN 91 116.980 19.876 6.317 648 HB3 GLN 91 2HB GLN 91 117.103 20.557 7.940 649 HG2 GLN 91 1HG GLN 91 115.948 18.604 8.872 650 HG3 GLN 91 2HG GLN 91 115.761 17.927 7.257 651 HE21 GLN 91 1HE2 GLN 91 117.137 16.450 9.232 652 HE22 GLN 91 2HE2 GLN 91 118.786 16.389 8.834 653 H THR 92 H THR 92 114.493 22.616 8.446 654 HA THR 92 HA THR 92 115.713 24.503 6.573 655 HB THR 92 HB THR 92 113.381 24.261 5.814 656 HG1 THR 92 HG1 THR 92 113.328 26.327 5.490 657 HG21 THR 92 3HG2 THR 92 111.557 25.079 7.309 658 HG22 THR 92 1HG2 THR 92 112.718 25.147 8.635 659 HG23 THR 92 2HG2 THR 92 112.313 23.598 7.897 660 H THR 93 H THR 93 115.517 26.814 7.529 661 HA THR 93 HA THR 93 116.101 26.637 10.410 662 HB THR 93 HB THR 93 116.554 28.946 8.501 663 HG1 THR 93 HG1 THR 93 118.771 28.181 8.754 664 HG21 THR 93 3HG2 THR 93 117.741 28.390 11.233 665 HG22 THR 93 1HG2 THR 93 116.362 29.458 10.964 666 HG23 THR 93 2HG2 THR 93 117.933 29.852 10.263 667 H GLU 94 H GLU 94 114.722 27.400 11.877 668 HA GLU 94 HA GLU 94 112.851 29.471 11.603 669 HB2 GLU 94 1HB GLU 94 111.897 27.888 9.876 670 HB3 GLU 94 2HB GLU 94 111.614 26.739 11.179 671 HG2 GLU 94 1HG GLU 94 110.222 28.435 12.343 672 HG3 GLU 94 2HG GLU 94 110.465 29.537 10.994 673 H TYR 95 H TYR 95 111.658 29.755 13.535 674 HA TYR 95 HA TYR 95 112.580 28.197 15.793 675 HB2 TYR 95 1HB TYR 95 110.579 30.453 15.562 676 HB3 TYR 95 2HB TYR 95 111.029 29.698 17.080 677 HD1 TYR 95 HD1 TYR 95 113.313 29.989 17.997 678 HD2 TYR 95 HD2 TYR 95 112.030 32.000 14.425 679 HE1 TYR 95 HE1 TYR 95 115.238 31.542 18.180 680 HE2 TYR 95 HE2 TYR 95 113.955 33.554 14.608 681 HH TYR 95 HH TYR 95 115.975 33.862 15.633 682 HA PRO 96 HA PRO 96 109.827 24.983 15.554 683 HB2 PRO 96 1HB PRO 96 108.924 25.213 18.376 684 HB3 PRO 96 2HB PRO 96 109.744 23.873 17.553 685 HG2 PRO 96 1HG PRO 96 110.997 25.448 19.310 686 HG3 PRO 96 2HG PRO 96 111.821 24.745 17.907 687 HD2 PRO 96 1HD PRO 96 110.915 27.557 18.339 688 HD3 PRO 96 2HD PRO 96 112.316 26.942 17.435 689 H THR 97 H THR 97 107.895 24.744 14.691 690 HA THR 97 HA THR 97 105.602 26.302 15.724 691 HB THR 97 HB THR 97 105.984 25.201 12.926 692 HG1 THR 97 HG1 THR 97 106.215 27.439 12.423 693 HG21 THR 97 3HG2 THR 97 103.846 26.850 14.280 694 HG22 THR 97 1HG2 THR 97 103.659 25.333 13.400 695 HG23 THR 97 2HG2 THR 97 104.034 26.819 12.526 696 H TYR 98 H TYR 98 103.571 25.144 15.861 697 HA TYR 98 HA TYR 98 103.911 22.198 15.932 698 HB2 TYR 98 1HB TYR 98 101.820 23.946 17.235 699 HB3 TYR 98 2HB TYR 98 101.921 22.201 17.370 700 HD1 TYR 98 HD1 TYR 98 103.892 21.164 18.552 701 HD2 TYR 98 HD2 TYR 98 103.135 25.393 18.586 702 HE1 TYR 98 HE1 TYR 98 105.399 21.419 20.505 703 HE2 TYR 98 HE2 TYR 98 104.643 25.646 20.538 704 HH TYR 98 HH TYR 98 105.712 24.495 22.196 705 H LYS 99 H LYS 99 103.089 21.116 14.304 706 HA LYS 99 HA LYS 99 100.733 22.190 12.866 707 HB2 LYS 99 1HB LYS 99 102.861 21.953 11.538 708 HB3 LYS 99 2HB LYS 99 102.773 20.214 11.820 709 HG2 LYS 99 1HG LYS 99 100.524 20.179 10.766 710 HG3 LYS 99 2HG LYS 99 100.673 21.903 10.430 711 HD2 LYS 99 1HD LYS 99 102.758 21.412 9.127 712 HD3 LYS 99 2HD LYS 99 102.445 19.691 9.359 713 HE2 LYS 99 1HE LYS 99 100.450 19.765 8.083 714 HE3 LYS 99 2HE LYS 99 100.366 21.525 8.166 715 HZ1 LYS 99 3HZ LYS 99 102.585 20.080 6.836 716 HZ2 LYS 99 1HZ LYS 99 102.204 21.730 6.727 717 HZ3 LYS 99 2HZ LYS 99 101.183 20.575 6.011 718 H HIS 100 H HIS 100 99.034 20.738 12.372 719 HA HIS 100 HA HIS 100 98.393 18.785 14.264 720 HB2 HIS 100 1HB HIS 100 97.447 19.079 11.411 721 HB3 HIS 100 2HB HIS 100 96.717 18.003 12.589 722 HD1 HIS 100 HD1 HIS 100 96.975 21.594 11.601 723 HD2 HIS 100 HD2 HIS 100 95.184 19.338 14.614 724 HE1 HIS 100 HE1 HIS 100 95.337 23.131 12.767 725 H ASP 101 H ASP 101 99.782 18.398 11.013 726 HA ASP 101 HA ASP 101 100.487 15.610 11.672 727 HB2 ASP 101 1HB ASP 101 99.249 16.098 9.542 728 HB3 ASP 101 2HB ASP 101 100.643 17.026 9.003 729 H THR 102 H THR 102 102.439 15.429 12.598 730 HA THR 102 HA THR 102 104.388 17.461 12.622 731 HB THR 102 HB THR 102 104.816 14.511 13.140 732 HG1 THR 102 HG1 THR 102 103.062 15.582 14.304 733 HG21 THR 102 3HG2 THR 102 106.252 17.009 14.082 734 HG22 THR 102 1HG2 THR 102 106.893 15.787 12.984 735 HG23 THR 102 2HG2 THR 102 106.578 15.379 14.670 736 H SER 103 H SER 103 104.154 14.493 10.685 737 HA SER 103 HA SER 103 106.229 15.585 8.879 738 HB2 SER 103 1HB SER 103 107.201 13.383 8.631 739 HB3 SER 103 2HB SER 103 107.158 13.784 10.345 740 HG SER 103 HG SER 103 106.102 11.696 9.143 741 H ASP 104 H ASP 104 106.190 14.355 6.717 742 HA ASP 104 HA ASP 104 103.365 14.194 5.888 743 HB2 ASP 104 1HB ASP 104 105.911 14.418 4.260 744 HB3 ASP 104 2HB ASP 104 104.284 14.353 3.586 745 H TYR 105 H TYR 105 102.467 12.285 5.195 746 HA TYR 105 HA TYR 105 104.265 9.961 4.918 747 HB2 TYR 105 1HB TYR 105 102.905 8.621 6.353 748 HB3 TYR 105 2HB TYR 105 103.371 10.067 7.223 749 HD1 TYR 105 HD1 TYR 105 101.696 11.867 7.643 750 HD2 TYR 105 HD2 TYR 105 100.619 8.117 5.847 751 HE1 TYR 105 HE1 TYR 105 99.308 12.314 8.140 752 HE2 TYR 105 HE2 TYR 105 98.230 8.565 6.342 753 HH TYR 105 HH TYR 105 97.208 11.633 7.827 754 H GLY 106 H GLY 106 103.439 8.188 3.769 755 HA2 GLY 106 1HA GLY 106 100.854 8.462 2.425 756 HA3 GLY 106 2HA GLY 106 102.282 8.423 1.393 757 H PHE 107 H PHE 107 100.551 6.467 0.931 758 HA PHE 107 HA PHE 107 101.519 4.091 2.428 759 HB2 PHE 107 1HB PHE 107 98.912 4.503 0.957 760 HB3 PHE 107 2HB PHE 107 99.414 3.009 1.725 761 HD1 PHE 107 HD1 PHE 107 99.602 2.882 4.210 762 HD2 PHE 107 HD2 PHE 107 98.030 6.344 2.211 763 HE1 PHE 107 HE1 PHE 107 98.610 3.665 6.344 764 HE2 PHE 107 HE2 PHE 107 97.038 7.127 4.345 765 HZ PHE 107 HZ PHE 107 97.329 5.786 6.411 766 H SER 108 H SER 108 102.218 2.284 1.255 767 HA SER 108 HA SER 108 102.374 2.624 -1.684 768 HB2 SER 108 1HB SER 108 104.639 1.724 0.111 769 HB3 SER 108 2HB SER 108 104.683 1.841 -1.646 770 HG SER 108 HG SER 108 104.566 3.865 0.306 771 H TYR 109 H TYR 109 102.330 0.771 -2.891 772 HA TYR 109 HA TYR 109 102.294 -1.839 -1.566 773 HB2 TYR 109 1HB TYR 109 99.945 -1.073 -1.568 774 HB3 TYR 109 2HB TYR 109 100.028 -0.849 -3.305 775 HD1 TYR 109 HD2 TYR 109 99.840 -3.289 -0.564 776 HD2 TYR 109 HD1 TYR 109 100.047 -2.770 -4.822 777 HE1 TYR 109 HE2 TYR 109 99.163 -5.653 -0.884 778 HE2 TYR 109 HE1 TYR 109 99.369 -5.134 -5.143 779 HH TYR 109 HH TYR 109 98.677 -6.998 -4.148 780 H GLY 110 H GLY 110 102.760 -3.574 -3.010 781 HA2 GLY 110 1HA GLY 110 102.850 -3.259 -5.841 782 HA3 GLY 110 2HA GLY 110 104.457 -3.044 -5.158 783 H ALA 111 H ALA 111 104.507 -5.017 -6.766 784 HA ALA 111 HA ALA 111 104.540 -7.413 -5.073 785 HB1 ALA 111 1HB ALA 111 103.148 -7.219 -7.753 786 HB2 ALA 111 2HB ALA 111 102.425 -7.645 -6.202 787 HB3 ALA 111 3HB ALA 111 103.566 -8.746 -6.975 788 H GLY 112 H GLY 112 105.915 -9.125 -5.976 789 HA2 GLY 112 1HA GLY 112 107.738 -8.279 -8.111 790 HA3 GLY 112 2HA GLY 112 108.437 -8.538 -6.519 791 H LEU 113 H LEU 113 109.226 -9.966 -8.765 792 HA LEU 113 HA LEU 113 108.324 -12.701 -8.093 793 HB2 LEU 113 1HB LEU 113 107.466 -11.943 -10.316 794 HB3 LEU 113 2HB LEU 113 109.132 -11.711 -10.838 795 HG LEU 113 HG LEU 113 109.477 -14.185 -10.116 796 HD11 LEU 113 1HD1 LEU 113 107.600 -15.549 -9.873 797 HD12 LEU 113 2HD1 LEU 113 106.539 -14.410 -10.702 798 HD13 LEU 113 3HD1 LEU 113 107.072 -14.079 -9.055 799 HD21 LEU 113 3HD2 LEU 113 107.662 -13.680 -12.487 800 HD22 LEU 113 1HD2 LEU 113 108.899 -14.927 -12.324 801 HD23 LEU 113 2HD2 LEU 113 109.369 -13.233 -12.474 802 H GLN 114 H GLN 114 109.918 -14.176 -7.762 803 HA GLN 114 HA GLN 114 112.717 -13.257 -8.079 804 HB2 GLN 114 1HB GLN 114 111.972 -13.716 -5.749 805 HB3 GLN 114 2HB GLN 114 111.592 -15.371 -6.222 806 HG2 GLN 114 1HG GLN 114 113.935 -15.756 -6.839 807 HG3 GLN 114 2HG GLN 114 114.331 -14.089 -6.430 808 HE21 GLN 114 1HE2 GLN 114 115.749 -16.029 -5.075 809 HE22 GLN 114 2HE2 GLN 114 115.213 -16.151 -3.470 810 H PHE 115 H PHE 115 113.975 -14.355 -9.525 811 HA PHE 115 HA PHE 115 113.053 -17.025 -10.404 812 HB2 PHE 115 1HB PHE 115 113.283 -16.495 -12.703 813 HB3 PHE 115 2HB PHE 115 112.231 -15.297 -11.980 814 HD1 PHE 115 HD1 PHE 115 115.506 -15.937 -13.515 815 HD2 PHE 115 HD2 PHE 115 112.939 -12.962 -11.780 816 HE1 PHE 115 HE1 PHE 115 116.933 -14.150 -14.473 817 HE2 PHE 115 HE2 PHE 115 114.367 -11.175 -12.737 818 HZ PHE 115 HZ PHE 115 116.363 -11.768 -14.085 819 H ASN 116 H ASN 116 114.646 -18.247 -11.571 820 HA ASN 116 HA ASN 116 116.699 -19.208 -11.794 821 HB2 ASN 116 1HB ASN 116 117.329 -16.724 -12.393 822 HB3 ASN 116 2HB ASN 116 118.129 -16.766 -10.823 823 HD21 ASN 116 1HD2 ASN 116 118.283 -17.925 -14.124 824 HD22 ASN 116 2HD2 ASN 116 119.741 -18.780 -13.957 825 HA PRO 117 HA PRO 117 117.051 -19.652 -7.213 826 HB2 PRO 117 1HB PRO 117 115.402 -21.704 -6.700 827 HB3 PRO 117 2HB PRO 117 114.776 -20.056 -6.909 828 HG2 PRO 117 1HG PRO 117 114.682 -22.358 -8.763 829 HG3 PRO 117 2HG PRO 117 113.526 -21.036 -8.535 830 HD2 PRO 117 1HD PRO 117 115.492 -21.218 -10.569 831 HD3 PRO 117 2HD PRO 117 114.490 -19.803 -10.178 832 H MET 118 H MET 118 117.204 -21.948 -9.852 833 HA MET 118 HA MET 118 118.201 -24.217 -8.580 834 HB2 MET 118 1HB MET 118 118.825 -23.123 -11.330 835 HB3 MET 118 2HB MET 118 119.240 -24.750 -10.785 836 HG2 MET 118 1HG MET 118 116.805 -25.120 -10.266 837 HG3 MET 118 2HG MET 118 116.461 -23.568 -11.025 838 HE1 MET 118 3HE MET 118 117.357 -22.873 -13.133 839 HE2 MET 118 1HE MET 118 117.309 -23.850 -14.605 840 HE3 MET 118 2HE MET 118 118.781 -23.779 -13.638 841 H GLU 119 H GLU 119 119.892 -21.284 -9.601 842 HA GLU 119 HA GLU 119 122.464 -22.378 -8.743 843 HB2 GLU 119 1HB GLU 119 121.725 -19.669 -9.881 844 HB3 GLU 119 2HB GLU 119 123.366 -20.212 -9.531 845 HG2 GLU 119 1HG GLU 119 123.035 -22.121 -11.092 846 HG3 GLU 119 2HG GLU 119 121.441 -21.495 -11.488 847 H ASN 120 H ASN 120 123.826 -20.638 -7.459 848 HA ASN 120 HA ASN 120 122.446 -20.299 -4.939 849 HB2 ASN 120 1HB ASN 120 125.260 -19.543 -5.739 850 HB3 ASN 120 2HB ASN 120 124.625 -19.579 -4.094 851 HD21 ASN 120 1HD2 ASN 120 123.149 -21.978 -4.119 852 HD22 ASN 120 2HD2 ASN 120 124.202 -23.281 -4.389 853 H VAL 121 H VAL 121 122.240 -18.405 -7.583 854 HA VAL 121 HA VAL 121 121.892 -15.986 -5.934 855 HB VAL 121 HB VAL 121 124.006 -15.774 -7.181 856 HG11 VAL 121 1HG1 VAL 121 124.059 -15.787 -9.595 857 HG12 VAL 121 2HG1 VAL 121 122.308 -15.973 -9.681 858 HG13 VAL 121 3HG1 VAL 121 123.306 -17.292 -9.067 859 HG21 VAL 121 3HG2 VAL 121 123.449 -13.652 -8.365 860 HG22 VAL 121 1HG2 VAL 121 122.698 -13.751 -6.773 861 HG23 VAL 121 2HG2 VAL 121 121.738 -14.051 -8.222 862 H ALA 122 H ALA 122 120.091 -14.784 -6.403 863 HA ALA 122 HA ALA 122 118.458 -15.585 -8.731 864 HB1 ALA 122 1HB ALA 122 117.652 -15.536 -5.837 865 HB2 ALA 122 2HB ALA 122 117.333 -16.768 -7.057 866 HB3 ALA 122 3HB ALA 122 116.459 -15.238 -7.101 867 H LEU 123 H LEU 123 116.840 -13.960 -9.323 868 HA LEU 123 HA LEU 123 117.762 -11.231 -8.596 869 HB2 LEU 123 1HB LEU 123 116.640 -12.182 -11.239 870 HB3 LEU 123 2HB LEU 123 117.182 -10.547 -10.869 871 HG LEU 123 HG LEU 123 118.945 -13.014 -10.768 872 HD11 LEU 123 1HD1 LEU 123 120.000 -11.958 -12.797 873 HD12 LEU 123 2HD1 LEU 123 118.659 -10.813 -12.835 874 HD13 LEU 123 3HD1 LEU 123 118.355 -12.534 -13.071 875 HD21 LEU 123 3HD2 LEU 123 119.463 -10.048 -10.415 876 HD22 LEU 123 1HD2 LEU 123 120.749 -11.220 -10.711 877 HD23 LEU 123 2HD2 LEU 123 119.767 -11.336 -9.250 878 H ASP 124 H ASP 124 116.182 -9.632 -8.327 879 HA ASP 124 HA ASP 124 113.395 -10.634 -8.138 880 HB2 ASP 124 1HB ASP 124 114.486 -10.365 -5.911 881 HB3 ASP 124 2HB ASP 124 114.748 -8.663 -6.283 882 H PHE 125 H PHE 125 111.997 -9.532 -9.304 883 HA PHE 125 HA PHE 125 112.615 -6.724 -10.043 884 HB2 PHE 125 1HB PHE 125 112.676 -8.302 -11.962 885 HB3 PHE 125 2HB PHE 125 111.024 -8.768 -11.606 886 HD1 PHE 125 HD1 PHE 125 109.160 -7.255 -12.082 887 HD2 PHE 125 HD2 PHE 125 113.217 -6.144 -12.951 888 HE1 PHE 125 HE1 PHE 125 108.345 -5.394 -13.506 889 HE2 PHE 125 HE2 PHE 125 112.402 -4.283 -14.374 890 HZ PHE 125 HZ PHE 125 109.967 -3.909 -14.651 891 H SER 126 H SER 126 111.166 -5.267 -9.292 892 HA SER 126 HA SER 126 108.420 -6.146 -8.732 893 HB2 SER 126 1HB SER 126 109.704 -6.442 -6.630 894 HB3 SER 126 2HB SER 126 110.150 -4.740 -6.688 895 HG SER 126 HG SER 126 108.023 -4.190 -6.426 896 H TYR 127 H TYR 127 106.888 -4.559 -8.860 897 HA TYR 127 HA TYR 127 107.822 -1.828 -9.537 898 HB2 TYR 127 1HB TYR 127 105.863 -1.580 -10.915 899 HB3 TYR 127 2HB TYR 127 106.732 -3.017 -11.413 900 HD1 TYR 127 HD1 TYR 127 105.832 -5.274 -10.871 901 HD2 TYR 127 HD2 TYR 127 103.643 -1.680 -10.009 902 HE1 TYR 127 HE1 TYR 127 103.757 -6.603 -10.597 903 HE2 TYR 127 HE2 TYR 127 101.568 -3.010 -9.736 904 HH TYR 127 HH TYR 127 100.791 -5.427 -10.731 905 H GLU 128 H GLU 128 107.326 -0.338 -8.070 906 HA GLU 128 HA GLU 128 105.115 -0.895 -6.171 907 HB2 GLU 128 1HB GLU 128 107.418 -1.076 -5.202 908 HB3 GLU 128 2HB GLU 128 107.667 0.623 -5.602 909 HG2 GLU 128 1HG GLU 128 105.671 1.206 -4.233 910 HG3 GLU 128 2HG GLU 128 105.513 -0.485 -3.781 911 H GLN 129 H GLN 129 103.647 0.665 -5.838 912 HA GLN 129 HA GLN 129 104.159 3.358 -6.961 913 HB2 GLN 129 1HB GLN 129 101.571 1.780 -6.988 914 HB3 GLN 129 2HB GLN 129 101.728 3.468 -7.477 915 HG2 GLN 129 1HG GLN 129 103.301 2.845 -9.241 916 HG3 GLN 129 2HG GLN 129 103.245 1.161 -8.728 917 HE21 GLN 129 1HE2 GLN 129 102.511 1.945 -11.385 918 HE22 GLN 129 2HE2 GLN 129 100.848 1.668 -11.581 919 H SER 130 H SER 130 103.413 5.091 -5.718 920 HA SER 130 HA SER 130 102.191 4.434 -3.112 921 HB2 SER 130 1HB SER 130 104.649 4.594 -2.812 922 HB3 SER 130 2HB SER 130 104.604 6.223 -3.477 923 HG SER 130 HG SER 130 103.245 5.269 -1.166 924 H ARG 131 H ARG 131 100.911 6.008 -2.233 925 HA ARG 131 HA ARG 131 100.469 8.446 -3.863 926 HB2 ARG 131 1HB ARG 131 98.562 6.821 -3.889 927 HB3 ARG 131 2HB ARG 131 98.438 7.005 -2.139 928 HG2 ARG 131 1HG ARG 131 98.029 9.407 -2.393 929 HG3 ARG 131 2HG ARG 131 98.219 9.271 -4.142 930 HD2 ARG 131 1HD ARG 131 95.856 9.259 -3.677 931 HD3 ARG 131 2HD ARG 131 96.312 7.621 -4.137 932 HE ARG 131 HE ARG 131 95.825 6.919 -1.982 933 HH11 ARG 131 1HH1 ARG 131 95.944 10.428 -2.008 934 HH12 ARG 131 2HH1 ARG 131 95.320 10.561 -0.397 935 HH21 ARG 131 1HH2 ARG 131 95.026 7.154 0.087 936 HH22 ARG 131 2HH2 ARG 131 94.807 8.729 0.772 937 H ILE 132 H ILE 132 100.932 10.285 -2.852 938 HA ILE 132 HA ILE 132 100.917 10.361 0.089 939 HB ILE 132 HB ILE 132 103.250 10.059 -0.514 940 HG12 ILE 132 1HG1 ILE 132 102.849 12.992 0.099 941 HG13 ILE 132 2HG1 ILE 132 102.535 11.719 1.280 942 HG21 ILE 132 1HG2 ILE 132 102.775 11.194 -2.882 943 HG22 ILE 132 2HG2 ILE 132 104.383 11.178 -2.166 944 HG23 ILE 132 3HG2 ILE 132 103.379 12.621 -2.041 945 HD11 ILE 132 3HD1 ILE 132 104.825 10.973 1.195 946 HD12 ILE 132 1HD1 ILE 132 104.854 12.722 1.414 947 HD13 ILE 132 2HD1 ILE 132 105.174 12.025 -0.175 948 H ARG 133 H ARG 133 99.164 11.557 0.306 949 HA ARG 133 HA ARG 133 97.345 12.719 -0.668 950 HB2 ARG 133 1HB ARG 133 99.307 14.695 0.488 951 HB3 ARG 133 2HB ARG 133 97.608 15.048 0.169 952 HG2 ARG 133 1HG ARG 133 96.980 13.125 1.638 953 HG3 ARG 133 2HG ARG 133 98.686 12.914 2.033 954 HD2 ARG 133 1HD ARG 133 97.029 15.396 2.553 955 HD3 ARG 133 2HD ARG 133 97.581 14.247 3.768 956 HE ARG 133 HE ARG 133 99.911 14.983 2.706 957 HH11 ARG 133 1HH1 ARG 133 97.190 17.003 3.633 958 HH12 ARG 133 2HH1 ARG 133 98.197 18.368 3.978 959 HH21 ARG 133 1HH2 ARG 133 101.152 16.774 3.173 960 HH22 ARG 133 2HH2 ARG 133 100.410 18.239 3.723 961 H SER 134 H SER 134 97.389 12.482 -2.939 962 HA SER 134 HA SER 134 96.795 13.557 -4.882 963 HB2 SER 134 1HB SER 134 96.333 15.590 -3.504 964 HB3 SER 134 2HB SER 134 98.001 16.087 -3.766 965 HG SER 134 HG SER 134 95.837 16.039 -5.495 966 H VAL 135 H VAL 135 99.996 13.273 -3.728 967 HA VAL 135 HA VAL 135 101.077 13.915 -6.402 968 HB VAL 135 HB VAL 135 102.551 13.378 -3.810 969 HG11 VAL 135 1HG1 VAL 135 104.502 14.203 -5.020 970 HG12 VAL 135 2HG1 VAL 135 103.518 14.514 -6.450 971 HG13 VAL 135 3HG1 VAL 135 103.795 12.857 -5.913 972 HG21 VAL 135 3HG2 VAL 135 102.087 16.010 -5.246 973 HG22 VAL 135 1HG2 VAL 135 102.918 15.777 -3.708 974 HG23 VAL 135 2HG2 VAL 135 101.182 15.489 -3.824 975 H ASP 136 H ASP 136 101.937 12.330 -7.663 976 HA ASP 136 HA ASP 136 101.483 9.561 -6.719 977 HB2 ASP 136 1HB ASP 136 101.710 10.623 -9.544 978 HB3 ASP 136 2HB ASP 136 101.345 8.961 -9.088 979 H VAL 137 H VAL 137 103.189 8.251 -6.405 980 HA VAL 137 HA VAL 137 105.809 9.083 -7.527 981 HB VAL 137 HB VAL 137 105.274 7.557 -4.964 982 HG11 VAL 137 1HG1 VAL 137 107.441 7.096 -6.173 983 HG12 VAL 137 2HG1 VAL 137 107.644 7.792 -4.565 984 HG13 VAL 137 3HG1 VAL 137 107.832 8.807 -5.996 985 HG21 VAL 137 3HG2 VAL 137 104.584 9.980 -4.912 986 HG22 VAL 137 1HG2 VAL 137 106.243 10.409 -5.327 987 HG23 VAL 137 2HG2 VAL 137 105.899 9.594 -3.801 988 H GLY 138 H GLY 138 106.774 7.676 -8.849 989 HA2 GLY 138 1HA GLY 138 105.825 4.862 -8.867 990 HA3 GLY 138 2HA GLY 138 106.220 5.749 -10.339 991 H THR 139 H THR 139 107.409 3.391 -8.494 992 HA THR 139 HA THR 139 110.224 4.249 -8.892 993 HB THR 139 HB THR 139 110.831 2.996 -6.888 994 HG1 THR 139 HG1 THR 139 109.213 1.457 -6.889 995 HG21 THR 139 3HG2 THR 139 109.766 4.461 -5.215 996 HG22 THR 139 1HG2 THR 139 108.545 4.927 -6.398 997 HG23 THR 139 2HG2 THR 139 110.232 5.376 -6.649 998 H TRP 140 H TRP 140 111.605 2.806 -9.749 999 HA TRP 140 HA TRP 140 110.580 0.100 -10.399 1000 HB2 TRP 140 1HB TRP 140 110.978 1.571 -12.371 1001 HB3 TRP 140 2HB TRP 140 112.647 1.746 -11.872 1002 HD1 TRP 140 HD1 TRP 140 110.256 -0.584 -13.614 1003 HE1 TRP 140 HE1 TRP 140 111.563 -2.575 -14.596 1004 HE3 TRP 140 HE3 TRP 140 114.810 0.196 -11.441 1005 HZ2 TRP 140 HZ2 TRP 140 114.198 -3.694 -14.474 1006 HZ3 TRP 140 HZ3 TRP 140 116.696 -1.342 -11.888 1007 HH2 TRP 140 HH2 TRP 140 116.399 -3.285 -13.399 1008 H ILE 141 H ILE 141 111.634 -1.501 -9.361 1009 HA ILE 141 HA ILE 141 114.331 -0.924 -8.273 1010 HB ILE 141 HB ILE 141 112.618 -0.727 -6.519 1011 HG12 ILE 141 1HG1 ILE 141 114.117 -3.316 -6.099 1012 HG13 ILE 141 2HG1 ILE 141 114.947 -1.760 -6.143 1013 HG21 ILE 141 1HG2 ILE 141 111.291 -2.662 -5.852 1014 HG22 ILE 141 2HG2 ILE 141 112.023 -3.635 -7.127 1015 HG23 ILE 141 3HG2 ILE 141 110.970 -2.284 -7.545 1016 HD11 ILE 141 3HD1 ILE 141 112.593 -2.315 -4.322 1017 HD12 ILE 141 1HD1 ILE 141 113.699 -0.943 -4.264 1018 HD13 ILE 141 2HD1 ILE 141 114.269 -2.553 -3.826 1019 H ALA 142 H ALA 142 115.824 -2.430 -8.541 1020 HA ALA 142 HA ALA 142 115.014 -5.216 -9.051 1021 HB1 ALA 142 1HB ALA 142 116.888 -3.580 -10.776 1022 HB2 ALA 142 2HB ALA 142 115.405 -4.394 -11.275 1023 HB3 ALA 142 3HB ALA 142 116.820 -5.342 -10.819 1024 H GLY 143 H GLY 143 116.469 -6.746 -8.219 1025 HA2 GLY 143 1HA GLY 143 119.034 -5.845 -7.167 1026 HA3 GLY 143 2HA GLY 143 117.838 -6.269 -5.950 1027 H VAL 144 H VAL 144 119.828 -7.736 -5.591 1028 HA VAL 144 HA VAL 144 119.249 -10.336 -6.835 1029 HB VAL 144 HB VAL 144 121.190 -9.399 -8.035 1030 HG11 VAL 144 1HG1 VAL 144 121.971 -7.942 -6.148 1031 HG12 VAL 144 2HG1 VAL 144 123.262 -8.899 -6.876 1032 HG13 VAL 144 3HG1 VAL 144 122.563 -9.389 -5.333 1033 HG21 VAL 144 3HG2 VAL 144 122.718 -11.282 -7.661 1034 HG22 VAL 144 1HG2 VAL 144 121.046 -11.838 -7.604 1035 HG23 VAL 144 2HG2 VAL 144 121.952 -11.614 -6.107 1036 H GLY 145 H GLY 145 119.725 -12.128 -5.462 1037 HA2 GLY 145 1HA GLY 145 120.467 -11.456 -2.690 1038 HA3 GLY 145 2HA GLY 145 118.922 -12.245 -2.991 1039 H TYR 146 H TYR 146 120.867 -13.346 -1.362 1040 HA TYR 146 HA TYR 146 121.735 -15.712 -2.908 1041 HB2 TYR 146 1HB TYR 146 123.267 -14.349 -0.688 1042 HB3 TYR 146 2HB TYR 146 123.742 -15.825 -1.504 1043 HD1 TYR 146 HD1 TYR 146 124.377 -15.745 -3.939 1044 HD2 TYR 146 HD2 TYR 146 123.699 -12.199 -1.611 1045 HE1 TYR 146 HE1 TYR 146 125.571 -14.397 -5.644 1046 HE2 TYR 146 HE2 TYR 146 124.894 -10.851 -3.316 1047 HH TYR 146 HH TYR 146 126.163 -12.356 -6.288 1048 H ARG 147 H ARG 147 121.464 -17.672 -1.896 1049 HA ARG 147 HA ARG 147 119.964 -17.619 0.654 1050 HB2 ARG 147 1HB ARG 147 118.812 -18.594 -1.339 1051 HB3 ARG 147 2HB ARG 147 120.082 -19.816 -1.422 1052 HG2 ARG 147 1HG ARG 147 119.521 -20.608 0.818 1053 HG3 ARG 147 2HG ARG 147 118.314 -19.334 0.993 1054 HD2 ARG 147 1HD ARG 147 117.143 -21.342 0.378 1055 HD3 ARG 147 2HD ARG 147 117.140 -20.283 -1.027 1056 HE ARG 147 HE ARG 147 118.619 -22.787 -0.720 1057 HH11 ARG 147 1HH1 ARG 147 118.099 -19.914 -2.675 1058 HH12 ARG 147 2HH1 ARG 147 118.772 -20.642 -4.094 1059 HH21 ARG 147 1HH2 ARG 147 119.475 -23.664 -2.581 1060 HH22 ARG 147 2HH2 ARG 147 119.540 -22.736 -4.041 1061 H PHE 148 H PHE 148 120.738 -18.669 2.399 1062 HA PHE 148 HA PHE 148 123.057 -20.466 2.071 1063 HB2 PHE 148 1HB PHE 148 122.815 -18.201 4.055 1064 HB3 PHE 148 2HB PHE 148 124.066 -19.429 4.090 1065 HD1 PHE 148 HD1 PHE 148 125.785 -19.514 2.291 1066 HD2 PHE 148 HD2 PHE 148 122.875 -16.363 2.517 1067 HE1 PHE 148 HE1 PHE 148 127.154 -18.140 0.747 1068 HE2 PHE 148 HE2 PHE 148 124.245 -14.988 0.972 1069 HZ PHE 148 HZ PHE 148 126.384 -15.876 0.087 Start of MODEL 15 1 H1 ALA 1 3H ALA 1 115.445 -23.192 9.749 2 H2 ALA 1 2H ALA 1 114.665 -22.763 8.301 3 H3 ALA 1 HT3 ALA 1 116.062 -21.932 8.795 4 HA ALA 1 HA ALA 1 117.102 -24.325 8.717 5 HB1 ALA 1 2HB ALA 1 115.171 -25.570 8.112 6 HB2 ALA 1 3HB ALA 1 116.092 -25.413 6.616 7 HB3 ALA 1 1HB ALA 1 114.689 -24.383 6.900 8 H THR 2 H THR 2 115.564 -22.475 6.072 9 HA THR 2 HA THR 2 118.272 -21.754 5.100 10 HB THR 2 HB THR 2 115.786 -22.178 3.423 11 HG1 THR 2 HG1 THR 2 116.371 -24.172 3.942 12 HG21 THR 2 3HG2 THR 2 117.468 -22.124 1.568 13 HG22 THR 2 1HG2 THR 2 118.697 -21.670 2.748 14 HG23 THR 2 2HG2 THR 2 117.338 -20.591 2.432 15 H SER 3 H SER 3 118.632 -19.647 4.572 16 HA SER 3 HA SER 3 116.376 -17.751 4.894 17 HB2 SER 3 1HB SER 3 119.235 -17.373 5.823 18 HB3 SER 3 2HB SER 3 117.943 -16.183 5.944 19 HG SER 3 HG SER 3 117.986 -18.774 7.121 20 H THR 4 H THR 4 116.435 -15.905 3.581 21 HA THR 4 HA THR 4 118.447 -15.932 1.404 22 HB THR 4 HB THR 4 115.517 -15.243 1.085 23 HG1 THR 4 HG1 THR 4 115.275 -17.251 0.254 24 HG21 THR 4 3HG2 THR 4 116.804 -14.128 -0.574 25 HG22 THR 4 1HG2 THR 4 116.205 -15.587 -1.363 26 HG23 THR 4 2HG2 THR 4 117.870 -15.517 -0.788 27 H VAL 5 H VAL 5 119.394 -14.002 1.002 28 HA VAL 5 HA VAL 5 118.139 -11.572 2.158 29 HB VAL 5 HB VAL 5 120.007 -12.315 3.588 30 HG11 VAL 5 1HG1 VAL 5 121.859 -11.788 1.266 31 HG12 VAL 5 2HG1 VAL 5 121.225 -13.402 1.585 32 HG13 VAL 5 3HG1 VAL 5 122.214 -12.589 2.797 33 HG21 VAL 5 3HG2 VAL 5 121.239 -10.203 3.592 34 HG22 VAL 5 1HG2 VAL 5 119.534 -9.891 3.267 35 HG23 VAL 5 2HG2 VAL 5 120.704 -9.861 1.947 36 H THR 6 H THR 6 118.033 -9.861 0.810 37 HA THR 6 HA THR 6 119.706 -9.846 -1.603 38 HB THR 6 HB THR 6 117.601 -10.972 -2.221 39 HG1 THR 6 HG1 THR 6 117.832 -8.339 -3.236 40 HG21 THR 6 3HG2 THR 6 115.505 -9.619 -2.247 41 HG22 THR 6 1HG2 THR 6 116.335 -8.382 -1.303 42 HG23 THR 6 2HG2 THR 6 116.073 -9.986 -0.618 43 H GLY 7 H GLY 7 119.844 -7.804 -2.645 44 HA2 GLY 7 1HA GLY 7 118.738 -5.498 -1.183 45 HA3 GLY 7 2HA GLY 7 120.477 -5.564 -1.479 46 H GLY 8 H GLY 8 118.545 -3.597 -2.526 47 HA2 GLY 8 1HA GLY 8 119.158 -3.919 -5.367 48 HA3 GLY 8 2HA GLY 8 117.453 -3.880 -4.945 49 H TYR 9 H TYR 9 118.339 -2.057 -6.643 50 HA TYR 9 HA TYR 9 118.478 0.461 -5.087 51 HB2 TYR 9 1HB TYR 9 119.382 0.025 -7.936 52 HB3 TYR 9 2HB TYR 9 119.599 1.470 -6.968 53 HD1 TYR 9 HD2 TYR 9 121.315 1.568 -5.224 54 HD2 TYR 9 HD1 TYR 9 120.756 -1.957 -7.612 55 HE1 TYR 9 HE2 TYR 9 123.506 0.698 -4.452 56 HE2 TYR 9 HE1 TYR 9 122.946 -2.827 -6.842 57 HH TYR 9 HH TYR 9 125.094 -0.867 -4.822 58 H ALA 10 H ALA 10 116.983 2.053 -5.606 59 HA ALA 10 HA ALA 10 115.131 1.519 -7.837 60 HB1 ALA 10 1HB ALA 10 113.989 2.508 -5.262 61 HB2 ALA 10 2HB ALA 10 114.338 0.786 -5.417 62 HB3 ALA 10 3HB ALA 10 113.226 1.566 -6.543 63 H GLN 11 H GLN 11 114.331 3.299 -8.842 64 HA GLN 11 HA GLN 11 115.062 5.955 -7.749 65 HB2 GLN 11 1HB GLN 11 114.909 5.073 -10.646 66 HB3 GLN 11 2HB GLN 11 115.195 6.728 -10.105 67 HG2 GLN 11 1HG GLN 11 117.201 5.911 -8.849 68 HG3 GLN 11 2HG GLN 11 116.948 4.322 -9.548 69 HE21 GLN 11 1HE2 GLN 11 116.128 6.426 -12.063 70 HE22 GLN 11 2HE2 GLN 11 117.659 6.556 -12.780 71 H SER 12 H SER 12 113.444 7.537 -7.794 72 HA SER 12 HA SER 12 110.762 6.576 -8.634 73 HB2 SER 12 1HB SER 12 109.819 7.608 -6.642 74 HB3 SER 12 2HB SER 12 111.050 6.438 -6.177 75 HG SER 12 HG SER 12 110.947 9.107 -5.754 76 H ASP 13 H ASP 13 109.362 8.077 -9.443 77 HA ASP 13 HA ASP 13 110.346 10.845 -9.775 78 HB2 ASP 13 1HB ASP 13 109.369 10.849 -12.045 79 HB3 ASP 13 2HB ASP 13 110.659 9.657 -11.897 80 H ALA 14 H ALA 14 108.779 12.424 -9.552 81 HA ALA 14 HA ALA 14 106.240 11.470 -8.414 82 HB1 ALA 14 1HB ALA 14 107.664 14.126 -8.131 83 HB2 ALA 14 2HB ALA 14 107.588 12.851 -6.914 84 HB3 ALA 14 3HB ALA 14 106.123 13.716 -7.379 85 H GLN 15 H GLN 15 104.798 11.345 -9.956 86 HA GLN 15 HA GLN 15 104.586 13.081 -12.203 87 HB2 GLN 15 1HB GLN 15 103.654 10.768 -12.134 88 HB3 GLN 15 2HB GLN 15 102.443 11.325 -10.980 89 HG2 GLN 15 1HG GLN 15 101.723 13.044 -12.664 90 HG3 GLN 15 2HG GLN 15 102.822 12.298 -13.823 91 HE21 GLN 15 1HE2 GLN 15 101.719 10.901 -15.190 92 HE22 GLN 15 2HE2 GLN 15 100.403 9.930 -14.737 93 H GLY 16 H GLY 16 103.843 15.038 -12.287 94 HA2 GLY 16 1HA GLY 16 102.368 16.832 -11.870 95 HA3 GLY 16 2HA GLY 16 101.862 16.049 -10.380 96 H GLN 17 H GLN 17 104.924 15.638 -9.847 97 HA GLN 17 HA GLN 17 105.581 18.432 -9.122 98 HB2 GLN 17 1HB GLN 17 106.577 15.893 -7.808 99 HB3 GLN 17 2HB GLN 17 106.937 17.542 -7.307 100 HG2 GLN 17 1HG GLN 17 104.194 16.253 -7.330 101 HG3 GLN 17 2HG GLN 17 105.169 16.580 -5.901 102 HE21 GLN 17 1HE2 GLN 17 102.499 17.746 -7.285 103 HE22 GLN 17 2HE2 GLN 17 102.685 19.409 -7.009 104 H MET 18 H MET 18 107.836 19.042 -9.333 105 HA MET 18 HA MET 18 109.271 17.477 -11.384 106 HB2 MET 18 1HB MET 18 109.655 20.314 -10.397 107 HB3 MET 18 2HB MET 18 110.664 19.530 -11.613 108 HG2 MET 18 1HG MET 18 108.635 19.148 -13.006 109 HG3 MET 18 2HG MET 18 107.681 20.031 -11.815 110 HE1 MET 18 3HE MET 18 106.789 21.608 -13.515 111 HE2 MET 18 1HE MET 18 107.687 20.859 -14.840 112 HE3 MET 18 2HE MET 18 107.723 22.607 -14.625 113 H ASN 19 H ASN 19 110.318 15.873 -10.236 114 HA ASN 19 HA ASN 19 112.685 16.539 -8.839 115 HB2 ASN 19 1HB ASN 19 112.053 15.750 -6.582 116 HB3 ASN 19 2HB ASN 19 111.188 17.214 -7.042 117 HD21 ASN 19 1HD2 ASN 19 109.112 17.019 -6.181 118 HD22 ASN 19 2HD2 ASN 19 108.139 15.634 -6.311 119 H LYS 20 H LYS 20 113.945 14.745 -8.305 120 HA LYS 20 HA LYS 20 112.790 12.075 -8.804 121 HB2 LYS 20 1HB LYS 20 115.434 13.114 -9.861 122 HB3 LYS 20 2HB LYS 20 114.901 11.435 -9.950 123 HG2 LYS 20 1HG LYS 20 112.888 12.178 -11.222 124 HG3 LYS 20 2HG LYS 20 113.527 13.823 -11.212 125 HD2 LYS 20 1HD LYS 20 115.586 12.986 -12.353 126 HD3 LYS 20 2HD LYS 20 114.837 11.392 -12.460 127 HE2 LYS 20 1HE LYS 20 113.159 12.143 -13.938 128 HE3 LYS 20 2HE LYS 20 113.435 13.837 -13.529 129 HZ1 LYS 20 3HZ LYS 20 114.366 13.158 -15.705 130 HZ2 LYS 20 1HZ LYS 20 115.427 12.113 -14.895 131 HZ3 LYS 20 2HZ LYS 20 115.527 13.790 -14.637 132 H MET 21 H MET 21 113.682 10.408 -7.519 133 HA MET 21 HA MET 21 115.666 11.255 -5.493 134 HB2 MET 21 1HB MET 21 113.051 9.835 -4.928 135 HB3 MET 21 2HB MET 21 114.328 10.134 -3.747 136 HG2 MET 21 1HG MET 21 114.111 12.591 -4.235 137 HG3 MET 21 2HG MET 21 112.708 12.215 -5.236 138 HE1 MET 21 3HE MET 21 114.523 11.954 -2.152 139 HE2 MET 21 1HE MET 21 113.614 10.673 -1.341 140 HE3 MET 21 2HE MET 21 113.395 12.353 -0.859 141 H GLY 22 H GLY 22 116.730 9.449 -4.408 142 HA2 GLY 22 1HA GLY 22 116.539 6.880 -5.859 143 HA3 GLY 22 2HA GLY 22 118.106 7.674 -5.701 144 H GLY 23 H GLY 23 116.850 5.095 -4.563 145 HA2 GLY 23 1HA GLY 23 117.878 5.482 -1.846 146 HA3 GLY 23 2HA GLY 23 116.215 4.941 -2.006 147 H PHE 24 H PHE 24 117.927 3.413 -0.629 148 HA PHE 24 HA PHE 24 118.470 1.106 -2.414 149 HB2 PHE 24 1HB PHE 24 119.894 1.779 0.167 150 HB3 PHE 24 2HB PHE 24 120.276 0.471 -0.936 151 HD1 PHE 24 HD1 PHE 24 121.419 0.922 -3.073 152 HD2 PHE 24 HD2 PHE 24 120.523 4.070 -0.291 153 HE1 PHE 24 HE1 PHE 24 122.988 2.427 -4.267 154 HE2 PHE 24 HE2 PHE 24 122.092 5.573 -1.486 155 HZ PHE 24 HZ PHE 24 123.324 4.751 -3.474 156 H ASN 25 H ASN 25 117.915 -0.973 -1.538 157 HA ASN 25 HA ASN 25 116.283 -0.894 0.936 158 HB2 ASN 25 1HB ASN 25 114.638 -2.364 -0.139 159 HB3 ASN 25 2HB ASN 25 114.775 -0.831 -0.999 160 HD21 ASN 25 1HD2 ASN 25 115.958 -0.844 -3.081 161 HD22 ASN 25 2HD2 ASN 25 116.171 -2.296 -3.933 162 H LEU 26 H LEU 26 116.471 -2.607 2.268 163 HA LEU 26 HA LEU 26 118.124 -4.899 1.375 164 HB2 LEU 26 1HB LEU 26 118.170 -3.319 3.939 165 HB3 LEU 26 2HB LEU 26 118.625 -5.016 3.952 166 HG LEU 26 HG LEU 26 120.574 -3.504 3.721 167 HD11 LEU 26 1HD1 LEU 26 120.323 -4.928 1.097 168 HD12 LEU 26 2HD1 LEU 26 120.300 -5.856 2.596 169 HD13 LEU 26 3HD1 LEU 26 121.695 -4.850 2.201 170 HD21 LEU 26 3HD2 LEU 26 120.834 -1.963 2.029 171 HD22 LEU 26 1HD2 LEU 26 119.080 -1.910 2.193 172 HD23 LEU 26 2HD2 LEU 26 119.817 -2.858 0.902 173 H LYS 27 H LYS 27 117.304 -6.922 1.863 174 HA LYS 27 HA LYS 27 114.697 -6.971 3.272 175 HB2 LYS 27 1HB LYS 27 115.395 -8.325 0.665 176 HB3 LYS 27 2HB LYS 27 113.891 -8.557 1.557 177 HG2 LYS 27 1HG LYS 27 113.459 -6.107 1.389 178 HG3 LYS 27 2HG LYS 27 114.904 -5.948 0.391 179 HD2 LYS 27 1HD LYS 27 113.919 -7.586 -1.220 180 HD3 LYS 27 2HD LYS 27 112.441 -7.591 -0.257 181 HE2 LYS 27 1HE LYS 27 112.190 -5.166 -0.611 182 HE3 LYS 27 2HE LYS 27 113.669 -5.151 -1.572 183 HZ1 LYS 27 3HZ LYS 27 112.569 -6.829 -3.036 184 HZ2 LYS 27 1HZ LYS 27 111.864 -5.286 -3.070 185 HZ3 LYS 27 2HZ LYS 27 111.124 -6.537 -2.191 186 H TYR 28 H TYR 28 114.251 -8.714 4.495 187 HA TYR 28 HA TYR 28 116.182 -10.966 4.490 188 HB2 TYR 28 1HB TYR 28 115.894 -11.186 6.868 189 HB3 TYR 28 2HB TYR 28 116.385 -9.543 6.507 190 HD1 TYR 28 HD2 TYR 28 114.842 -7.669 6.824 191 HD2 TYR 28 HD1 TYR 28 113.664 -11.706 7.701 192 HE1 TYR 28 HE2 TYR 28 112.875 -6.823 8.077 193 HE2 TYR 28 HE1 TYR 28 111.697 -10.861 8.953 194 HH TYR 28 HH TYR 28 110.462 -9.052 9.430 195 H ARG 29 H ARG 29 115.325 -13.018 4.491 196 HA ARG 29 HA ARG 29 112.395 -13.284 4.618 197 HB2 ARG 29 1HB ARG 29 113.078 -12.990 2.242 198 HB3 ARG 29 2HB ARG 29 114.091 -14.425 2.391 199 HG2 ARG 29 1HG ARG 29 112.089 -15.753 3.013 200 HG3 ARG 29 2HG ARG 29 111.087 -14.319 2.786 201 HD2 ARG 29 1HD ARG 29 111.890 -14.184 0.427 202 HD3 ARG 29 2HD ARG 29 112.768 -15.691 0.671 203 HE ARG 29 HE ARG 29 110.212 -16.307 1.404 204 HH11 ARG 29 1HH1 ARG 29 111.585 -14.902 -1.505 205 HH12 ARG 29 2HH1 ARG 29 110.347 -15.556 -2.525 206 HH21 ARG 29 1HH2 ARG 29 108.647 -17.123 0.040 207 HH22 ARG 29 2HH2 ARG 29 108.704 -16.796 -1.659 208 H TYR 30 H TYR 30 111.660 -15.167 5.476 209 HA TYR 30 HA TYR 30 113.658 -17.267 6.105 210 HB2 TYR 30 1HB TYR 30 111.311 -16.351 7.771 211 HB3 TYR 30 2HB TYR 30 112.322 -17.737 8.134 212 HD1 TYR 30 HD2 TYR 30 114.606 -17.449 8.959 213 HD2 TYR 30 HD1 TYR 30 112.114 -14.067 8.059 214 HE1 TYR 30 HE2 TYR 30 116.170 -15.969 10.189 215 HE2 TYR 30 HE1 TYR 30 113.677 -12.589 9.290 216 HH TYR 30 HH TYR 30 116.566 -13.911 10.912 217 H GLU 31 H GLU 31 113.042 -19.385 5.787 218 HA GLU 31 HA GLU 31 110.322 -19.871 4.737 219 HB2 GLU 31 1HB GLU 31 112.911 -20.824 3.493 220 HB3 GLU 31 2HB GLU 31 111.296 -21.314 2.981 221 HG2 GLU 31 1HG GLU 31 110.743 -18.927 2.544 222 HG3 GLU 31 2HG GLU 31 112.391 -18.488 2.972 223 H GLU 32 H GLU 32 109.483 -21.917 5.102 224 HA GLU 32 HA GLU 32 110.934 -23.544 7.086 225 HB2 GLU 32 1HB GLU 32 108.627 -22.727 7.633 226 HB3 GLU 32 2HB GLU 32 108.021 -23.701 6.294 227 HG2 GLU 32 1HG GLU 32 109.026 -25.720 7.345 228 HG3 GLU 32 2HG GLU 32 109.529 -24.734 8.709 229 H ASP 33 H ASP 33 111.324 -25.725 6.755 230 HA ASP 33 HA ASP 33 111.862 -26.423 4.059 231 HB2 ASP 33 1HB ASP 33 111.931 -28.084 6.580 232 HB3 ASP 33 2HB ASP 33 112.558 -28.608 5.021 233 H ASN 34 H ASN 34 109.366 -27.605 6.344 234 HA ASN 34 HA ASN 34 108.326 -29.330 4.180 235 HB2 ASN 34 1HB ASN 34 107.848 -29.394 7.159 236 HB3 ASN 34 2HB ASN 34 107.106 -30.490 5.995 237 HD21 ASN 34 1HD2 ASN 34 108.902 -31.347 8.127 238 HD22 ASN 34 2HD2 ASN 34 110.282 -32.003 7.386 239 H SER 35 H SER 35 107.530 -26.423 5.850 240 HA SER 35 HA SER 35 105.025 -26.336 4.345 241 HB2 SER 35 1HB SER 35 105.222 -26.306 7.329 242 HB3 SER 35 2HB SER 35 104.039 -25.254 6.559 243 HG SER 35 HG SER 35 102.970 -26.971 5.841 244 HA PRO 36 HA PRO 36 107.756 -22.604 4.521 245 HB2 PRO 36 1HB PRO 36 107.903 -22.017 1.872 246 HB3 PRO 36 2HB PRO 36 108.921 -23.250 2.641 247 HG2 PRO 36 1HG PRO 36 106.477 -23.583 0.987 248 HG3 PRO 36 2HG PRO 36 107.955 -24.561 1.034 249 HD2 PRO 36 1HD PRO 36 105.609 -25.273 2.296 250 HD3 PRO 36 2HD PRO 36 107.219 -25.833 2.798 251 H LEU 37 H LEU 37 107.007 -20.662 4.967 252 HA LEU 37 HA LEU 37 104.893 -19.482 3.268 253 HB2 LEU 37 1HB LEU 37 104.171 -19.992 5.658 254 HB3 LEU 37 2HB LEU 37 105.370 -18.811 6.183 255 HG LEU 37 HG LEU 37 103.389 -18.035 4.064 256 HD11 LEU 37 1HD1 LEU 37 102.805 -17.768 7.018 257 HD12 LEU 37 2HD1 LEU 37 102.192 -19.113 6.058 258 HD13 LEU 37 3HD1 LEU 37 101.719 -17.461 5.664 259 HD21 LEU 37 3HD2 LEU 37 104.951 -16.333 4.420 260 HD22 LEU 37 1HD2 LEU 37 105.104 -16.697 6.139 261 HD23 LEU 37 2HD2 LEU 37 103.671 -15.865 5.537 262 H GLY 38 H GLY 38 105.534 -17.551 2.296 263 HA2 GLY 38 1HA GLY 38 108.344 -16.854 2.803 264 HA3 GLY 38 2HA GLY 38 107.410 -16.422 1.373 265 H VAL 39 H VAL 39 108.707 -15.231 4.194 266 HA VAL 39 HA VAL 39 106.906 -12.872 4.064 267 HB VAL 39 HB VAL 39 106.634 -14.087 6.193 268 HG11 VAL 39 1HG1 VAL 39 109.510 -13.432 6.821 269 HG12 VAL 39 2HG1 VAL 39 109.059 -14.976 6.099 270 HG13 VAL 39 3HG1 VAL 39 108.418 -14.521 7.677 271 HG21 VAL 39 3HG2 VAL 39 108.212 -11.525 6.564 272 HG22 VAL 39 1HG2 VAL 39 107.009 -12.194 7.667 273 HG23 VAL 39 2HG2 VAL 39 106.515 -11.584 6.088 274 H ILE 40 H ILE 40 107.870 -11.048 3.522 275 HA ILE 40 HA ILE 40 110.820 -10.851 3.785 276 HB ILE 40 HB ILE 40 109.098 -9.694 1.573 277 HG12 ILE 40 1HG1 ILE 40 111.117 -11.957 1.456 278 HG13 ILE 40 2HG1 ILE 40 109.370 -12.197 1.503 279 HG21 ILE 40 1HG2 ILE 40 112.109 -9.799 1.950 280 HG22 ILE 40 2HG2 ILE 40 111.106 -8.358 2.125 281 HG23 ILE 40 3HG2 ILE 40 111.269 -9.134 0.549 282 HD11 ILE 40 3HD1 ILE 40 110.950 -10.749 -0.639 283 HD12 ILE 40 1HD1 ILE 40 109.188 -10.756 -0.552 284 HD13 ILE 40 2HD1 ILE 40 110.063 -12.265 -0.814 285 H GLY 41 H GLY 41 111.501 -9.191 4.943 286 HA2 GLY 41 1HA GLY 41 109.702 -6.854 5.311 287 HA3 GLY 41 2HA GLY 41 110.886 -7.386 6.507 288 H SER 42 H SER 42 110.440 -4.929 4.553 289 HA SER 42 HA SER 42 113.257 -4.788 3.640 290 HB2 SER 42 1HB SER 42 111.595 -5.225 1.780 291 HB3 SER 42 2HB SER 42 110.894 -3.654 2.142 292 HG SER 42 HG SER 42 112.713 -2.679 1.477 293 H PHE 43 H PHE 43 114.320 -2.949 4.091 294 HA PHE 43 HA PHE 43 112.755 -0.628 5.079 295 HB2 PHE 43 1HB PHE 43 115.598 -1.416 5.741 296 HB3 PHE 43 2HB PHE 43 114.757 0.000 6.345 297 HD1 PHE 43 HD1 PHE 43 112.663 -0.363 7.783 298 HD2 PHE 43 HD2 PHE 43 115.451 -3.491 6.837 299 HE1 PHE 43 HE1 PHE 43 111.807 -1.701 9.688 300 HE2 PHE 43 HE2 PHE 43 114.595 -4.829 8.742 301 HZ PHE 43 HZ PHE 43 112.773 -3.935 10.166 302 H THR 44 H THR 44 112.932 1.215 3.888 303 HA THR 44 HA THR 44 115.024 1.256 1.774 304 HB THR 44 HB THR 44 112.245 2.445 1.629 305 HG1 THR 44 HG1 THR 44 111.998 0.673 0.102 306 HG21 THR 44 3HG2 THR 44 113.682 3.639 0.166 307 HG22 THR 44 1HG2 THR 44 112.906 2.429 -0.857 308 HG23 THR 44 2HG2 THR 44 114.558 2.178 -0.293 309 H TYR 45 H TYR 45 116.299 2.962 1.676 310 HA TYR 45 HA TYR 45 115.537 5.430 3.136 311 HB2 TYR 45 1HB TYR 45 118.322 4.376 2.605 312 HB3 TYR 45 2HB TYR 45 117.920 5.845 3.467 313 HD1 TYR 45 HD1 TYR 45 116.847 5.714 5.722 314 HD2 TYR 45 HD2 TYR 45 118.264 2.229 3.648 315 HE1 TYR 45 HE1 TYR 45 116.805 4.433 7.845 316 HE2 TYR 45 HE2 TYR 45 118.220 0.948 5.771 317 HH TYR 45 HH TYR 45 117.243 0.989 7.922 318 H THR 46 H THR 46 115.229 7.120 1.796 319 HA THR 46 HA THR 46 116.608 7.120 -0.828 320 HB THR 46 HB THR 46 113.821 8.190 -0.408 321 HG1 THR 46 HG1 THR 46 114.725 5.583 -0.929 322 HG21 THR 46 3HG2 THR 46 115.450 8.701 -2.420 323 HG22 THR 46 1HG2 THR 46 113.751 8.344 -2.726 324 HG23 THR 46 2HG2 THR 46 114.969 7.088 -2.948 325 H GLU 47 H GLU 47 117.273 9.113 -1.602 326 HA GLU 47 HA GLU 47 116.937 11.430 0.196 327 HB2 GLU 47 1HB GLU 47 119.550 10.456 -0.985 328 HB3 GLU 47 2HB GLU 47 119.332 11.968 -0.102 329 HG2 GLU 47 1HG GLU 47 118.533 10.669 1.865 330 HG3 GLU 47 2HG GLU 47 118.853 9.180 0.987 331 H LYS 48 H LYS 48 117.464 13.476 -0.844 332 HA LYS 48 HA LYS 48 117.293 13.422 -3.793 333 HB2 LYS 48 1HB LYS 48 115.050 13.880 -2.806 334 HB3 LYS 48 2HB LYS 48 115.732 15.281 -1.980 335 HG2 LYS 48 1HG LYS 48 116.411 16.211 -4.191 336 HG3 LYS 48 2HG LYS 48 115.616 14.849 -4.979 337 HD2 LYS 48 1HD LYS 48 113.479 15.505 -3.863 338 HD3 LYS 48 2HD LYS 48 114.294 16.933 -3.219 339 HE2 LYS 48 1HE LYS 48 114.048 16.265 -6.166 340 HE3 LYS 48 2HE LYS 48 113.044 17.435 -5.310 341 HZ1 LYS 48 3HZ LYS 48 114.626 18.882 -5.884 342 HZ2 LYS 48 1HZ LYS 48 115.761 17.672 -6.235 343 HZ3 LYS 48 2HZ LYS 48 115.541 18.189 -4.631 344 H SER 49 H SER 49 118.690 14.766 -4.778 345 HA SER 49 HA SER 49 120.042 16.840 -3.141 346 HB2 SER 49 1HB SER 49 121.178 15.237 -5.446 347 HB3 SER 49 2HB SER 49 122.019 16.497 -4.551 348 HG SER 49 HG SER 49 121.425 13.887 -3.859 349 H ARG 50 H ARG 50 120.229 18.864 -3.998 350 HA ARG 50 HA ARG 50 119.326 19.310 -6.764 351 HB2 ARG 50 1HB ARG 50 117.377 19.631 -5.239 352 HB3 ARG 50 2HB ARG 50 118.287 20.885 -4.397 353 HG2 ARG 50 1HG ARG 50 118.500 22.138 -6.530 354 HG3 ARG 50 2HG ARG 50 117.525 20.906 -7.332 355 HD2 ARG 50 1HD ARG 50 115.681 21.374 -5.714 356 HD3 ARG 50 2HD ARG 50 116.648 22.682 -5.039 357 HE ARG 50 HE ARG 50 116.333 22.936 -7.877 358 HH11 ARG 50 1HH1 ARG 50 114.686 23.529 -4.835 359 HH12 ARG 50 2HH1 ARG 50 113.705 24.793 -5.498 360 HH21 ARG 50 1HH2 ARG 50 115.043 24.571 -8.675 361 HH22 ARG 50 2HH2 ARG 50 113.906 25.375 -7.645 362 H THR 51 H THR 51 120.385 20.940 -7.799 363 HA THR 51 HA THR 51 122.248 22.603 -6.199 364 HB THR 51 HB THR 51 122.738 21.523 -8.985 365 HG1 THR 51 HG1 THR 51 123.055 19.805 -7.757 366 HG21 THR 51 3HG2 THR 51 124.637 22.854 -7.040 367 HG22 THR 51 1HG2 THR 51 123.797 23.724 -8.322 368 HG23 THR 51 2HG2 THR 51 124.944 22.447 -8.729 369 H ALA 52 H ALA 52 122.039 24.727 -6.475 370 HA ALA 52 HA ALA 52 120.693 25.738 -8.910 371 HB1 ALA 52 1HB ALA 52 119.115 25.780 -7.011 372 HB2 ALA 52 2HB ALA 52 119.541 27.409 -7.537 373 HB3 ALA 52 3HB ALA 52 120.271 26.733 -6.080 374 H SER 53 H SER 53 121.328 27.846 -9.568 375 HA SER 53 HA SER 53 124.059 28.451 -9.267 376 HB2 SER 53 1HB SER 53 123.574 30.485 -10.486 377 HB3 SER 53 2HB SER 53 122.622 29.174 -11.174 378 HG SER 53 HG SER 53 121.375 31.066 -10.797 379 H SER 54 H SER 54 121.200 29.681 -7.581 380 HA SER 54 HA SER 54 122.418 31.788 -6.173 381 HB2 SER 54 1HB SER 54 120.151 30.012 -5.242 382 HB3 SER 54 2HB SER 54 120.540 31.619 -4.637 383 HG SER 54 HG SER 54 119.314 30.820 -6.991 384 H GLY 55 H GLY 55 122.280 28.321 -5.510 385 HA2 GLY 55 1HA GLY 55 123.928 27.164 -4.259 386 HA3 GLY 55 2HA GLY 55 124.353 28.672 -3.466 387 H ASP 56 H ASP 56 120.979 28.318 -3.493 388 HA ASP 56 HA ASP 56 120.969 27.678 -0.656 389 HB2 ASP 56 1HB ASP 56 119.521 29.472 -1.598 390 HB3 ASP 56 2HB ASP 56 118.648 28.245 -2.514 391 H TYR 57 H TYR 57 120.859 25.654 0.056 392 HA TYR 57 HA TYR 57 119.250 23.692 -1.439 393 HB2 TYR 57 1HB TYR 57 120.956 22.019 -1.296 394 HB3 TYR 57 2HB TYR 57 121.634 23.435 -2.072 395 HD1 TYR 57 HD1 TYR 57 123.243 24.886 -0.841 396 HD2 TYR 57 HD2 TYR 57 121.765 21.207 0.811 397 HE1 TYR 57 HE1 TYR 57 125.083 24.894 0.822 398 HE2 TYR 57 HE2 TYR 57 123.604 21.214 2.474 399 HH TYR 57 HH TYR 57 126.318 23.094 2.203 400 H ASN 58 H ASN 58 118.430 21.973 -0.194 401 HA ASN 58 HA ASN 58 118.746 22.210 2.731 402 HB2 ASN 58 1HB ASN 58 116.343 21.929 3.038 403 HB3 ASN 58 2HB ASN 58 116.665 23.362 2.066 404 HD21 ASN 58 1HD2 ASN 58 114.134 22.013 1.971 405 HD22 ASN 58 2HD2 ASN 58 113.956 21.330 0.427 406 H LYS 59 H LYS 59 117.765 20.236 3.841 407 HA LYS 59 HA LYS 59 118.576 17.842 2.309 408 HB2 LYS 59 1HB LYS 59 118.440 18.350 5.289 409 HB3 LYS 59 2HB LYS 59 118.855 16.799 4.556 410 HG2 LYS 59 1HG LYS 59 120.788 17.783 3.451 411 HG3 LYS 59 2HG LYS 59 120.345 19.388 4.037 412 HD2 LYS 59 1HD LYS 59 122.071 18.531 5.494 413 HD3 LYS 59 2HD LYS 59 120.551 18.500 6.388 414 HE2 LYS 59 1HE LYS 59 120.276 16.129 5.951 415 HE3 LYS 59 2HE LYS 59 121.687 16.122 4.892 416 HZ1 LYS 59 3HZ LYS 59 123.122 16.438 6.667 417 HZ2 LYS 59 1HZ LYS 59 121.981 15.351 7.293 418 HZ3 LYS 59 2HZ LYS 59 121.896 16.998 7.702 419 H ASN 60 H ASN 60 117.088 16.421 1.731 420 HA ASN 60 HA ASN 60 114.548 16.285 3.253 421 HB2 ASN 60 1HB ASN 60 114.988 15.899 0.282 422 HB3 ASN 60 2HB ASN 60 113.467 15.618 1.123 423 HD21 ASN 60 1HD2 ASN 60 113.811 17.602 -0.980 424 HD22 ASN 60 2HD2 ASN 60 113.554 19.127 -0.280 425 H GLN 61 H GLN 61 113.985 14.293 3.991 426 HA GLN 61 HA GLN 61 115.520 11.963 2.981 427 HB2 GLN 61 1HB GLN 61 114.903 12.642 5.866 428 HB3 GLN 61 2HB GLN 61 115.592 11.115 5.315 429 HG2 GLN 61 1HG GLN 61 117.532 12.280 4.395 430 HG3 GLN 61 2HG GLN 61 116.836 13.837 4.841 431 HE21 GLN 61 1HE2 GLN 61 119.389 12.989 5.835 432 HE22 GLN 61 2HE2 GLN 61 119.251 12.746 7.510 433 H TYR 62 H TYR 62 114.406 10.075 2.782 434 HA TYR 62 HA TYR 62 111.614 9.991 3.749 435 HB2 TYR 62 1HB TYR 62 111.677 10.555 1.344 436 HB3 TYR 62 2HB TYR 62 112.615 9.109 1.040 437 HD1 TYR 62 HD1 TYR 62 109.299 10.412 2.044 438 HD2 TYR 62 HD2 TYR 62 111.568 6.948 0.903 439 HE1 TYR 62 HE1 TYR 62 107.195 9.138 1.727 440 HE2 TYR 62 HE2 TYR 62 109.464 5.673 0.588 441 HH TYR 62 HH TYR 62 106.676 6.833 0.087 442 H TYR 63 H TYR 63 111.078 8.122 4.740 443 HA TYR 63 HA TYR 63 112.834 5.767 4.386 444 HB2 TYR 63 1HB TYR 63 113.492 6.899 6.448 445 HB3 TYR 63 2HB TYR 63 111.827 6.911 6.996 446 HD1 TYR 63 HD1 TYR 63 114.716 4.708 6.198 447 HD2 TYR 63 HD2 TYR 63 110.882 5.035 8.105 448 HE1 TYR 63 HE1 TYR 63 115.069 2.508 7.288 449 HE2 TYR 63 HE2 TYR 63 111.236 2.836 9.193 450 HH TYR 63 HH TYR 63 112.546 1.044 9.330 451 H GLY 64 H GLY 64 111.753 3.809 4.316 452 HA2 GLY 64 1HA GLY 64 108.836 3.865 4.846 453 HA3 GLY 64 2HA GLY 64 109.443 3.295 3.296 454 H ILE 65 H ILE 65 108.017 2.071 5.756 455 HA ILE 65 HA ILE 65 109.763 -0.320 5.969 456 HB ILE 65 HB ILE 65 107.603 0.571 7.903 457 HG12 ILE 65 1HG1 ILE 65 110.616 0.627 8.253 458 HG13 ILE 65 2HG1 ILE 65 109.638 2.049 7.894 459 HG21 ILE 65 1HG2 ILE 65 108.051 -1.896 7.712 460 HG22 ILE 65 2HG2 ILE 65 108.426 -1.232 9.302 461 HG23 ILE 65 3HG2 ILE 65 109.725 -1.578 8.162 462 HD11 ILE 65 3HD1 ILE 65 109.734 0.405 10.400 463 HD12 ILE 65 1HD1 ILE 65 108.240 1.244 9.985 464 HD13 ILE 65 2HD1 ILE 65 109.730 2.158 10.218 465 H THR 66 H THR 66 108.961 -2.118 5.001 466 HA THR 66 HA THR 66 106.051 -2.350 4.645 467 HB THR 66 HB THR 66 106.953 -1.300 2.603 468 HG1 THR 66 HG1 THR 66 106.157 -3.995 2.269 469 HG21 THR 66 3HG2 THR 66 108.405 -2.659 1.114 470 HG22 THR 66 1HG2 THR 66 108.573 -3.852 2.401 471 HG23 THR 66 2HG2 THR 66 109.212 -2.223 2.620 472 H ALA 67 H ALA 67 105.320 -4.476 4.101 473 HA ALA 67 HA ALA 67 107.228 -6.678 4.336 474 HB1 ALA 67 1HB ALA 67 106.169 -5.943 6.650 475 HB2 ALA 67 2HB ALA 67 106.331 -7.650 6.238 476 HB3 ALA 67 3HB ALA 67 104.776 -6.840 6.045 477 H GLY 68 H GLY 68 106.371 -8.675 3.494 478 HA2 GLY 68 1HA GLY 68 103.694 -8.558 2.325 479 HA3 GLY 68 2HA GLY 68 105.035 -8.668 1.207 480 HA PRO 69 HA PRO 69 104.296 -13.076 2.865 481 HB2 PRO 69 1HB PRO 69 101.947 -13.953 1.827 482 HB3 PRO 69 2HB PRO 69 102.070 -13.266 3.460 483 HG2 PRO 69 1HG PRO 69 101.110 -12.002 0.945 484 HG3 PRO 69 2HG PRO 69 100.484 -11.854 2.597 485 HD2 PRO 69 1HD PRO 69 102.087 -9.962 1.417 486 HD3 PRO 69 2HD PRO 69 101.991 -10.217 3.171 487 H ALA 70 H ALA 70 104.462 -14.989 1.356 488 HA ALA 70 HA ALA 70 104.450 -14.268 -1.497 489 HB1 ALA 70 1HB ALA 70 106.762 -15.887 -0.542 490 HB2 ALA 70 2HB ALA 70 106.803 -14.153 -0.231 491 HB3 ALA 70 3HB ALA 70 106.656 -14.749 -1.883 492 H TYR 71 H TYR 71 104.295 -16.082 -2.915 493 HA TYR 71 HA TYR 71 103.349 -18.557 -1.589 494 HB2 TYR 71 1HB TYR 71 101.613 -16.978 -2.668 495 HB3 TYR 71 2HB TYR 71 102.293 -17.490 -4.197 496 HD1 TYR 71 HD1 TYR 71 101.541 -19.411 -1.061 497 HD2 TYR 71 HD2 TYR 71 100.708 -18.840 -5.235 498 HE1 TYR 71 HE1 TYR 71 100.036 -21.381 -1.029 499 HE2 TYR 71 HE2 TYR 71 99.207 -20.813 -5.206 500 HH TYR 71 HH TYR 71 98.277 -22.395 -3.963 501 H ARG 72 H ARG 72 104.767 -20.124 -2.012 502 HA ARG 72 HA ARG 72 105.982 -20.271 -4.710 503 HB2 ARG 72 1HB ARG 72 107.592 -19.982 -2.835 504 HB3 ARG 72 2HB ARG 72 106.993 -21.481 -2.124 505 HG2 ARG 72 1HG ARG 72 107.635 -22.699 -4.187 506 HG3 ARG 72 2HG ARG 72 108.283 -21.203 -4.857 507 HD2 ARG 72 1HD ARG 72 109.824 -21.045 -2.894 508 HD3 ARG 72 2HD ARG 72 109.233 -22.612 -2.349 509 HE ARG 72 HE ARG 72 110.057 -22.970 -4.975 510 HH11 ARG 72 1HH1 ARG 72 111.585 -22.009 -1.964 511 HH12 ARG 72 2HH1 ARG 72 113.129 -22.639 -2.431 512 HH21 ARG 72 1HH2 ARG 72 112.068 -23.763 -5.520 513 HH22 ARG 72 2HH2 ARG 72 113.398 -23.620 -4.418 514 H ILE 73 H ILE 73 105.190 -21.820 -5.957 515 HA ILE 73 HA ILE 73 104.908 -24.488 -5.234 516 HB ILE 73 HB ILE 73 103.033 -23.855 -3.840 517 HG12 ILE 73 1HG1 ILE 73 101.841 -25.131 -6.293 518 HG13 ILE 73 2HG1 ILE 73 102.986 -25.986 -5.259 519 HG21 ILE 73 1HG2 ILE 73 101.129 -22.695 -4.574 520 HG22 ILE 73 2HG2 ILE 73 101.558 -22.884 -6.273 521 HG23 ILE 73 3HG2 ILE 73 102.482 -21.786 -5.248 522 HD11 ILE 73 3HD1 ILE 73 100.227 -24.986 -4.591 523 HD12 ILE 73 1HD1 ILE 73 101.416 -25.235 -3.313 524 HD13 ILE 73 2HD1 ILE 73 100.917 -26.587 -4.330 525 H ASN 74 H ASN 74 103.069 -22.200 -7.386 526 HA ASN 74 HA ASN 74 103.412 -24.200 -9.517 527 HB2 ASN 74 1HB ASN 74 101.488 -21.886 -9.238 528 HB3 ASN 74 2HB ASN 74 101.583 -22.946 -10.642 529 HD21 ASN 74 1HD2 ASN 74 99.231 -22.712 -8.935 530 HD22 ASN 74 2HD2 ASN 74 98.988 -24.225 -8.206 531 H ASP 75 H ASP 75 103.993 -23.552 -11.609 532 HA ASP 75 HA ASP 75 105.244 -22.455 -13.178 533 HB2 ASP 75 1HB ASP 75 104.274 -20.048 -11.627 534 HB3 ASP 75 2HB ASP 75 105.058 -19.980 -13.203 535 H TRP 76 H TRP 76 106.583 -23.417 -10.817 536 HA TRP 76 HA TRP 76 108.664 -23.423 -9.908 537 HB2 TRP 76 1HB TRP 76 109.287 -23.430 -12.268 538 HB3 TRP 76 2HB TRP 76 109.274 -21.678 -12.291 539 HD1 TRP 76 HD1 TRP 76 111.423 -20.465 -11.580 540 HE1 TRP 76 HE1 TRP 76 113.730 -21.229 -10.725 541 HE3 TRP 76 HE3 TRP 76 110.455 -25.405 -10.723 542 HZ2 TRP 76 HZ2 TRP 76 115.001 -23.623 -9.799 543 HZ3 TRP 76 HZ3 TRP 76 112.227 -26.901 -9.857 544 HH2 TRP 76 HH2 TRP 76 114.496 -26.020 -9.394 545 H ALA 77 H ALA 77 109.059 -20.108 -11.146 546 HA ALA 77 HA ALA 77 110.249 -19.096 -8.878 547 HB1 ALA 77 1HB ALA 77 109.523 -16.848 -9.741 548 HB2 ALA 77 2HB ALA 77 108.569 -17.692 -10.960 549 HB3 ALA 77 3HB ALA 77 110.324 -17.866 -10.937 550 H SER 78 H SER 78 109.428 -17.361 -7.442 551 HA SER 78 HA SER 78 106.750 -18.066 -6.392 552 HB2 SER 78 1HB SER 78 109.130 -16.950 -4.886 553 HB3 SER 78 2HB SER 78 107.583 -17.429 -4.194 554 HG SER 78 HG SER 78 109.717 -18.957 -5.080 555 H ILE 79 H ILE 79 105.455 -16.325 -5.561 556 HA ILE 79 HA ILE 79 106.267 -13.647 -6.570 557 HB ILE 79 HB ILE 79 103.931 -13.251 -7.212 558 HG12 ILE 79 1HG1 ILE 79 103.493 -16.187 -6.578 559 HG13 ILE 79 2HG1 ILE 79 102.943 -14.863 -5.550 560 HG21 ILE 79 1HG2 ILE 79 104.934 -15.842 -8.419 561 HG22 ILE 79 2HG2 ILE 79 105.610 -14.259 -8.807 562 HG23 ILE 79 3HG2 ILE 79 103.928 -14.621 -9.198 563 HD11 ILE 79 3HD1 ILE 79 101.735 -13.948 -7.607 564 HD12 ILE 79 1HD1 ILE 79 101.074 -15.433 -6.923 565 HD13 ILE 79 2HD1 ILE 79 102.073 -15.500 -8.375 566 H TYR 80 H TYR 80 105.483 -11.858 -5.371 567 HA TYR 80 HA TYR 80 104.109 -12.437 -2.853 568 HB2 TYR 80 1HB TYR 80 105.796 -11.444 -1.475 569 HB3 TYR 80 2HB TYR 80 106.530 -12.726 -2.416 570 HD1 TYR 80 HD1 TYR 80 106.339 -9.101 -1.852 571 HD2 TYR 80 HD2 TYR 80 108.158 -12.221 -4.176 572 HE1 TYR 80 HE1 TYR 80 108.053 -7.501 -2.657 573 HE2 TYR 80 HE2 TYR 80 109.873 -10.622 -4.981 574 HH TYR 80 HH TYR 80 110.863 -8.292 -3.901 575 H GLY 81 H GLY 81 103.380 -10.533 -1.741 576 HA2 GLY 81 1HA GLY 81 103.427 -8.046 -3.357 577 HA3 GLY 81 2HA GLY 81 101.905 -8.656 -2.704 578 H VAL 82 H VAL 82 103.360 -6.133 -2.124 579 HA VAL 82 HA VAL 82 103.784 -6.479 0.779 580 HB VAL 82 HB VAL 82 105.735 -4.955 0.633 581 HG11 VAL 82 1HG1 VAL 82 107.205 -6.669 -0.717 582 HG12 VAL 82 2HG1 VAL 82 105.718 -7.615 -0.756 583 HG13 VAL 82 3HG1 VAL 82 106.437 -7.167 0.789 584 HG21 VAL 82 3HG2 VAL 82 105.050 -3.910 -1.543 585 HG22 VAL 82 1HG2 VAL 82 105.513 -5.404 -2.357 586 HG23 VAL 82 2HG2 VAL 82 106.731 -4.442 -1.521 587 H VAL 83 H VAL 83 103.370 -4.703 2.044 588 HA VAL 83 HA VAL 83 102.577 -2.187 0.751 589 HB VAL 83 HB VAL 83 100.481 -3.408 1.202 590 HG11 VAL 83 1HG1 VAL 83 99.868 -4.178 3.356 591 HG12 VAL 83 2HG1 VAL 83 101.169 -3.281 4.138 592 HG13 VAL 83 3HG1 VAL 83 101.541 -4.702 3.163 593 HG21 VAL 83 3HG2 VAL 83 100.605 -0.925 1.471 594 HG22 VAL 83 1HG2 VAL 83 100.922 -1.161 3.190 595 HG23 VAL 83 2HG2 VAL 83 99.379 -1.665 2.500 596 H GLY 84 H GLY 84 102.863 -0.331 2.177 597 HA2 GLY 84 1HA GLY 84 103.909 -0.703 4.833 598 HA3 GLY 84 2HA GLY 84 105.167 -0.312 3.667 599 H VAL 85 H VAL 85 105.204 1.492 5.381 600 HA VAL 85 HA VAL 85 103.508 3.734 4.449 601 HB VAL 85 HB VAL 85 104.347 3.217 7.317 602 HG11 VAL 85 1HG1 VAL 85 102.791 5.116 7.772 603 HG12 VAL 85 2HG1 VAL 85 102.607 5.345 6.033 604 HG13 VAL 85 3HG1 VAL 85 104.178 5.597 6.794 605 HG21 VAL 85 3HG2 VAL 85 101.656 2.956 5.938 606 HG22 VAL 85 1HG2 VAL 85 101.898 2.880 7.683 607 HG23 VAL 85 2HG2 VAL 85 102.601 1.644 6.641 608 H GLY 86 H GLY 86 104.583 5.655 4.150 609 HA2 GLY 86 1HA GLY 86 107.489 5.663 4.757 610 HA3 GLY 86 2HA GLY 86 106.859 6.196 3.204 611 H TYR 87 H TYR 87 108.364 7.577 5.413 612 HA TYR 87 HA TYR 87 106.533 9.886 5.726 613 HB2 TYR 87 1HB TYR 87 108.669 8.964 7.657 614 HB3 TYR 87 2HB TYR 87 107.660 10.386 7.840 615 HD1 TYR 87 HD1 TYR 87 105.192 10.116 8.227 616 HD2 TYR 87 HD2 TYR 87 107.907 6.787 8.256 617 HE1 TYR 87 HE1 TYR 87 103.493 8.742 9.399 618 HE2 TYR 87 HE2 TYR 87 106.208 5.413 9.428 619 HH TYR 87 HH TYR 87 104.193 5.374 10.350 620 H GLY 88 H GLY 88 107.412 11.896 5.339 621 HA2 GLY 88 1HA GLY 88 110.239 12.004 4.471 622 HA3 GLY 88 2HA GLY 88 108.959 12.700 3.482 623 H LYS 89 H LYS 89 111.339 13.825 4.995 624 HA LYS 89 HA LYS 89 109.872 16.062 6.239 625 HB2 LYS 89 1HB LYS 89 110.726 14.546 8.030 626 HB3 LYS 89 2HB LYS 89 112.360 14.799 7.417 627 HG2 LYS 89 1HG LYS 89 112.086 17.247 7.775 628 HG3 LYS 89 2HG LYS 89 110.496 16.942 8.476 629 HD2 LYS 89 1HD LYS 89 111.589 15.454 10.171 630 HD3 LYS 89 2HD LYS 89 113.156 15.943 9.527 631 HE2 LYS 89 1HE LYS 89 112.239 18.377 9.913 632 HE3 LYS 89 2HE LYS 89 111.143 17.577 11.039 633 HZ1 LYS 89 3HZ LYS 89 114.068 17.134 11.099 634 HZ2 LYS 89 1HZ LYS 89 112.928 16.769 12.299 635 HZ3 LYS 89 2HZ LYS 89 113.325 18.388 11.972 636 H PHE 90 H PHE 90 110.758 18.066 5.848 637 HA PHE 90 HA PHE 90 113.290 18.162 4.322 638 HB2 PHE 90 1HB PHE 90 112.329 19.808 2.827 639 HB3 PHE 90 2HB PHE 90 111.394 18.327 2.772 640 HD1 PHE 90 HD2 PHE 90 109.120 18.239 3.672 641 HD2 PHE 90 HD1 PHE 90 111.431 21.858 3.793 642 HE1 PHE 90 HE2 PHE 90 107.068 19.531 4.185 643 HE2 PHE 90 HE1 PHE 90 109.378 23.151 4.305 644 HZ PHE 90 HZ PHE 90 107.196 21.988 4.503 645 H GLN 91 H GLN 91 114.397 20.196 4.415 646 HA GLN 91 HA GLN 91 113.875 21.625 6.940 647 HB2 GLN 91 1HB GLN 91 116.106 20.560 6.612 648 HB3 GLN 91 2HB GLN 91 116.372 21.621 5.228 649 HG2 GLN 91 1HG GLN 91 115.993 23.587 6.751 650 HG3 GLN 91 2HG GLN 91 115.950 22.460 8.108 651 HE21 GLN 91 1HE2 GLN 91 117.937 22.438 9.154 652 HE22 GLN 91 2HE2 GLN 91 119.446 22.539 8.384 653 H THR 92 H THR 92 113.073 23.618 6.886 654 HA THR 92 HA THR 92 113.665 25.370 4.617 655 HB THR 92 HB THR 92 111.556 24.248 4.031 656 HG1 THR 92 HG1 THR 92 111.299 26.149 3.212 657 HG21 THR 92 3HG2 THR 92 109.532 24.753 5.428 658 HG22 THR 92 1HG2 THR 92 110.608 25.400 6.668 659 HG23 THR 92 2HG2 THR 92 110.697 23.695 6.225 660 H THR 93 H THR 93 112.742 27.631 5.060 661 HA THR 93 HA THR 93 113.247 28.297 7.883 662 HB THR 93 HB THR 93 113.026 30.138 5.485 663 HG1 THR 93 HG1 THR 93 114.804 28.638 5.448 664 HG21 THR 93 3HG2 THR 93 114.171 30.602 8.253 665 HG22 THR 93 1HG2 THR 93 112.577 31.145 7.730 666 HG23 THR 93 2HG2 THR 93 114.025 31.792 6.960 667 H GLU 94 H GLU 94 111.674 29.120 9.181 668 HA GLU 94 HA GLU 94 109.118 29.965 8.116 669 HB2 GLU 94 1HB GLU 94 109.068 27.460 7.962 670 HB3 GLU 94 2HB GLU 94 109.243 27.401 9.714 671 HG2 GLU 94 1HG GLU 94 107.173 28.756 9.942 672 HG3 GLU 94 2HG GLU 94 106.986 28.736 8.195 673 H TYR 95 H TYR 95 107.815 30.964 9.636 674 HA TYR 95 HA TYR 95 109.050 31.733 12.137 675 HB2 TYR 95 1HB TYR 95 106.953 33.023 12.467 676 HB3 TYR 95 2HB TYR 95 107.756 33.391 10.952 677 HD1 TYR 95 HD1 TYR 95 104.989 31.387 12.452 678 HD2 TYR 95 HD2 TYR 95 106.607 33.181 8.900 679 HE1 TYR 95 HE1 TYR 95 102.890 30.872 11.235 680 HE2 TYR 95 HE2 TYR 95 104.508 32.665 7.683 681 HH TYR 95 HH TYR 95 102.595 31.422 7.766 682 HA PRO 96 HA PRO 96 107.986 28.424 14.496 683 HB2 PRO 96 1HB PRO 96 106.659 30.004 16.637 684 HB3 PRO 96 2HB PRO 96 108.085 28.954 16.723 685 HG2 PRO 96 1HG PRO 96 108.276 31.614 16.822 686 HG3 PRO 96 2HG PRO 96 109.515 30.604 16.054 687 HD2 PRO 96 1HD PRO 96 107.434 32.322 14.773 688 HD3 PRO 96 2HD PRO 96 109.076 31.924 14.219 689 H THR 97 H THR 97 106.501 26.902 14.520 690 HA THR 97 HA THR 97 103.673 27.637 14.089 691 HB THR 97 HB THR 97 104.719 26.776 12.048 692 HG1 THR 97 HG1 THR 97 102.565 26.222 12.488 693 HG21 THR 97 3HG2 THR 97 105.507 24.407 12.011 694 HG22 THR 97 1HG2 THR 97 105.343 24.358 13.766 695 HG23 THR 97 2HG2 THR 97 106.512 25.447 13.020 696 H TYR 98 H TYR 98 102.084 26.110 14.840 697 HA TYR 98 HA TYR 98 102.977 24.626 17.216 698 HB2 TYR 98 1HB TYR 98 101.060 26.195 17.410 699 HB3 TYR 98 2HB TYR 98 100.184 25.240 16.229 700 HD1 TYR 98 HD1 TYR 98 101.565 25.289 19.662 701 HD2 TYR 98 HD2 TYR 98 99.125 23.162 16.836 702 HE1 TYR 98 HE1 TYR 98 100.711 23.843 21.487 703 HE2 TYR 98 HE2 TYR 98 98.272 21.716 18.661 704 HH TYR 98 HH TYR 98 98.918 22.410 22.009 705 H LYS 99 H LYS 99 102.731 22.413 17.397 706 HA LYS 99 HA LYS 99 103.096 21.090 14.893 707 HB2 LYS 99 1HB LYS 99 102.969 20.020 17.716 708 HB3 LYS 99 2HB LYS 99 103.427 19.066 16.304 709 HG2 LYS 99 1HG LYS 99 105.254 20.700 15.837 710 HG3 LYS 99 2HG LYS 99 104.838 21.546 17.328 711 HD2 LYS 99 1HD LYS 99 105.238 19.429 18.593 712 HD3 LYS 99 2HD LYS 99 105.778 18.674 17.093 713 HE2 LYS 99 1HE LYS 99 107.792 19.398 18.055 714 HE3 LYS 99 2HE LYS 99 107.406 20.703 16.933 715 HZ1 LYS 99 3HZ LYS 99 106.600 22.037 18.665 716 HZ2 LYS 99 1HZ LYS 99 108.044 21.376 19.262 717 HZ3 LYS 99 2HZ LYS 99 106.550 20.742 19.766 718 H HIS 100 H HIS 100 101.840 19.767 13.779 719 HA HIS 100 HA HIS 100 99.521 18.478 14.911 720 HB2 HIS 100 1HB HIS 100 97.898 19.431 13.378 721 HB3 HIS 100 2HB HIS 100 98.602 20.688 14.374 722 HD1 HIS 100 HD1 HIS 100 100.640 22.059 13.106 723 HD2 HIS 100 HD2 HIS 100 97.955 19.982 10.686 724 HE1 HIS 100 HE1 HIS 100 100.879 23.026 10.780 725 H ASP 101 H ASP 101 101.270 19.381 11.960 726 HA ASP 101 HA ASP 101 101.322 16.545 11.188 727 HB2 ASP 101 1HB ASP 101 100.545 18.846 9.377 728 HB3 ASP 101 2HB ASP 101 100.927 17.222 8.810 729 H THR 102 H THR 102 103.425 17.285 12.382 730 HA THR 102 HA THR 102 105.276 19.025 11.230 731 HB THR 102 HB THR 102 105.905 16.494 12.762 732 HG1 THR 102 HG1 THR 102 104.548 17.620 14.029 733 HG21 THR 102 3HG2 THR 102 107.396 19.124 12.546 734 HG22 THR 102 1HG2 THR 102 107.820 17.662 11.654 735 HG23 THR 102 2HG2 THR 102 107.924 17.683 13.414 736 H SER 103 H SER 103 104.716 15.582 10.605 737 HA SER 103 HA SER 103 106.619 15.746 8.334 738 HB2 SER 103 1HB SER 103 105.956 13.337 10.045 739 HB3 SER 103 2HB SER 103 107.055 13.358 8.669 740 HG SER 103 HG SER 103 107.668 13.843 11.134 741 H ASP 104 H ASP 104 106.068 14.600 6.435 742 HA ASP 104 HA ASP 104 103.159 14.242 6.108 743 HB2 ASP 104 1HB ASP 104 105.376 14.504 4.060 744 HB3 ASP 104 2HB ASP 104 103.667 14.307 3.679 745 H TYR 105 H TYR 105 102.297 12.299 5.299 746 HA TYR 105 HA TYR 105 104.174 10.038 5.042 747 HB2 TYR 105 1HB TYR 105 102.871 8.658 6.493 748 HB3 TYR 105 2HB TYR 105 103.288 10.125 7.354 749 HD1 TYR 105 HD1 TYR 105 101.552 11.858 7.785 750 HD2 TYR 105 HD2 TYR 105 100.599 8.073 5.992 751 HE1 TYR 105 HE1 TYR 105 99.151 12.222 8.292 752 HE2 TYR 105 HE2 TYR 105 98.199 8.438 6.498 753 HH TYR 105 HH TYR 105 96.733 10.750 6.886 754 H GLY 106 H GLY 106 103.334 8.200 3.935 755 HA2 GLY 106 1HA GLY 106 100.753 8.446 2.591 756 HA3 GLY 106 2HA GLY 106 102.170 8.468 1.546 757 H PHE 107 H PHE 107 100.592 6.501 0.957 758 HA PHE 107 HA PHE 107 101.510 4.100 2.449 759 HB2 PHE 107 1HB PHE 107 98.976 4.514 0.857 760 HB3 PHE 107 2HB PHE 107 99.465 3.004 1.604 761 HD1 PHE 107 HD2 PHE 107 99.358 2.706 4.031 762 HD2 PHE 107 HD1 PHE 107 98.166 6.394 2.177 763 HE1 PHE 107 HE2 PHE 107 98.245 3.404 6.135 764 HE2 PHE 107 HE1 PHE 107 97.051 7.091 4.281 765 HZ PHE 107 HZ PHE 107 97.091 5.596 6.259 766 H SER 108 H SER 108 102.321 2.354 1.269 767 HA SER 108 HA SER 108 102.511 2.714 -1.664 768 HB2 SER 108 1HB SER 108 104.852 2.070 -1.622 769 HB3 SER 108 2HB SER 108 104.619 3.470 -0.578 770 HG SER 108 HG SER 108 105.337 2.279 0.991 771 H TYR 109 H TYR 109 102.609 0.832 -2.863 772 HA TYR 109 HA TYR 109 102.748 -1.751 -1.546 773 HB2 TYR 109 1HB TYR 109 100.607 -2.547 -2.262 774 HB3 TYR 109 2HB TYR 109 100.367 -1.083 -1.331 775 HD1 TYR 109 HD2 TYR 109 99.574 0.974 -2.404 776 HD2 TYR 109 HD1 TYR 109 100.175 -2.635 -4.656 777 HE1 TYR 109 HE2 TYR 109 98.274 1.931 -4.286 778 HE2 TYR 109 HE1 TYR 109 98.873 -1.677 -6.538 779 HH TYR 109 HH TYR 109 98.115 0.358 -7.397 780 H GLY 110 H GLY 110 102.813 -3.540 -3.117 781 HA2 GLY 110 1HA GLY 110 102.805 -3.185 -5.910 782 HA3 GLY 110 2HA GLY 110 104.459 -2.992 -5.341 783 H ALA 111 H ALA 111 104.459 -4.965 -6.918 784 HA ALA 111 HA ALA 111 104.406 -7.375 -5.228 785 HB1 ALA 111 1HB ALA 111 102.414 -7.724 -6.419 786 HB2 ALA 111 2HB ALA 111 103.612 -8.599 -7.371 787 HB3 ALA 111 3HB ALA 111 103.061 -7.008 -7.895 788 H GLY 112 H GLY 112 105.805 -9.097 -6.038 789 HA2 GLY 112 1HA GLY 112 107.776 -8.280 -8.050 790 HA3 GLY 112 2HA GLY 112 108.365 -8.583 -6.420 791 H LEU 113 H LEU 113 109.196 -9.997 -8.707 792 HA LEU 113 HA LEU 113 108.285 -12.720 -8.007 793 HB2 LEU 113 1HB LEU 113 107.361 -11.893 -10.209 794 HB3 LEU 113 2HB LEU 113 109.017 -11.821 -10.802 795 HG LEU 113 HG LEU 113 108.124 -14.376 -9.516 796 HD11 LEU 113 1HD1 LEU 113 107.266 -15.127 -11.781 797 HD12 LEU 113 2HD1 LEU 113 107.254 -13.430 -12.258 798 HD13 LEU 113 3HD1 LEU 113 106.225 -13.981 -10.937 799 HD21 LEU 113 3HD2 LEU 113 110.044 -13.474 -11.645 800 HD22 LEU 113 1HD2 LEU 113 109.491 -15.149 -11.645 801 HD23 LEU 113 2HD2 LEU 113 110.340 -14.502 -10.246 802 H GLN 114 H GLN 114 109.910 -14.180 -7.698 803 HA GLN 114 HA GLN 114 112.679 -13.204 -8.091 804 HB2 GLN 114 1HB GLN 114 111.998 -13.632 -5.740 805 HB3 GLN 114 2HB GLN 114 111.661 -15.309 -6.166 806 HG2 GLN 114 1HG GLN 114 113.993 -15.647 -6.817 807 HG3 GLN 114 2HG GLN 114 114.354 -13.955 -6.497 808 HE21 GLN 114 1HE2 GLN 114 115.896 -15.728 -5.104 809 HE22 GLN 114 2HE2 GLN 114 115.410 -15.824 -3.481 810 H PHE 115 H PHE 115 114.037 -14.330 -9.368 811 HA PHE 115 HA PHE 115 113.163 -17.001 -10.326 812 HB2 PHE 115 1HB PHE 115 112.980 -15.175 -12.034 813 HB3 PHE 115 2HB PHE 115 114.711 -14.936 -11.892 814 HD1 PHE 115 HD1 PHE 115 112.098 -17.425 -12.809 815 HD2 PHE 115 HD2 PHE 115 116.230 -16.292 -13.105 816 HE1 PHE 115 HE1 PHE 115 112.462 -19.195 -14.509 817 HE2 PHE 115 HE2 PHE 115 116.594 -18.062 -14.802 818 HZ PHE 115 HZ PHE 115 114.710 -19.514 -15.504 819 H ASN 116 H ASN 116 114.654 -18.602 -10.236 820 HA ASN 116 HA ASN 116 117.393 -17.892 -9.368 821 HB2 ASN 116 1HB ASN 116 117.311 -19.874 -7.860 822 HB3 ASN 116 2HB ASN 116 116.201 -18.587 -7.395 823 HD21 ASN 116 1HD2 ASN 116 116.313 -21.868 -7.585 824 HD22 ASN 116 2HD2 ASN 116 114.686 -22.200 -7.932 825 HA PRO 117 HA PRO 117 117.678 -20.910 -12.839 826 HB2 PRO 117 1HB PRO 117 119.767 -19.786 -14.159 827 HB3 PRO 117 2HB PRO 117 118.101 -19.211 -14.357 828 HG2 PRO 117 1HG PRO 117 120.321 -18.055 -12.763 829 HG3 PRO 117 2HG PRO 117 119.057 -17.242 -13.703 830 HD2 PRO 117 1HD PRO 117 118.998 -17.545 -10.951 831 HD3 PRO 117 2HD PRO 117 117.568 -17.265 -11.964 832 H MET 118 H MET 118 120.134 -21.687 -13.778 833 HA MET 118 HA MET 118 121.147 -23.355 -11.788 834 HB2 MET 118 1HB MET 118 122.468 -22.329 -14.309 835 HB3 MET 118 2HB MET 118 123.108 -23.640 -13.314 836 HG2 MET 118 1HG MET 118 120.969 -24.878 -13.626 837 HG3 MET 118 2HG MET 118 120.411 -23.596 -14.701 838 HE1 MET 118 3HE MET 118 119.835 -25.412 -16.011 839 HE2 MET 118 1HE MET 118 120.833 -26.872 -15.994 840 HE3 MET 118 2HE MET 118 120.786 -25.851 -17.429 841 H GLU 119 H GLU 119 122.136 -20.092 -12.710 842 HA GLU 119 HA GLU 119 124.566 -19.897 -11.364 843 HB2 GLU 119 1HB GLU 119 122.427 -17.785 -11.730 844 HB3 GLU 119 2HB GLU 119 124.095 -17.466 -11.252 845 HG2 GLU 119 1HG GLU 119 124.874 -18.547 -13.353 846 HG3 GLU 119 2HG GLU 119 123.197 -18.764 -13.839 847 H ASN 120 H ASN 120 125.119 -19.040 -9.302 848 HA ASN 120 HA ASN 120 123.392 -20.022 -7.200 849 HB2 ASN 120 1HB ASN 120 126.067 -18.623 -7.053 850 HB3 ASN 120 2HB ASN 120 125.250 -19.425 -5.712 851 HD21 ASN 120 1HD2 ASN 120 127.847 -20.054 -7.323 852 HD22 ASN 120 2HD2 ASN 120 127.671 -21.698 -7.708 853 H VAL 121 H VAL 121 122.958 -17.303 -8.830 854 HA VAL 121 HA VAL 121 122.190 -15.769 -6.420 855 HB VAL 121 HB VAL 121 124.162 -14.741 -7.487 856 HG11 VAL 121 1HG1 VAL 121 123.862 -15.505 -9.777 857 HG12 VAL 121 2HG1 VAL 121 123.889 -13.741 -9.761 858 HG13 VAL 121 3HG1 VAL 121 122.355 -14.599 -9.916 859 HG21 VAL 121 3HG2 VAL 121 122.527 -13.283 -6.396 860 HG22 VAL 121 1HG2 VAL 121 121.571 -13.213 -7.876 861 HG23 VAL 121 2HG2 VAL 121 123.175 -12.483 -7.827 862 H ALA 122 H ALA 122 120.227 -14.710 -6.511 863 HA ALA 122 HA ALA 122 118.488 -15.436 -8.803 864 HB1 ALA 122 1HB ALA 122 118.088 -16.365 -6.368 865 HB2 ALA 122 2HB ALA 122 116.728 -15.815 -7.347 866 HB3 ALA 122 3HB ALA 122 117.397 -14.765 -6.097 867 H LEU 123 H LEU 123 116.876 -13.896 -9.416 868 HA LEU 123 HA LEU 123 117.729 -11.108 -8.863 869 HB2 LEU 123 1HB LEU 123 116.375 -12.201 -11.341 870 HB3 LEU 123 2HB LEU 123 116.937 -10.549 -11.099 871 HG LEU 123 HG LEU 123 118.720 -13.003 -11.081 872 HD11 LEU 123 1HD1 LEU 123 117.754 -12.455 -13.318 873 HD12 LEU 123 2HD1 LEU 123 119.500 -12.218 -13.256 874 HD13 LEU 123 3HD1 LEU 123 118.419 -10.828 -13.174 875 HD21 LEU 123 3HD2 LEU 123 119.782 -11.361 -9.752 876 HD22 LEU 123 1HD2 LEU 123 119.192 -10.039 -10.759 877 HD23 LEU 123 2HD2 LEU 123 120.468 -11.100 -11.355 878 H ASP 124 H ASP 124 116.179 -9.595 -8.334 879 HA ASP 124 HA ASP 124 113.389 -10.580 -8.085 880 HB2 ASP 124 1HB ASP 124 114.896 -8.645 -6.307 881 HB3 ASP 124 2HB ASP 124 113.185 -9.035 -6.156 882 H PHE 125 H PHE 125 111.959 -9.490 -9.264 883 HA PHE 125 HA PHE 125 112.548 -6.670 -9.981 884 HB2 PHE 125 1HB PHE 125 111.099 -8.755 -11.624 885 HB3 PHE 125 2HB PHE 125 111.265 -7.063 -12.054 886 HD1 PHE 125 HD1 PHE 125 112.970 -10.306 -11.773 887 HD2 PHE 125 HD2 PHE 125 113.405 -6.166 -12.835 888 HE1 PHE 125 HE1 PHE 125 115.118 -10.820 -12.899 889 HE2 PHE 125 HE2 PHE 125 115.553 -6.681 -13.962 890 HZ PHE 125 HZ PHE 125 116.410 -9.009 -13.994 891 H SER 126 H SER 126 111.012 -5.239 -9.349 892 HA SER 126 HA SER 126 108.295 -6.220 -8.808 893 HB2 SER 126 1HB SER 126 109.923 -4.677 -6.777 894 HB3 SER 126 2HB SER 126 108.248 -5.189 -6.601 895 HG SER 126 HG SER 126 110.318 -6.535 -5.889 896 H TYR 127 H TYR 127 106.698 -4.615 -8.779 897 HA TYR 127 HA TYR 127 107.536 -1.956 -9.786 898 HB2 TYR 127 1HB TYR 127 104.879 -3.360 -10.114 899 HB3 TYR 127 2HB TYR 127 105.309 -1.795 -10.775 900 HD1 TYR 127 HD1 TYR 127 105.735 -5.432 -11.061 901 HD2 TYR 127 HD2 TYR 127 106.802 -1.611 -12.707 902 HE1 TYR 127 HE1 TYR 127 106.588 -6.550 -13.104 903 HE2 TYR 127 HE2 TYR 127 107.654 -2.729 -14.750 904 HH TYR 127 HH TYR 127 107.446 -6.269 -15.129 905 H GLU 128 H GLU 128 107.189 -0.287 -8.436 906 HA GLU 128 HA GLU 128 105.334 -0.697 -6.154 907 HB2 GLU 128 1HB GLU 128 107.757 -0.754 -5.535 908 HB3 GLU 128 2HB GLU 128 107.901 0.900 -6.131 909 HG2 GLU 128 1HG GLU 128 106.111 1.593 -4.545 910 HG3 GLU 128 2HG GLU 128 106.067 -0.046 -3.911 911 H GLN 129 H GLN 129 103.849 0.807 -5.811 912 HA GLN 129 HA GLN 129 104.200 3.488 -7.012 913 HB2 GLN 129 1HB GLN 129 101.649 1.862 -6.823 914 HB3 GLN 129 2HB GLN 129 101.734 3.548 -7.333 915 HG2 GLN 129 1HG GLN 129 103.172 2.944 -9.213 916 HG3 GLN 129 2HG GLN 129 103.197 1.265 -8.685 917 HE21 GLN 129 1HE2 GLN 129 102.236 2.005 -11.281 918 HE22 GLN 129 2HE2 GLN 129 100.570 1.686 -11.341 919 H SER 130 H SER 130 103.533 5.217 -5.723 920 HA SER 130 HA SER 130 102.484 4.576 -3.042 921 HB2 SER 130 1HB SER 130 104.961 4.759 -2.886 922 HB3 SER 130 2HB SER 130 104.858 6.383 -3.557 923 HG SER 130 HG SER 130 104.189 5.418 -1.045 924 H ARG 131 H ARG 131 101.120 6.102 -2.210 925 HA ARG 131 HA ARG 131 100.609 8.493 -3.892 926 HB2 ARG 131 1HB ARG 131 98.810 6.766 -4.000 927 HB3 ARG 131 2HB ARG 131 98.591 6.939 -2.259 928 HG2 ARG 131 1HG ARG 131 98.139 9.371 -2.595 929 HG3 ARG 131 2HG ARG 131 98.240 9.116 -4.338 930 HD2 ARG 131 1HD ARG 131 96.285 7.738 -2.476 931 HD3 ARG 131 2HD ARG 131 95.895 9.071 -3.560 932 HE ARG 131 HE ARG 131 97.070 7.021 -5.080 933 HH11 ARG 131 1HH1 ARG 131 94.111 7.570 -3.272 934 HH12 ARG 131 2HH1 ARG 131 93.191 6.478 -4.253 935 HH21 ARG 131 1HH2 ARG 131 95.835 5.630 -6.308 936 HH22 ARG 131 2HH2 ARG 131 94.157 5.394 -5.951 937 H ILE 132 H ILE 132 100.803 10.405 -2.912 938 HA ILE 132 HA ILE 132 100.345 10.554 0.013 939 HB ILE 132 HB ILE 132 102.344 12.203 -1.583 940 HG12 ILE 132 1HG1 ILE 132 102.943 10.130 0.539 941 HG13 ILE 132 2HG1 ILE 132 102.991 9.770 -1.188 942 HG21 ILE 132 1HG2 ILE 132 102.907 13.230 0.486 943 HG22 ILE 132 2HG2 ILE 132 102.029 12.017 1.416 944 HG23 ILE 132 3HG2 ILE 132 101.144 13.203 0.457 945 HD11 ILE 132 3HD1 ILE 132 105.236 10.347 -0.390 946 HD12 ILE 132 1HD1 ILE 132 104.634 11.881 0.242 947 HD13 ILE 132 2HD1 ILE 132 104.652 11.590 -1.497 948 H ARG 133 H ARG 133 98.497 11.848 0.254 949 HA ARG 133 HA ARG 133 96.934 12.176 -1.964 950 HB2 ARG 133 1HB ARG 133 96.141 12.197 0.386 951 HB3 ARG 133 2HB ARG 133 96.744 13.842 0.552 952 HG2 ARG 133 1HG ARG 133 94.438 14.088 0.063 953 HG3 ARG 133 2HG ARG 133 95.246 14.416 -1.467 954 HD2 ARG 133 1HD ARG 133 94.853 12.055 -2.150 955 HD3 ARG 133 2HD ARG 133 93.989 11.786 -0.639 956 HE ARG 133 HE ARG 133 93.020 13.975 -2.309 957 HH11 ARG 133 1HH1 ARG 133 92.612 10.617 -1.365 958 HH12 ARG 133 2HH1 ARG 133 90.973 10.557 -1.923 959 HH21 ARG 133 1HH2 ARG 133 90.908 13.836 -3.009 960 HH22 ARG 133 2HH2 ARG 133 90.022 12.356 -2.842 961 H SER 134 H SER 134 97.837 13.116 -3.641 962 HA SER 134 HA SER 134 97.389 15.505 -4.645 963 HB2 SER 134 1HB SER 134 99.768 15.833 -2.826 964 HB3 SER 134 2HB SER 134 99.647 16.769 -4.312 965 HG SER 134 HG SER 134 98.438 17.177 -1.979 966 H VAL 135 H VAL 135 100.304 13.536 -4.003 967 HA VAL 135 HA VAL 135 101.091 13.899 -6.828 968 HB VAL 135 HB VAL 135 103.401 13.532 -6.054 969 HG11 VAL 135 1HG1 VAL 135 101.885 15.669 -4.522 970 HG12 VAL 135 2HG1 VAL 135 102.501 15.822 -6.168 971 HG13 VAL 135 3HG1 VAL 135 103.623 15.667 -4.815 972 HG21 VAL 135 3HG2 VAL 135 102.870 12.120 -4.090 973 HG22 VAL 135 1HG2 VAL 135 102.129 13.509 -3.295 974 HG23 VAL 135 2HG2 VAL 135 103.861 13.503 -3.625 975 H ASP 136 H ASP 136 101.531 12.158 -8.073 976 HA ASP 136 HA ASP 136 101.176 9.485 -6.850 977 HB2 ASP 136 1HB ASP 136 99.670 10.073 -8.745 978 HB3 ASP 136 2HB ASP 136 101.087 10.268 -9.773 979 H VAL 137 H VAL 137 103.019 8.338 -6.488 980 HA VAL 137 HA VAL 137 105.451 9.162 -7.969 981 HB VAL 137 HB VAL 137 105.257 7.837 -5.252 982 HG11 VAL 137 1HG1 VAL 137 107.563 8.960 -6.865 983 HG12 VAL 137 2HG1 VAL 137 107.347 7.294 -6.327 984 HG13 VAL 137 3HG1 VAL 137 107.676 8.566 -5.150 985 HG21 VAL 137 3HG2 VAL 137 105.916 10.709 -5.983 986 HG22 VAL 137 1HG2 VAL 137 105.904 10.028 -4.357 987 HG23 VAL 137 2HG2 VAL 137 104.398 10.175 -5.262 988 H GLY 138 H GLY 138 106.535 7.694 -9.133 989 HA2 GLY 138 1HA GLY 138 105.714 4.848 -8.928 990 HA3 GLY 138 2HA GLY 138 106.079 5.632 -10.465 991 H THR 139 H THR 139 107.348 3.410 -8.624 992 HA THR 139 HA THR 139 110.128 4.341 -9.023 993 HB THR 139 HB THR 139 109.150 2.791 -6.615 994 HG1 THR 139 HG1 THR 139 108.866 4.648 -5.697 995 HG21 THR 139 3HG2 THR 139 111.801 4.162 -7.119 996 HG22 THR 139 1HG2 THR 139 111.528 2.445 -7.411 997 HG23 THR 139 2HG2 THR 139 111.385 3.095 -5.779 998 H TRP 140 H TRP 140 111.448 2.904 -9.962 999 HA TRP 140 HA TRP 140 110.475 0.137 -10.345 1000 HB2 TRP 140 1HB TRP 140 112.562 1.736 -11.838 1001 HB3 TRP 140 2HB TRP 140 112.186 0.053 -12.151 1002 HD1 TRP 140 HD1 TRP 140 110.364 3.464 -12.104 1003 HE1 TRP 140 HE1 TRP 140 108.600 3.453 -13.982 1004 HE3 TRP 140 HE3 TRP 140 110.947 -1.305 -13.830 1005 HZ2 TRP 140 HZ2 TRP 140 107.572 1.656 -15.962 1006 HZ3 TRP 140 HZ3 TRP 140 109.568 -2.140 -15.709 1007 HH2 TRP 140 HH2 TRP 140 107.882 -0.670 -16.777 1008 H ILE 141 H ILE 141 111.498 -1.467 -9.277 1009 HA ILE 141 HA ILE 141 114.148 -0.889 -8.083 1010 HB ILE 141 HB ILE 141 112.379 -0.650 -6.393 1011 HG12 ILE 141 1HG1 ILE 141 113.848 -3.252 -5.917 1012 HG13 ILE 141 2HG1 ILE 141 114.662 -1.687 -5.885 1013 HG21 ILE 141 1HG2 ILE 141 110.776 -2.229 -7.512 1014 HG22 ILE 141 2HG2 ILE 141 110.959 -2.508 -5.781 1015 HG23 ILE 141 3HG2 ILE 141 111.769 -3.567 -6.935 1016 HD11 ILE 141 3HD1 ILE 141 113.520 -0.976 -3.982 1017 HD12 ILE 141 1HD1 ILE 141 113.700 -2.699 -3.654 1018 HD13 ILE 141 2HD1 ILE 141 112.167 -2.074 -4.261 1019 H ALA 142 H ALA 142 115.641 -2.404 -8.327 1020 HA ALA 142 HA ALA 142 114.841 -5.193 -8.801 1021 HB1 ALA 142 1HB ALA 142 116.722 -3.617 -10.576 1022 HB2 ALA 142 2HB ALA 142 115.180 -4.334 -11.044 1023 HB3 ALA 142 3HB ALA 142 116.545 -5.371 -10.625 1024 H GLY 143 H GLY 143 116.394 -6.722 -8.086 1025 HA2 GLY 143 1HA GLY 143 118.942 -5.778 -7.046 1026 HA3 GLY 143 2HA GLY 143 117.777 -6.234 -5.809 1027 H VAL 144 H VAL 144 119.810 -7.682 -5.505 1028 HA VAL 144 HA VAL 144 119.257 -10.266 -6.820 1029 HB VAL 144 HB VAL 144 121.688 -10.707 -6.942 1030 HG11 VAL 144 1HG1 VAL 144 121.230 -8.092 -8.354 1031 HG12 VAL 144 2HG1 VAL 144 120.241 -9.492 -8.770 1032 HG13 VAL 144 3HG1 VAL 144 121.993 -9.564 -8.957 1033 HG21 VAL 144 3HG2 VAL 144 121.975 -7.773 -6.218 1034 HG22 VAL 144 1HG2 VAL 144 123.284 -8.901 -6.575 1035 HG23 VAL 144 2HG2 VAL 144 122.317 -9.106 -5.114 1036 H GLY 145 H GLY 145 119.754 -12.104 -5.519 1037 HA2 GLY 145 1HA GLY 145 120.413 -11.544 -2.700 1038 HA3 GLY 145 2HA GLY 145 118.906 -12.370 -3.078 1039 H TYR 146 H TYR 146 120.810 -13.503 -1.445 1040 HA TYR 146 HA TYR 146 121.801 -15.759 -3.075 1041 HB2 TYR 146 1HB TYR 146 123.241 -14.447 -0.765 1042 HB3 TYR 146 2HB TYR 146 123.777 -15.878 -1.624 1043 HD1 TYR 146 HD1 TYR 146 123.391 -12.225 -1.754 1044 HD2 TYR 146 HD2 TYR 146 124.710 -15.717 -3.882 1045 HE1 TYR 146 HE1 TYR 146 124.586 -10.783 -3.380 1046 HE2 TYR 146 HE2 TYR 146 125.904 -14.275 -5.507 1047 HH TYR 146 HH TYR 146 126.874 -11.481 -5.117 1048 H ARG 147 H ARG 147 121.551 -17.769 -2.175 1049 HA ARG 147 HA ARG 147 119.901 -17.930 0.246 1050 HB2 ARG 147 1HB ARG 147 120.739 -20.103 -1.691 1051 HB3 ARG 147 2HB ARG 147 119.551 -20.262 -0.398 1052 HG2 ARG 147 1HG ARG 147 119.301 -18.303 -2.695 1053 HG3 ARG 147 2HG ARG 147 118.529 -19.888 -2.660 1054 HD2 ARG 147 1HD ARG 147 117.406 -19.224 -0.516 1055 HD3 ARG 147 2HD ARG 147 118.070 -17.607 -0.721 1056 HE ARG 147 HE ARG 147 116.511 -17.213 -2.394 1057 HH11 ARG 147 1HH1 ARG 147 116.537 -20.649 -1.675 1058 HH12 ARG 147 2HH1 ARG 147 115.123 -20.961 -2.626 1059 HH21 ARG 147 1HH2 ARG 147 114.690 -17.675 -3.599 1060 HH22 ARG 147 2HH2 ARG 147 114.092 -19.298 -3.701 1061 H PHE 148 H PHE 148 120.589 -18.843 2.134 1062 HA PHE 148 HA PHE 148 123.202 -20.194 2.181 1063 HB2 PHE 148 1HB PHE 148 123.559 -17.798 2.732 1064 HB3 PHE 148 2HB PHE 148 122.430 -17.961 4.063 1065 HD1 PHE 148 HD1 PHE 148 125.749 -18.958 2.767 1066 HD2 PHE 148 HD2 PHE 148 123.078 -19.016 6.132 1067 HE1 PHE 148 HE1 PHE 148 127.607 -19.706 4.229 1068 HE2 PHE 148 HE2 PHE 148 124.937 -19.764 7.593 1069 HZ PHE 148 HZ PHE 148 127.201 -20.109 6.643 Start of MODEL 16 1 H1 ALA 1 3H ALA 1 116.565 -25.572 8.070 2 H2 ALA 1 2H ALA 1 116.135 -25.236 9.679 3 H3 ALA 1 HT3 ALA 1 117.637 -24.723 9.074 4 HA ALA 1 HA ALA 1 115.034 -23.781 8.014 5 HB1 ALA 1 2HB ALA 1 115.014 -22.873 10.163 6 HB2 ALA 1 3HB ALA 1 115.881 -21.628 9.264 7 HB3 ALA 1 1HB ALA 1 116.773 -22.787 10.251 8 H THR 2 H THR 2 115.287 -22.036 6.548 9 HA THR 2 HA THR 2 118.022 -21.719 5.443 10 HB THR 2 HB THR 2 115.427 -21.720 3.884 11 HG1 THR 2 HG1 THR 2 115.650 -23.792 4.032 12 HG21 THR 2 3HG2 THR 2 118.331 -21.358 3.218 13 HG22 THR 2 1HG2 THR 2 116.933 -20.456 2.633 14 HG23 THR 2 2HG2 THR 2 117.249 -22.081 2.028 15 H SER 3 H SER 3 118.657 -19.674 4.889 16 HA SER 3 HA SER 3 116.742 -17.474 5.425 17 HB2 SER 3 1HB SER 3 119.693 -17.549 6.104 18 HB3 SER 3 2HB SER 3 118.611 -16.183 6.352 19 HG SER 3 HG SER 3 118.550 -17.226 8.253 20 H THR 4 H THR 4 116.851 -15.699 4.086 21 HA THR 4 HA THR 4 118.762 -15.814 1.832 22 HB THR 4 HB THR 4 115.845 -15.039 1.608 23 HG1 THR 4 HG1 THR 4 115.528 -17.088 1.425 24 HG21 THR 4 3HG2 THR 4 117.866 -15.636 -0.562 25 HG22 THR 4 1HG2 THR 4 117.561 -14.005 0.034 26 HG23 THR 4 2HG2 THR 4 116.267 -14.914 -0.745 27 H VAL 5 H VAL 5 119.747 -13.928 1.367 28 HA VAL 5 HA VAL 5 118.720 -11.462 2.666 29 HB VAL 5 HB VAL 5 121.628 -12.221 2.272 30 HG11 VAL 5 1HG1 VAL 5 120.358 -9.905 3.763 31 HG12 VAL 5 2HG1 VAL 5 121.094 -9.781 2.164 32 HG13 VAL 5 3HG1 VAL 5 122.085 -10.202 3.561 33 HG21 VAL 5 3HG2 VAL 5 121.710 -12.495 4.688 34 HG22 VAL 5 1HG2 VAL 5 120.443 -13.543 4.048 35 HG23 VAL 5 2HG2 VAL 5 120.018 -12.023 4.836 36 H THR 6 H THR 6 118.486 -9.738 1.313 37 HA THR 6 HA THR 6 119.771 -9.879 -1.344 38 HB THR 6 HB THR 6 117.765 -9.368 -2.512 39 HG1 THR 6 HG1 THR 6 116.782 -7.975 -1.143 40 HG21 THR 6 3HG2 THR 6 116.781 -11.414 -2.424 41 HG22 THR 6 1HG2 THR 6 116.450 -11.288 -0.697 42 HG23 THR 6 2HG2 THR 6 118.047 -11.786 -1.254 43 H GLY 7 H GLY 7 119.802 -7.842 -2.473 44 HA2 GLY 7 1HA GLY 7 119.070 -5.442 -0.963 45 HA3 GLY 7 2HA GLY 7 120.771 -5.618 -1.403 46 H GLY 8 H GLY 8 118.838 -3.587 -2.351 47 HA2 GLY 8 1HA GLY 8 119.291 -3.942 -5.208 48 HA3 GLY 8 2HA GLY 8 117.603 -3.932 -4.717 49 H TYR 9 H TYR 9 118.371 -2.091 -6.458 50 HA TYR 9 HA TYR 9 118.496 0.427 -4.903 51 HB2 TYR 9 1HB TYR 9 120.515 0.093 -6.272 52 HB3 TYR 9 2HB TYR 9 119.516 -0.107 -7.698 53 HD1 TYR 9 HD2 TYR 9 120.854 2.276 -5.241 54 HD2 TYR 9 HD1 TYR 9 118.408 1.809 -8.740 55 HE1 TYR 9 HE2 TYR 9 120.914 4.727 -5.609 56 HE2 TYR 9 HE1 TYR 9 118.467 4.260 -9.108 57 HH TYR 9 HH TYR 9 120.644 6.298 -7.562 58 H ALA 10 H ALA 10 117.018 2.004 -5.433 59 HA ALA 10 HA ALA 10 115.156 1.471 -7.650 60 HB1 ALA 10 1HB ALA 10 113.256 1.516 -6.350 61 HB2 ALA 10 2HB ALA 10 114.023 2.458 -5.070 62 HB3 ALA 10 3HB ALA 10 114.371 0.737 -5.227 63 H GLN 11 H GLN 11 114.175 3.283 -8.527 64 HA GLN 11 HA GLN 11 114.937 5.912 -7.418 65 HB2 GLN 11 1HB GLN 11 115.302 6.770 -9.665 66 HB3 GLN 11 2HB GLN 11 116.349 5.380 -9.390 67 HG2 GLN 11 1HG GLN 11 114.562 3.962 -10.521 68 HG3 GLN 11 2HG GLN 11 113.783 5.471 -10.993 69 HE21 GLN 11 1HE2 GLN 11 114.234 5.507 -13.238 70 HE22 GLN 11 2HE2 GLN 11 115.806 5.470 -13.879 71 H SER 12 H SER 12 113.327 7.498 -7.505 72 HA SER 12 HA SER 12 110.669 6.511 -8.397 73 HB2 SER 12 1HB SER 12 109.684 7.534 -6.424 74 HB3 SER 12 2HB SER 12 110.924 6.384 -5.936 75 HG SER 12 HG SER 12 112.330 8.386 -6.051 76 H ASP 13 H ASP 13 109.284 7.961 -9.260 77 HA ASP 13 HA ASP 13 110.213 10.748 -9.608 78 HB2 ASP 13 1HB ASP 13 110.517 9.400 -11.695 79 HB3 ASP 13 2HB ASP 13 108.785 9.074 -11.691 80 H ALA 14 H ALA 14 108.611 12.301 -9.430 81 HA ALA 14 HA ALA 14 106.063 11.309 -8.319 82 HB1 ALA 14 1HB ALA 14 107.704 12.661 -6.868 83 HB2 ALA 14 2HB ALA 14 106.022 13.191 -6.903 84 HB3 ALA 14 3HB ALA 14 107.234 14.042 -7.859 85 H GLN 15 H GLN 15 104.626 11.352 -9.894 86 HA GLN 15 HA GLN 15 104.500 13.346 -11.944 87 HB2 GLN 15 1HB GLN 15 102.462 11.315 -10.999 88 HB3 GLN 15 2HB GLN 15 102.271 12.330 -12.429 89 HG2 GLN 15 1HG GLN 15 104.288 11.371 -13.421 90 HG3 GLN 15 2HG GLN 15 104.572 10.411 -11.973 91 HE21 GLN 15 1HE2 GLN 15 104.242 9.183 -14.537 92 HE22 GLN 15 2HE2 GLN 15 102.791 8.301 -14.525 93 H GLY 16 H GLY 16 103.765 15.307 -11.781 94 HA2 GLY 16 1HA GLY 16 102.272 17.032 -11.215 95 HA3 GLY 16 2HA GLY 16 101.635 16.035 -9.917 96 H GLN 17 H GLN 17 104.632 15.537 -9.150 97 HA GLN 17 HA GLN 17 105.199 18.197 -7.981 98 HB2 GLN 17 1HB GLN 17 106.004 15.470 -6.941 99 HB3 GLN 17 2HB GLN 17 106.427 17.013 -6.208 100 HG2 GLN 17 1HG GLN 17 103.612 15.954 -6.598 101 HG3 GLN 17 2HG GLN 17 104.489 16.000 -5.071 102 HE21 GLN 17 1HE2 GLN 17 102.034 17.562 -6.466 103 HE22 GLN 17 2HE2 GLN 17 102.318 19.153 -5.942 104 H MET 18 H MET 18 107.439 18.854 -7.947 105 HA MET 18 HA MET 18 109.007 17.625 -10.125 106 HB2 MET 18 1HB MET 18 109.243 20.317 -8.767 107 HB3 MET 18 2HB MET 18 110.317 19.739 -10.041 108 HG2 MET 18 1HG MET 18 108.295 19.427 -11.507 109 HG3 MET 18 2HG MET 18 107.332 20.211 -10.256 110 HE1 MET 18 3HE MET 18 107.828 22.383 -9.240 111 HE2 MET 18 1HE MET 18 108.692 23.735 -9.982 112 HE3 MET 18 2HE MET 18 109.588 22.446 -9.180 113 H ASN 19 H ASN 19 110.055 15.918 -9.142 114 HA ASN 19 HA ASN 19 112.432 16.502 -7.734 115 HB2 ASN 19 1HB ASN 19 111.960 15.506 -5.566 116 HB3 ASN 19 2HB ASN 19 110.883 16.868 -5.840 117 HD21 ASN 19 1HD2 ASN 19 110.136 14.917 -3.965 118 HD22 ASN 19 2HD2 ASN 19 108.835 14.013 -4.573 119 H LYS 20 H LYS 20 113.783 14.714 -7.501 120 HA LYS 20 HA LYS 20 112.719 12.084 -8.307 121 HB2 LYS 20 1HB LYS 20 113.858 13.163 -10.253 122 HB3 LYS 20 2HB LYS 20 115.334 13.254 -9.292 123 HG2 LYS 20 1HG LYS 20 115.265 10.783 -9.001 124 HG3 LYS 20 2HG LYS 20 113.849 10.722 -10.052 125 HD2 LYS 20 1HD LYS 20 115.205 11.824 -11.850 126 HD3 LYS 20 2HD LYS 20 116.621 11.688 -10.806 127 HE2 LYS 20 1HE LYS 20 116.700 9.777 -12.229 128 HE3 LYS 20 2HE LYS 20 116.108 9.185 -10.678 129 HZ1 LYS 20 3HZ LYS 20 113.822 9.857 -11.847 130 HZ2 LYS 20 1HZ LYS 20 114.505 8.308 -11.969 131 HZ3 LYS 20 2HZ LYS 20 114.728 9.435 -13.221 132 H MET 21 H MET 21 113.581 10.358 -7.138 133 HA MET 21 HA MET 21 115.646 11.066 -5.121 134 HB2 MET 21 1HB MET 21 113.088 9.520 -4.663 135 HB3 MET 21 2HB MET 21 114.387 9.695 -3.483 136 HG2 MET 21 1HG MET 21 114.128 12.191 -3.672 137 HG3 MET 21 2HG MET 21 112.707 11.915 -4.679 138 HE1 MET 21 3HE MET 21 111.550 9.189 -3.254 139 HE2 MET 21 1HE MET 21 110.729 10.545 -4.038 140 HE3 MET 21 2HE MET 21 110.259 10.047 -2.415 141 H GLY 22 H GLY 22 117.000 9.415 -4.444 142 HA2 GLY 22 1HA GLY 22 116.770 6.823 -5.858 143 HA3 GLY 22 2HA GLY 22 118.306 7.692 -5.813 144 H GLY 23 H GLY 23 117.078 5.083 -4.531 145 HA2 GLY 23 1HA GLY 23 118.315 5.487 -1.904 146 HA3 GLY 23 2HA GLY 23 116.622 5.022 -1.934 147 H PHE 24 H PHE 24 118.302 3.443 -0.620 148 HA PHE 24 HA PHE 24 118.694 1.086 -2.383 149 HB2 PHE 24 1HB PHE 24 120.295 1.880 0.059 150 HB3 PHE 24 2HB PHE 24 120.497 0.394 -0.848 151 HD1 PHE 24 HD1 PHE 24 120.998 4.046 -0.850 152 HD2 PHE 24 HD2 PHE 24 121.631 0.381 -3.000 153 HE1 PHE 24 HE1 PHE 24 122.621 5.195 -2.331 154 HE2 PHE 24 HE2 PHE 24 123.255 1.531 -4.482 155 HZ PHE 24 HZ PHE 24 123.749 3.938 -4.147 156 H ASN 25 H ASN 25 118.169 -0.965 -1.397 157 HA ASN 25 HA ASN 25 116.664 -0.780 1.137 158 HB2 ASN 25 1HB ASN 25 114.841 -2.091 0.213 159 HB3 ASN 25 2HB ASN 25 115.062 -0.626 -0.738 160 HD21 ASN 25 1HD2 ASN 25 113.764 -2.915 -1.846 161 HD22 ASN 25 2HD2 ASN 25 114.756 -3.558 -3.065 162 H LEU 26 H LEU 26 116.775 -2.522 2.454 163 HA LEU 26 HA LEU 26 118.186 -4.929 1.468 164 HB2 LEU 26 1HB LEU 26 118.542 -3.630 4.185 165 HB3 LEU 26 2HB LEU 26 119.325 -5.109 3.630 166 HG LEU 26 HG LEU 26 119.647 -2.408 2.292 167 HD11 LEU 26 1HD1 LEU 26 120.652 -2.420 4.543 168 HD12 LEU 26 2HD1 LEU 26 121.907 -2.430 3.304 169 HD13 LEU 26 3HD1 LEU 26 121.502 -3.916 4.160 170 HD21 LEU 26 3HD2 LEU 26 121.606 -3.625 1.238 171 HD22 LEU 26 1HD2 LEU 26 120.023 -4.218 0.737 172 HD23 LEU 26 2HD2 LEU 26 120.963 -5.115 1.929 173 H LYS 27 H LYS 27 117.241 -6.854 2.090 174 HA LYS 27 HA LYS 27 115.103 -6.769 4.077 175 HB2 LYS 27 1HB LYS 27 113.416 -7.631 2.557 176 HB3 LYS 27 2HB LYS 27 114.050 -6.100 1.956 177 HG2 LYS 27 1HG LYS 27 115.597 -7.365 0.475 178 HG3 LYS 27 2HG LYS 27 114.830 -8.867 0.998 179 HD2 LYS 27 1HD LYS 27 112.617 -7.828 0.244 180 HD3 LYS 27 2HD LYS 27 113.583 -6.578 -0.539 181 HE2 LYS 27 1HE LYS 27 114.664 -8.174 -1.962 182 HE3 LYS 27 2HE LYS 27 114.009 -9.531 -1.045 183 HZ1 LYS 27 3HZ LYS 27 112.675 -9.316 -2.953 184 HZ2 LYS 27 1HZ LYS 27 112.545 -7.635 -2.785 185 HZ3 LYS 27 2HZ LYS 27 111.756 -8.661 -1.684 186 H TYR 28 H TYR 28 114.248 -8.816 4.656 187 HA TYR 28 HA TYR 28 116.028 -11.101 4.068 188 HB2 TYR 28 1HB TYR 28 116.139 -11.690 6.389 189 HB3 TYR 28 2HB TYR 28 116.673 -10.032 6.208 190 HD1 TYR 28 HD1 TYR 28 114.059 -12.258 7.520 191 HD2 TYR 28 HD2 TYR 28 115.337 -8.178 7.093 192 HE1 TYR 28 HE1 TYR 28 112.401 -11.558 9.227 193 HE2 TYR 28 HE2 TYR 28 113.680 -7.480 8.801 194 HH TYR 28 HH TYR 28 112.331 -8.280 10.486 195 H ARG 29 H ARG 29 115.039 -13.062 3.893 196 HA ARG 29 HA ARG 29 112.122 -13.169 4.402 197 HB2 ARG 29 1HB ARG 29 112.682 -13.004 1.968 198 HB3 ARG 29 2HB ARG 29 113.577 -14.518 2.119 199 HG2 ARG 29 1HG ARG 29 111.553 -15.678 2.860 200 HG3 ARG 29 2HG ARG 29 110.643 -14.168 2.802 201 HD2 ARG 29 1HD ARG 29 110.161 -15.357 0.772 202 HD3 ARG 29 2HD ARG 29 111.220 -14.018 0.348 203 HE ARG 29 HE ARG 29 111.898 -16.862 0.336 204 HH11 ARG 29 1HH1 ARG 29 113.084 -13.567 0.048 205 HH12 ARG 29 2HH1 ARG 29 114.520 -14.055 -0.785 206 HH21 ARG 29 1HH2 ARG 29 113.764 -17.425 -0.736 207 HH22 ARG 29 2HH2 ARG 29 114.900 -16.212 -1.224 208 H TYR 30 H TYR 30 111.337 -14.985 5.357 209 HA TYR 30 HA TYR 30 113.265 -17.146 5.992 210 HB2 TYR 30 1HB TYR 30 112.758 -15.722 7.948 211 HB3 TYR 30 2HB TYR 30 111.051 -16.068 7.741 212 HD1 TYR 30 HD1 TYR 30 114.338 -17.486 8.669 213 HD2 TYR 30 HD2 TYR 30 110.103 -18.169 8.450 214 HE1 TYR 30 HE1 TYR 30 114.592 -19.513 10.076 215 HE2 TYR 30 HE2 TYR 30 110.357 -20.196 9.857 216 HH TYR 30 HH TYR 30 113.469 -21.526 10.616 217 H GLU 31 H GLU 31 112.543 -19.234 5.813 218 HA GLU 31 HA GLU 31 109.736 -19.647 4.977 219 HB2 GLU 31 1HB GLU 31 112.200 -20.824 3.669 220 HB3 GLU 31 2HB GLU 31 110.535 -21.260 3.281 221 HG2 GLU 31 1HG GLU 31 110.081 -18.883 2.701 222 HG3 GLU 31 2HG GLU 31 111.770 -18.507 3.006 223 H GLU 32 H GLU 32 108.820 -21.616 5.537 224 HA GLU 32 HA GLU 32 110.157 -23.058 7.695 225 HB2 GLU 32 1HB GLU 32 107.765 -22.378 7.889 226 HB3 GLU 32 2HB GLU 32 107.385 -23.458 6.548 227 HG2 GLU 32 1HG GLU 32 106.941 -24.671 8.574 228 HG3 GLU 32 2HG GLU 32 108.414 -25.338 7.878 229 H ASP 33 H ASP 33 110.680 -25.240 7.645 230 HA ASP 33 HA ASP 33 111.663 -26.118 5.135 231 HB2 ASP 33 1HB ASP 33 112.471 -28.067 6.341 232 HB3 ASP 33 2HB ASP 33 112.786 -26.601 7.265 233 H ASN 34 H ASN 34 108.917 -27.286 7.121 234 HA ASN 34 HA ASN 34 108.336 -29.254 4.993 235 HB2 ASN 34 1HB ASN 34 107.048 -30.452 6.649 236 HB3 ASN 34 2HB ASN 34 108.657 -30.116 7.278 237 HD21 ASN 34 1HD2 ASN 34 106.433 -30.641 9.016 238 HD22 ASN 34 2HD2 ASN 34 106.090 -29.220 9.879 239 H SER 35 H SER 35 107.118 -26.290 6.243 240 HA SER 35 HA SER 35 104.892 -26.498 4.360 241 HB2 SER 35 1HB SER 35 103.332 -25.507 6.088 242 HB3 SER 35 2HB SER 35 103.794 -27.180 6.383 243 HG SER 35 HG SER 35 104.036 -25.987 8.275 244 HA PRO 36 HA PRO 36 107.488 -22.680 4.600 245 HB2 PRO 36 1HB PRO 36 107.428 -22.568 1.668 246 HB3 PRO 36 2HB PRO 36 108.811 -22.717 2.763 247 HG2 PRO 36 1HG PRO 36 107.968 -24.716 1.164 248 HG3 PRO 36 2HG PRO 36 108.773 -24.985 2.721 249 HD2 PRO 36 1HD PRO 36 105.853 -25.173 2.058 250 HD3 PRO 36 2HD PRO 36 106.831 -26.184 3.149 251 H LEU 37 H LEU 37 106.683 -20.749 4.914 252 HA LEU 37 HA LEU 37 104.686 -19.651 3.028 253 HB2 LEU 37 1HB LEU 37 104.958 -19.005 5.982 254 HB3 LEU 37 2HB LEU 37 103.780 -18.311 4.868 255 HG LEU 37 HG LEU 37 103.985 -21.267 5.513 256 HD11 LEU 37 1HD1 LEU 37 102.004 -20.946 6.884 257 HD12 LEU 37 2HD1 LEU 37 101.933 -19.239 6.448 258 HD13 LEU 37 3HD1 LEU 37 103.256 -19.839 7.447 259 HD21 LEU 37 3HD2 LEU 37 102.006 -19.585 3.946 260 HD22 LEU 37 1HD2 LEU 37 101.695 -21.251 4.436 261 HD23 LEU 37 2HD2 LEU 37 103.018 -20.890 3.327 262 H GLY 38 H GLY 38 105.260 -17.597 2.180 263 HA2 GLY 38 1HA GLY 38 108.068 -16.913 2.724 264 HA3 GLY 38 2HA GLY 38 107.136 -16.416 1.315 265 H VAL 39 H VAL 39 108.395 -15.379 4.216 266 HA VAL 39 HA VAL 39 106.685 -12.957 4.087 267 HB VAL 39 HB VAL 39 107.049 -12.682 6.520 268 HG11 VAL 39 1HG1 VAL 39 104.999 -13.767 5.742 269 HG12 VAL 39 2HG1 VAL 39 105.544 -14.532 7.235 270 HG13 VAL 39 3HG1 VAL 39 105.820 -15.327 5.685 271 HG21 VAL 39 3HG2 VAL 39 109.106 -13.906 6.839 272 HG22 VAL 39 1HG2 VAL 39 108.380 -15.390 6.222 273 HG23 VAL 39 2HG2 VAL 39 107.858 -14.732 7.772 274 H ILE 40 H ILE 40 107.781 -11.146 3.734 275 HA ILE 40 HA ILE 40 110.687 -11.099 4.287 276 HB ILE 40 HB ILE 40 110.316 -11.675 1.920 277 HG12 ILE 40 1HG1 ILE 40 111.257 -8.822 1.946 278 HG13 ILE 40 2HG1 ILE 40 112.154 -10.041 2.853 279 HG21 ILE 40 1HG2 ILE 40 108.903 -8.994 1.798 280 HG22 ILE 40 2HG2 ILE 40 108.137 -10.572 1.613 281 HG23 ILE 40 3HG2 ILE 40 109.298 -10.009 0.411 282 HD11 ILE 40 3HD1 ILE 40 111.965 -11.415 0.603 283 HD12 ILE 40 1HD1 ILE 40 113.207 -10.177 0.784 284 HD13 ILE 40 2HD1 ILE 40 111.729 -9.818 -0.107 285 H GLY 41 H GLY 41 111.482 -9.227 5.018 286 HA2 GLY 41 1HA GLY 41 109.672 -6.873 5.117 287 HA3 GLY 41 2HA GLY 41 110.758 -7.305 6.438 288 H SER 42 H SER 42 110.481 -5.018 4.287 289 HA SER 42 HA SER 42 113.356 -4.933 3.576 290 HB2 SER 42 1HB SER 42 111.087 -3.915 1.856 291 HB3 SER 42 2HB SER 42 112.795 -3.975 1.439 292 HG SER 42 HG SER 42 111.417 -5.743 0.646 293 H PHE 43 H PHE 43 114.393 -3.032 3.971 294 HA PHE 43 HA PHE 43 112.738 -0.707 4.800 295 HB2 PHE 43 1HB PHE 43 115.486 -1.515 5.769 296 HB3 PHE 43 2HB PHE 43 114.638 -0.051 6.229 297 HD1 PHE 43 HD1 PHE 43 112.599 -0.182 7.653 298 HD2 PHE 43 HD2 PHE 43 114.963 -3.648 6.733 299 HE1 PHE 43 HE1 PHE 43 111.515 -1.415 9.512 300 HE2 PHE 43 HE2 PHE 43 113.880 -4.881 8.592 301 HZ PHE 43 HZ PHE 43 112.156 -3.764 9.981 302 H THR 44 H THR 44 113.026 1.113 3.585 303 HA THR 44 HA THR 44 115.372 1.163 1.760 304 HB THR 44 HB THR 44 112.573 2.118 1.116 305 HG1 THR 44 HG1 THR 44 112.785 -0.176 1.291 306 HG21 THR 44 3HG2 THR 44 113.560 2.115 -1.217 307 HG22 THR 44 1HG2 THR 44 115.139 1.867 -0.471 308 HG23 THR 44 2HG2 THR 44 114.226 3.337 -0.134 309 H TYR 45 H TYR 45 116.423 3.072 1.532 310 HA TYR 45 HA TYR 45 115.217 5.484 2.750 311 HB2 TYR 45 1HB TYR 45 116.945 4.514 4.260 312 HB3 TYR 45 2HB TYR 45 118.120 4.672 2.968 313 HD1 TYR 45 HD1 TYR 45 115.946 6.531 5.321 314 HD2 TYR 45 HD2 TYR 45 119.123 6.796 2.444 315 HE1 TYR 45 HE1 TYR 45 116.408 8.855 6.049 316 HE2 TYR 45 HE2 TYR 45 119.583 9.121 3.172 317 HH TYR 45 HH TYR 45 117.843 11.028 4.450 318 H THR 46 H THR 46 115.260 7.206 1.447 319 HA THR 46 HA THR 46 116.957 7.098 -0.980 320 HB THR 46 HB THR 46 115.167 8.240 -2.187 321 HG1 THR 46 HG1 THR 46 113.100 8.326 -1.011 322 HG21 THR 46 3HG2 THR 46 113.311 6.397 -1.778 323 HG22 THR 46 1HG2 THR 46 114.582 5.638 -0.821 324 HG23 THR 46 2HG2 THR 46 114.849 5.976 -2.529 325 H GLU 47 H GLU 47 117.788 9.041 -1.728 326 HA GLU 47 HA GLU 47 117.569 11.372 0.074 327 HB2 GLU 47 1HB GLU 47 120.084 10.294 -1.229 328 HB3 GLU 47 2HB GLU 47 119.975 11.797 -0.314 329 HG2 GLU 47 1HG GLU 47 119.223 10.501 1.671 330 HG3 GLU 47 2HG GLU 47 119.430 9.014 0.755 331 H LYS 48 H LYS 48 118.316 13.398 -1.029 332 HA LYS 48 HA LYS 48 117.217 13.507 -3.722 333 HB2 LYS 48 1HB LYS 48 116.662 15.231 -2.002 334 HB3 LYS 48 2HB LYS 48 118.350 15.736 -2.014 335 HG2 LYS 48 1HG LYS 48 117.258 17.224 -3.507 336 HG3 LYS 48 2HG LYS 48 118.072 16.056 -4.547 337 HD2 LYS 48 1HD LYS 48 115.990 14.801 -4.823 338 HD3 LYS 48 2HD LYS 48 115.162 15.888 -3.708 339 HE2 LYS 48 1HE LYS 48 115.697 17.788 -5.255 340 HE3 LYS 48 2HE LYS 48 116.353 16.616 -6.398 341 HZ1 LYS 48 3HZ LYS 48 113.633 17.284 -5.850 342 HZ2 LYS 48 1HZ LYS 48 113.905 15.615 -5.709 343 HZ3 LYS 48 2HZ LYS 48 114.292 16.418 -7.155 344 H SER 49 H SER 49 118.361 13.836 -5.564 345 HA SER 49 HA SER 49 121.291 13.697 -5.342 346 HB2 SER 49 1HB SER 49 120.122 12.001 -6.739 347 HB3 SER 49 2HB SER 49 119.515 13.299 -7.762 348 HG SER 49 HG SER 49 121.456 12.366 -8.569 349 H ARG 50 H ARG 50 122.640 15.154 -6.417 350 HA ARG 50 HA ARG 50 121.667 17.835 -6.523 351 HB2 ARG 50 1HB ARG 50 123.996 17.212 -5.882 352 HB3 ARG 50 2HB ARG 50 124.297 16.751 -7.557 353 HG2 ARG 50 1HG ARG 50 123.680 19.061 -8.267 354 HG3 ARG 50 2HG ARG 50 123.512 19.508 -6.569 355 HD2 ARG 50 1HD ARG 50 126.041 18.447 -7.860 356 HD3 ARG 50 2HD ARG 50 125.738 20.132 -7.444 357 HE ARG 50 HE ARG 50 125.342 18.676 -5.114 358 HH11 ARG 50 1HH1 ARG 50 128.030 19.249 -7.299 359 HH12 ARG 50 2HH1 ARG 50 129.214 19.051 -6.052 360 HH21 ARG 50 1HH2 ARG 50 126.914 18.432 -3.552 361 HH22 ARG 50 2HH2 ARG 50 128.590 18.594 -3.958 362 H THR 51 H THR 51 121.024 19.047 -8.198 363 HA THR 51 HA THR 51 121.291 17.965 -10.935 364 HB THR 51 HB THR 51 118.801 19.273 -9.814 365 HG1 THR 51 HG1 THR 51 119.241 17.131 -9.032 366 HG21 THR 51 3HG2 THR 51 119.089 19.668 -12.196 367 HG22 THR 51 1HG2 THR 51 117.830 18.455 -11.969 368 HG23 THR 51 2HG2 THR 51 119.448 17.963 -12.468 369 H ALA 52 H ALA 52 121.487 19.519 -12.572 370 HA ALA 52 HA ALA 52 122.619 22.027 -11.752 371 HB1 ALA 52 1HB ALA 52 123.271 20.673 -13.811 372 HB2 ALA 52 2HB ALA 52 123.044 22.403 -14.065 373 HB3 ALA 52 3HB ALA 52 121.786 21.267 -14.554 374 H SER 53 H SER 53 121.612 23.909 -11.447 375 HA SER 53 HA SER 53 119.097 24.527 -12.756 376 HB2 SER 53 1HB SER 53 117.779 24.725 -10.754 377 HB3 SER 53 2HB SER 53 118.479 23.110 -10.770 378 HG SER 53 HG SER 53 118.695 24.242 -8.743 379 H SER 54 H SER 54 118.221 26.643 -11.440 380 HA SER 54 HA SER 54 120.319 28.594 -11.834 381 HB2 SER 54 1HB SER 54 118.606 30.225 -11.695 382 HB3 SER 54 2HB SER 54 117.892 28.853 -12.536 383 HG SER 54 HG SER 54 116.515 28.721 -10.959 384 H GLY 55 H GLY 55 120.214 26.695 -9.335 385 HA2 GLY 55 1HA GLY 55 121.486 27.204 -7.368 386 HA3 GLY 55 2HA GLY 55 120.863 28.844 -7.427 387 H ASP 56 H ASP 56 118.164 27.088 -8.020 388 HA ASP 56 HA ASP 56 117.370 27.129 -5.206 389 HB2 ASP 56 1HB ASP 56 115.095 26.672 -6.121 390 HB3 ASP 56 2HB ASP 56 115.825 28.137 -6.775 391 H TYR 57 H TYR 57 117.790 25.368 -4.040 392 HA TYR 57 HA TYR 57 117.233 22.719 -5.230 393 HB2 TYR 57 1HB TYR 57 119.669 23.135 -5.214 394 HB3 TYR 57 2HB TYR 57 119.597 23.418 -3.486 395 HD1 TYR 57 HD1 TYR 57 119.271 20.877 -6.153 396 HD2 TYR 57 HD2 TYR 57 119.447 21.590 -1.921 397 HE1 TYR 57 HE1 TYR 57 119.576 18.448 -5.756 398 HE2 TYR 57 HE2 TYR 57 119.753 19.161 -1.524 399 HH TYR 57 HH TYR 57 120.351 17.189 -2.579 400 H ASN 58 H ASN 58 116.056 21.402 -3.977 401 HA ASN 58 HA ASN 58 115.602 22.185 -1.152 402 HB2 ASN 58 1HB ASN 58 113.744 20.719 -3.041 403 HB3 ASN 58 2HB ASN 58 113.396 21.131 -1.364 404 HD21 ASN 58 1HD2 ASN 58 114.371 23.771 -1.224 405 HD22 ASN 58 2HD2 ASN 58 113.482 24.752 -2.286 406 H LYS 59 H LYS 59 116.150 20.741 0.371 407 HA LYS 59 HA LYS 59 117.243 18.174 -0.457 408 HB2 LYS 59 1HB LYS 59 118.344 19.625 1.272 409 HB3 LYS 59 2HB LYS 59 116.977 19.301 2.338 410 HG2 LYS 59 1HG LYS 59 117.430 16.865 2.145 411 HG3 LYS 59 2HG LYS 59 118.846 17.228 1.154 412 HD2 LYS 59 1HD LYS 59 119.735 18.620 3.048 413 HD3 LYS 59 2HD LYS 59 118.389 18.049 4.036 414 HE2 LYS 59 1HE LYS 59 119.173 15.674 3.398 415 HE3 LYS 59 2HE LYS 59 120.668 16.447 2.876 416 HZ1 LYS 59 3HZ LYS 59 120.881 17.419 5.088 417 HZ2 LYS 59 1HZ LYS 59 120.839 15.724 5.161 418 HZ3 LYS 59 2HZ LYS 59 119.462 16.626 5.584 419 H ASN 60 H ASN 60 116.167 16.310 -0.418 420 HA ASN 60 HA ASN 60 113.658 16.136 1.147 421 HB2 ASN 60 1HB ASN 60 113.242 16.507 -1.286 422 HB3 ASN 60 2HB ASN 60 114.117 15.017 -1.625 423 HD21 ASN 60 1HD2 ASN 60 112.023 14.202 -2.543 424 HD22 ASN 60 2HD2 ASN 60 110.832 13.612 -1.490 425 H GLN 61 H GLN 61 113.631 14.458 2.514 426 HA GLN 61 HA GLN 61 115.242 12.054 1.826 427 HB2 GLN 61 1HB GLN 61 114.768 13.285 4.552 428 HB3 GLN 61 2HB GLN 61 115.539 11.722 4.275 429 HG2 GLN 61 1HG GLN 61 117.314 12.791 2.977 430 HG3 GLN 61 2HG GLN 61 116.528 14.357 3.149 431 HE21 GLN 61 1HE2 GLN 61 119.208 13.854 4.093 432 HE22 GLN 61 2HE2 GLN 61 119.194 13.981 5.786 433 H TYR 62 H TYR 62 114.274 10.074 2.148 434 HA TYR 62 HA TYR 62 111.632 9.990 3.437 435 HB2 TYR 62 1HB TYR 62 112.218 9.442 0.576 436 HB3 TYR 62 2HB TYR 62 111.082 8.374 1.371 437 HD1 TYR 62 HD1 TYR 62 111.763 11.912 0.454 438 HD2 TYR 62 HD2 TYR 62 108.860 9.069 1.849 439 HE1 TYR 62 HE1 TYR 62 109.953 13.567 0.072 440 HE2 TYR 62 HE2 TYR 62 107.055 10.724 1.470 441 HH TYR 62 HH TYR 62 106.895 12.906 -0.250 442 H TYR 63 H TYR 63 111.153 8.060 4.432 443 HA TYR 63 HA TYR 63 112.936 5.756 3.963 444 HB2 TYR 63 1HB TYR 63 113.690 6.926 6.000 445 HB3 TYR 63 2HB TYR 63 112.076 6.794 6.670 446 HD1 TYR 63 HD2 TYR 63 115.181 5.004 5.854 447 HD2 TYR 63 HD1 TYR 63 111.229 4.652 7.498 448 HE1 TYR 63 HE2 TYR 63 115.781 2.804 6.825 449 HE2 TYR 63 HE1 TYR 63 111.831 2.452 8.470 450 HH TYR 63 HH TYR 63 114.925 1.393 8.842 451 H GLY 64 H GLY 64 111.873 3.741 4.053 452 HA2 GLY 64 1HA GLY 64 108.975 3.824 4.632 453 HA3 GLY 64 2HA GLY 64 109.529 3.272 3.057 454 H ILE 65 H ILE 65 108.153 2.006 5.518 455 HA ILE 65 HA ILE 65 109.923 -0.367 5.706 456 HB ILE 65 HB ILE 65 107.806 0.534 7.684 457 HG12 ILE 65 1HG1 ILE 65 110.826 0.563 7.962 458 HG13 ILE 65 2HG1 ILE 65 109.854 1.992 7.611 459 HG21 ILE 65 1HG2 ILE 65 108.164 -1.917 7.563 460 HG22 ILE 65 2HG2 ILE 65 108.739 -1.252 9.092 461 HG23 ILE 65 3HG2 ILE 65 109.891 -1.667 7.823 462 HD11 ILE 65 3HD1 ILE 65 109.782 0.273 10.099 463 HD12 ILE 65 1HD1 ILE 65 108.527 1.452 9.718 464 HD13 ILE 65 2HD1 ILE 65 110.187 1.986 9.981 465 H THR 66 H THR 66 109.097 -2.230 4.884 466 HA THR 66 HA THR 66 106.195 -2.412 4.443 467 HB THR 66 HB THR 66 107.190 -1.478 2.389 468 HG1 THR 66 HG1 THR 66 105.541 -2.594 1.743 469 HG21 THR 66 3HG2 THR 66 108.574 -4.102 1.924 470 HG22 THR 66 1HG2 THR 66 109.399 -2.821 2.813 471 HG23 THR 66 2HG2 THR 66 108.862 -2.541 1.157 472 H ALA 67 H ALA 67 105.435 -4.543 3.944 473 HA ALA 67 HA ALA 67 107.263 -6.786 4.321 474 HB1 ALA 67 1HB ALA 67 104.794 -6.722 6.033 475 HB2 ALA 67 2HB ALA 67 106.276 -5.955 6.605 476 HB3 ALA 67 3HB ALA 67 106.261 -7.679 6.234 477 H GLY 68 H GLY 68 106.361 -8.763 3.499 478 HA2 GLY 68 1HA GLY 68 103.720 -8.555 2.247 479 HA3 GLY 68 2HA GLY 68 105.100 -8.758 1.191 480 HA PRO 69 HA PRO 69 104.054 -13.100 2.798 481 HB2 PRO 69 1HB PRO 69 101.748 -13.847 1.575 482 HB3 PRO 69 2HB PRO 69 101.784 -13.192 3.225 483 HG2 PRO 69 1HG PRO 69 101.072 -11.845 0.673 484 HG3 PRO 69 2HG PRO 69 100.337 -11.688 2.279 485 HD2 PRO 69 1HD PRO 69 102.109 -9.861 1.250 486 HD3 PRO 69 2HD PRO 69 101.880 -10.140 2.989 487 H ALA 70 H ALA 70 104.267 -14.995 1.259 488 HA ALA 70 HA ALA 70 104.524 -14.174 -1.571 489 HB1 ALA 70 1HB ALA 70 106.539 -16.133 -0.668 490 HB2 ALA 70 2HB ALA 70 106.727 -14.516 0.009 491 HB3 ALA 70 3HB ALA 70 106.699 -14.743 -1.737 492 H TYR 71 H TYR 71 104.365 -15.912 -3.091 493 HA TYR 71 HA TYR 71 102.967 -18.296 -2.012 494 HB2 TYR 71 1HB TYR 71 102.514 -16.881 -4.643 495 HB3 TYR 71 2HB TYR 71 101.706 -18.347 -4.119 496 HD1 TYR 71 HD1 TYR 71 100.158 -18.258 -2.128 497 HD2 TYR 71 HD2 TYR 71 101.786 -14.728 -3.954 498 HE1 TYR 71 HE1 TYR 71 98.410 -16.884 -1.029 499 HE2 TYR 71 HE2 TYR 71 100.039 -13.353 -2.856 500 HH TYR 71 HH TYR 71 97.308 -14.425 -1.712 501 H ARG 72 H ARG 72 103.955 -20.139 -2.384 502 HA ARG 72 HA ARG 72 105.937 -20.320 -4.574 503 HB2 ARG 72 1HB ARG 72 105.811 -21.954 -2.028 504 HB3 ARG 72 2HB ARG 72 107.072 -22.018 -3.253 505 HG2 ARG 72 1HG ARG 72 106.398 -19.504 -1.706 506 HG3 ARG 72 2HG ARG 72 107.640 -20.644 -1.197 507 HD2 ARG 72 1HD ARG 72 107.595 -19.247 -3.889 508 HD3 ARG 72 2HD ARG 72 108.553 -18.731 -2.508 509 HE ARG 72 HE ARG 72 108.939 -21.489 -3.378 510 HH11 ARG 72 1HH1 ARG 72 110.129 -18.188 -3.513 511 HH12 ARG 72 2HH1 ARG 72 111.716 -18.677 -4.007 512 HH21 ARG 72 1HH2 ARG 72 110.998 -22.055 -4.014 513 HH22 ARG 72 2HH2 ARG 72 112.199 -20.839 -4.286 514 H ILE 73 H ILE 73 105.710 -21.886 -6.058 515 HA ILE 73 HA ILE 73 105.123 -23.843 -7.070 516 HB ILE 73 HB ILE 73 103.435 -24.555 -4.665 517 HG12 ILE 73 1HG1 ILE 73 106.289 -25.366 -5.301 518 HG13 ILE 73 2HG1 ILE 73 105.867 -24.131 -4.114 519 HG21 ILE 73 1HG2 ILE 73 104.677 -26.211 -6.877 520 HG22 ILE 73 2HG2 ILE 73 102.968 -25.797 -6.752 521 HG23 ILE 73 3HG2 ILE 73 103.715 -26.831 -5.535 522 HD11 ILE 73 3HD1 ILE 73 104.440 -25.850 -2.948 523 HD12 ILE 73 1HD1 ILE 73 106.165 -26.213 -2.927 524 HD13 ILE 73 2HD1 ILE 73 105.099 -27.060 -4.048 525 H ASN 74 H ASN 74 102.605 -21.812 -5.666 526 HA ASN 74 HA ASN 74 100.366 -22.773 -6.993 527 HB2 ASN 74 1HB ASN 74 100.477 -20.909 -5.278 528 HB3 ASN 74 2HB ASN 74 100.970 -19.842 -6.591 529 HD21 ASN 74 1HD2 ASN 74 99.244 -18.762 -7.536 530 HD22 ASN 74 2HD2 ASN 74 97.654 -19.350 -7.620 531 H ASP 75 H ASP 75 102.942 -20.672 -8.191 532 HA ASP 75 HA ASP 75 102.093 -21.272 -10.927 533 HB2 ASP 75 1HB ASP 75 102.311 -18.903 -11.598 534 HB3 ASP 75 2HB ASP 75 100.992 -19.153 -10.460 535 H TRP 76 H TRP 76 103.822 -20.198 -12.476 536 HA TRP 76 HA TRP 76 106.303 -21.394 -11.943 537 HB2 TRP 76 1HB TRP 76 107.126 -20.171 -13.876 538 HB3 TRP 76 2HB TRP 76 105.532 -20.826 -14.200 539 HD1 TRP 76 HD1 TRP 76 103.480 -19.067 -14.237 540 HE1 TRP 76 HE1 TRP 76 103.447 -16.555 -14.810 541 HE3 TRP 76 HE3 TRP 76 108.447 -17.989 -13.754 542 HZ2 TRP 76 HZ2 TRP 76 105.287 -14.372 -15.036 543 HZ3 TRP 76 HZ3 TRP 76 109.279 -15.692 -14.154 544 HH2 TRP 76 HH2 TRP 76 107.710 -13.883 -14.793 545 H ALA 77 H ALA 77 108.238 -20.625 -11.149 546 HA ALA 77 HA ALA 77 109.582 -19.402 -9.743 547 HB1 ALA 77 1HB ALA 77 109.898 -17.797 -11.406 548 HB2 ALA 77 2HB ALA 77 109.287 -16.825 -10.069 549 HB3 ALA 77 3HB ALA 77 108.210 -17.292 -11.383 550 H SER 78 H SER 78 109.308 -17.240 -8.170 551 HA SER 78 HA SER 78 106.929 -17.873 -6.517 552 HB2 SER 78 1HB SER 78 109.109 -18.391 -5.451 553 HB3 SER 78 2HB SER 78 109.596 -16.713 -5.669 554 HG SER 78 HG SER 78 108.727 -16.744 -3.678 555 H ILE 79 H ILE 79 105.740 -16.138 -5.619 556 HA ILE 79 HA ILE 79 106.353 -13.480 -6.810 557 HB ILE 79 HB ILE 79 104.494 -14.571 -8.005 558 HG12 ILE 79 1HG1 ILE 79 103.369 -12.378 -6.259 559 HG13 ILE 79 2HG1 ILE 79 104.597 -12.055 -7.483 560 HG21 ILE 79 1HG2 ILE 79 103.240 -14.653 -5.251 561 HG22 ILE 79 2HG2 ILE 79 103.606 -16.024 -6.297 562 HG23 ILE 79 3HG2 ILE 79 102.336 -14.886 -6.747 563 HD11 ILE 79 3HD1 ILE 79 101.843 -13.233 -7.928 564 HD12 ILE 79 1HD1 ILE 79 103.092 -13.169 -9.172 565 HD13 ILE 79 2HD1 ILE 79 102.441 -11.675 -8.499 566 H TYR 80 H TYR 80 105.763 -11.674 -5.596 567 HA TYR 80 HA TYR 80 104.941 -12.168 -2.800 568 HB2 TYR 80 1HB TYR 80 107.174 -10.343 -3.705 569 HB3 TYR 80 2HB TYR 80 106.592 -10.510 -2.062 570 HD1 TYR 80 HD1 TYR 80 108.068 -12.501 -4.869 571 HD2 TYR 80 HD2 TYR 80 107.622 -12.034 -0.623 572 HE1 TYR 80 HE1 TYR 80 109.710 -14.322 -4.497 573 HE2 TYR 80 HE2 TYR 80 109.260 -13.857 -0.250 574 HH TYR 80 HH TYR 80 110.771 -15.561 -2.999 575 H GLY 81 H GLY 81 103.700 -10.531 -1.884 576 HA2 GLY 81 1HA GLY 81 103.381 -8.031 -3.452 577 HA3 GLY 81 2HA GLY 81 101.976 -8.843 -2.757 578 H VAL 82 H VAL 82 103.105 -6.150 -2.138 579 HA VAL 82 HA VAL 82 103.737 -6.546 0.719 580 HB VAL 82 HB VAL 82 105.565 -4.889 0.532 581 HG11 VAL 82 1HG1 VAL 82 107.139 -6.398 -0.804 582 HG12 VAL 82 2HG1 VAL 82 105.735 -7.413 -1.121 583 HG13 VAL 82 3HG1 VAL 82 106.282 -7.157 0.535 584 HG21 VAL 82 3HG2 VAL 82 104.691 -3.815 -1.562 585 HG22 VAL 82 1HG2 VAL 82 105.216 -5.241 -2.458 586 HG23 VAL 82 2HG2 VAL 82 106.405 -4.223 -1.645 587 H VAL 83 H VAL 83 103.285 -4.866 2.069 588 HA VAL 83 HA VAL 83 102.134 -2.393 0.930 589 HB VAL 83 HB VAL 83 101.134 -3.877 3.386 590 HG11 VAL 83 1HG1 VAL 83 100.845 -1.564 3.807 591 HG12 VAL 83 2HG1 VAL 83 99.289 -2.092 3.170 592 HG13 VAL 83 3HG1 VAL 83 100.419 -1.227 2.129 593 HG21 VAL 83 3HG2 VAL 83 99.469 -3.286 0.955 594 HG22 VAL 83 1HG2 VAL 83 99.271 -4.556 2.162 595 HG23 VAL 83 2HG2 VAL 83 100.536 -4.689 0.942 596 H GLY 84 H GLY 84 102.626 -0.491 2.261 597 HA2 GLY 84 1HA GLY 84 104.069 -0.801 4.731 598 HA3 GLY 84 2HA GLY 84 105.133 -0.385 3.396 599 H VAL 85 H VAL 85 105.330 1.402 5.136 600 HA VAL 85 HA VAL 85 103.634 3.649 4.264 601 HB VAL 85 HB VAL 85 102.759 2.876 6.438 602 HG11 VAL 85 1HG1 VAL 85 104.201 3.065 8.451 603 HG12 VAL 85 2HG1 VAL 85 105.582 3.410 7.410 604 HG13 VAL 85 3HG1 VAL 85 104.788 1.837 7.329 605 HG21 VAL 85 3HG2 VAL 85 104.333 5.424 6.860 606 HG22 VAL 85 1HG2 VAL 85 102.744 5.009 7.504 607 HG23 VAL 85 2HG2 VAL 85 102.939 5.345 5.784 608 H GLY 86 H GLY 86 104.742 5.537 3.991 609 HA2 GLY 86 1HA GLY 86 107.624 5.533 4.702 610 HA3 GLY 86 2HA GLY 86 107.076 6.006 3.096 611 H TYR 87 H TYR 87 108.481 7.512 5.270 612 HA TYR 87 HA TYR 87 106.625 9.815 5.353 613 HB2 TYR 87 1HB TYR 87 107.400 10.398 7.546 614 HB3 TYR 87 2HB TYR 87 106.829 8.742 7.583 615 HD1 TYR 87 HD1 TYR 87 109.756 10.952 7.806 616 HD2 TYR 87 HD2 TYR 87 108.389 6.881 7.903 617 HE1 TYR 87 HE1 TYR 87 111.932 10.245 8.764 618 HE2 TYR 87 HE2 TYR 87 110.565 6.173 8.861 619 HH TYR 87 HH TYR 87 113.290 8.019 8.790 620 H GLY 88 H GLY 88 107.582 11.834 5.040 621 HA2 GLY 88 1HA GLY 88 110.460 11.874 4.435 622 HA3 GLY 88 2HA GLY 88 109.330 12.372 3.185 623 H LYS 89 H LYS 89 111.342 13.991 4.167 624 HA LYS 89 HA LYS 89 109.790 16.162 5.425 625 HB2 LYS 89 1HB LYS 89 111.228 15.068 7.140 626 HB3 LYS 89 2HB LYS 89 112.639 15.433 6.143 627 HG2 LYS 89 1HG LYS 89 112.209 17.822 6.324 628 HG3 LYS 89 2HG LYS 89 110.709 17.518 7.201 629 HD2 LYS 89 1HD LYS 89 112.408 18.079 8.824 630 HD3 LYS 89 2HD LYS 89 112.064 16.358 8.976 631 HE2 LYS 89 1HE LYS 89 114.506 16.842 9.002 632 HE3 LYS 89 2HE LYS 89 114.043 15.807 7.654 633 HZ1 LYS 89 3HZ LYS 89 114.108 18.726 7.299 634 HZ2 LYS 89 1HZ LYS 89 114.310 17.500 6.144 635 HZ3 LYS 89 2HZ LYS 89 115.558 17.842 7.244 636 H PHE 90 H PHE 90 110.137 18.145 4.564 637 HA PHE 90 HA PHE 90 112.167 18.379 2.417 638 HB2 PHE 90 1HB PHE 90 109.408 19.603 2.550 639 HB3 PHE 90 2HB PHE 90 110.591 19.908 1.294 640 HD1 PHE 90 HD1 PHE 90 111.091 18.214 -0.403 641 HD2 PHE 90 HD2 PHE 90 108.194 17.499 2.688 642 HE1 PHE 90 HE1 PHE 90 110.221 16.267 -1.668 643 HE2 PHE 90 HE2 PHE 90 107.325 15.551 1.422 644 HZ PHE 90 HZ PHE 90 108.338 14.936 -0.756 645 H GLN 91 H GLN 91 113.052 20.503 2.091 646 HA GLN 91 HA GLN 91 113.229 22.045 4.567 647 HB2 GLN 91 1HB GLN 91 114.694 22.351 1.934 648 HB3 GLN 91 2HB GLN 91 115.032 23.262 3.403 649 HG2 GLN 91 1HG GLN 91 115.243 20.253 3.101 650 HG3 GLN 91 2HG GLN 91 116.597 21.377 3.162 651 HE21 GLN 91 1HE2 GLN 91 115.257 19.160 5.077 652 HE22 GLN 91 2HE2 GLN 91 115.389 19.911 6.595 653 H THR 92 H THR 92 111.957 23.729 4.930 654 HA THR 92 HA THR 92 111.091 25.407 2.665 655 HB THR 92 HB THR 92 109.272 24.505 4.912 656 HG1 THR 92 HG1 THR 92 109.504 23.712 2.203 657 HG21 THR 92 3HG2 THR 92 108.982 26.312 2.521 658 HG22 THR 92 1HG2 THR 92 108.494 26.599 4.191 659 HG23 THR 92 2HG2 THR 92 107.578 25.475 3.186 660 H THR 93 H THR 93 110.597 27.593 3.238 661 HA THR 93 HA THR 93 111.881 28.457 5.744 662 HB THR 93 HB THR 93 110.962 30.122 3.385 663 HG1 THR 93 HG1 THR 93 113.432 28.932 4.068 664 HG21 THR 93 3HG2 THR 93 112.847 30.765 5.669 665 HG22 THR 93 1HG2 THR 93 111.168 31.295 5.583 666 HG23 THR 93 2HG2 THR 93 112.334 31.864 4.389 667 H GLU 94 H GLU 94 110.707 29.167 7.410 668 HA GLU 94 HA GLU 94 108.178 30.395 7.346 669 HB2 GLU 94 1HB GLU 94 107.538 28.141 6.395 670 HB3 GLU 94 2HB GLU 94 108.028 27.426 7.927 671 HG2 GLU 94 1HG GLU 94 105.647 27.775 8.005 672 HG3 GLU 94 2HG GLU 94 106.389 28.948 9.081 673 H TYR 95 H TYR 95 107.465 30.899 9.462 674 HA TYR 95 HA TYR 95 109.417 30.482 11.563 675 HB2 TYR 95 1HB TYR 95 106.739 31.873 11.470 676 HB3 TYR 95 2HB TYR 95 107.685 31.734 12.940 677 HD1 TYR 95 HD1 TYR 95 109.774 32.985 13.215 678 HD2 TYR 95 HD2 TYR 95 107.419 33.324 9.640 679 HE1 TYR 95 HE1 TYR 95 111.044 35.016 12.572 680 HE2 TYR 95 HE2 TYR 95 108.688 35.355 8.996 681 HH TYR 95 HH TYR 95 110.368 37.168 10.949 682 HA PRO 96 HA PRO 96 108.104 26.652 12.820 683 HB2 PRO 96 1HB PRO 96 108.098 26.759 15.609 684 HB3 PRO 96 2HB PRO 96 109.526 26.514 14.589 685 HG2 PRO 96 1HG PRO 96 108.542 28.988 15.896 686 HG3 PRO 96 2HG PRO 96 110.203 28.421 15.643 687 HD2 PRO 96 1HD PRO 96 109.127 30.372 14.109 688 HD3 PRO 96 2HD PRO 96 110.288 29.196 13.450 689 H THR 97 H THR 97 106.243 25.627 12.825 690 HA THR 97 HA THR 97 103.960 26.697 14.372 691 HB THR 97 HB THR 97 103.867 25.001 11.863 692 HG1 THR 97 HG1 THR 97 103.427 26.854 10.810 693 HG21 THR 97 3HG2 THR 97 101.927 24.626 13.238 694 HG22 THR 97 1HG2 THR 97 101.444 25.720 11.942 695 HG23 THR 97 2HG2 THR 97 101.754 26.351 13.559 696 H TYR 98 H TYR 98 102.594 25.078 15.401 697 HA TYR 98 HA TYR 98 104.051 22.592 16.009 698 HB2 TYR 98 1HB TYR 98 103.147 23.985 17.867 699 HB3 TYR 98 2HB TYR 98 101.531 23.706 17.249 700 HD1 TYR 98 HD2 TYR 98 104.416 22.231 18.980 701 HD2 TYR 98 HD1 TYR 98 100.455 21.519 17.479 702 HE1 TYR 98 HE2 TYR 98 104.290 20.138 20.306 703 HE2 TYR 98 HE1 TYR 98 100.328 19.427 18.805 704 HH TYR 98 HH TYR 98 101.305 18.296 20.548 705 H LYS 99 H LYS 99 103.561 20.796 14.957 706 HA LYS 99 HA LYS 99 100.916 20.570 13.641 707 HB2 LYS 99 1HB LYS 99 103.589 19.388 12.860 708 HB3 LYS 99 2HB LYS 99 102.060 19.031 12.057 709 HG2 LYS 99 1HG LYS 99 101.780 21.371 11.446 710 HG3 LYS 99 2HG LYS 99 103.230 21.812 12.350 711 HD2 LYS 99 1HD LYS 99 103.848 21.654 10.022 712 HD3 LYS 99 2HD LYS 99 104.537 20.259 10.852 713 HE2 LYS 99 1HE LYS 99 102.749 18.828 10.070 714 HE3 LYS 99 2HE LYS 99 101.885 20.207 9.389 715 HZ1 LYS 99 3HZ LYS 99 104.380 18.944 8.457 716 HZ2 LYS 99 1HZ LYS 99 104.037 20.557 8.060 717 HZ3 LYS 99 2HZ LYS 99 102.976 19.321 7.576 718 H HIS 100 H HIS 100 99.777 18.646 13.805 719 HA HIS 100 HA HIS 100 100.094 16.990 16.046 720 HB2 HIS 100 1HB HIS 100 98.761 16.377 13.405 721 HB3 HIS 100 2HB HIS 100 98.568 15.439 14.873 722 HD1 HIS 100 HD1 HIS 100 97.585 16.960 16.984 723 HD2 HIS 100 HD2 HIS 100 96.861 18.340 13.117 724 HE1 HIS 100 HE1 HIS 100 95.667 18.601 17.158 725 H ASP 101 H ASP 101 101.215 16.602 12.706 726 HA ASP 101 HA ASP 101 103.119 14.545 13.655 727 HB2 ASP 101 1HB ASP 101 101.260 13.564 12.285 728 HB3 ASP 101 2HB ASP 101 101.774 14.583 10.944 729 H THR 102 H THR 102 105.178 15.058 13.270 730 HA THR 102 HA THR 102 105.849 17.577 12.138 731 HB THR 102 HB THR 102 108.171 16.913 12.551 732 HG1 THR 102 HG1 THR 102 108.394 14.844 12.131 733 HG21 THR 102 3HG2 THR 102 107.997 16.640 14.939 734 HG22 THR 102 1HG2 THR 102 106.386 15.938 14.794 735 HG23 THR 102 2HG2 THR 102 106.642 17.642 14.423 736 H SER 103 H SER 103 105.782 14.323 10.818 737 HA SER 103 HA SER 103 107.031 15.332 8.323 738 HB2 SER 103 1HB SER 103 107.783 13.059 7.908 739 HB3 SER 103 2HB SER 103 108.331 13.575 9.500 740 HG SER 103 HG SER 103 107.133 12.070 10.353 741 H ASP 104 H ASP 104 106.265 14.344 6.330 742 HA ASP 104 HA ASP 104 103.352 13.925 6.405 743 HB2 ASP 104 1HB ASP 104 104.310 15.646 4.863 744 HB3 ASP 104 2HB ASP 104 105.164 14.357 4.018 745 H TYR 105 H TYR 105 102.421 11.990 5.800 746 HA TYR 105 HA TYR 105 104.302 9.797 5.130 747 HB2 TYR 105 1HB TYR 105 103.056 8.324 6.533 748 HB3 TYR 105 2HB TYR 105 103.492 9.740 7.467 749 HD1 TYR 105 HD1 TYR 105 101.758 11.426 8.062 750 HD2 TYR 105 HD2 TYR 105 100.775 7.750 6.069 751 HE1 TYR 105 HE1 TYR 105 99.374 11.734 8.671 752 HE2 TYR 105 HE2 TYR 105 98.390 8.058 6.677 753 HH TYR 105 HH TYR 105 97.057 10.824 7.541 754 H GLY 106 H GLY 106 103.514 8.070 3.897 755 HA2 GLY 106 1HA GLY 106 100.931 8.434 2.533 756 HA3 GLY 106 2HA GLY 106 102.395 8.303 1.564 757 H PHE 107 H PHE 107 100.477 6.501 1.096 758 HA PHE 107 HA PHE 107 101.212 4.042 2.583 759 HB2 PHE 107 1HB PHE 107 98.842 4.702 2.723 760 HB3 PHE 107 2HB PHE 107 98.736 4.691 0.975 761 HD1 PHE 107 HD1 PHE 107 99.118 2.591 4.000 762 HD2 PHE 107 HD2 PHE 107 98.485 2.637 -0.248 763 HE1 PHE 107 HE1 PHE 107 98.482 0.195 4.068 764 HE2 PHE 107 HE2 PHE 107 97.850 0.240 -0.181 765 HZ PHE 107 HZ PHE 107 97.847 -0.980 1.978 766 H SER 108 H SER 108 101.975 2.243 1.418 767 HA SER 108 HA SER 108 102.213 2.615 -1.518 768 HB2 SER 108 1HB SER 108 104.506 1.832 -1.430 769 HB3 SER 108 2HB SER 108 104.329 3.225 -0.369 770 HG SER 108 HG SER 108 104.688 0.516 0.234 771 H TYR 109 H TYR 109 102.116 0.823 -2.757 772 HA TYR 109 HA TYR 109 102.087 -1.838 -1.536 773 HB2 TYR 109 1HB TYR 109 99.738 -1.170 -1.532 774 HB3 TYR 109 2HB TYR 109 99.837 -0.735 -3.227 775 HD1 TYR 109 HD1 TYR 109 100.084 -3.604 -0.860 776 HD2 TYR 109 HD2 TYR 109 99.460 -2.345 -4.917 777 HE1 TYR 109 HE1 TYR 109 99.435 -5.917 -1.475 778 HE2 TYR 109 HE2 TYR 109 98.812 -4.658 -5.535 779 HH TYR 109 HH TYR 109 98.921 -6.850 -4.820 780 H GLY 110 H GLY 110 102.598 -3.509 -3.037 781 HA2 GLY 110 1HA GLY 110 102.784 -3.052 -5.850 782 HA3 GLY 110 2HA GLY 110 104.365 -2.891 -5.097 783 H ALA 111 H ALA 111 104.440 -4.771 -6.817 784 HA ALA 111 HA ALA 111 104.474 -7.248 -5.260 785 HB1 ALA 111 1HB ALA 111 102.286 -6.985 -6.665 786 HB2 ALA 111 2HB ALA 111 103.168 -8.512 -6.723 787 HB3 ALA 111 3HB ALA 111 103.334 -7.345 -8.036 788 H GLY 112 H GLY 112 105.813 -8.919 -6.284 789 HA2 GLY 112 1HA GLY 112 107.552 -8.025 -8.459 790 HA3 GLY 112 2HA GLY 112 108.322 -8.279 -6.898 791 H LEU 113 H LEU 113 109.131 -9.706 -9.077 792 HA LEU 113 HA LEU 113 108.221 -12.447 -8.434 793 HB2 LEU 113 1HB LEU 113 108.985 -11.417 -11.178 794 HB3 LEU 113 2HB LEU 113 108.512 -13.068 -10.783 795 HG LEU 113 HG LEU 113 106.747 -10.637 -10.371 796 HD11 LEU 113 1HD1 LEU 113 106.972 -12.653 -12.606 797 HD12 LEU 113 2HD1 LEU 113 106.890 -10.895 -12.717 798 HD13 LEU 113 3HD1 LEU 113 105.452 -11.819 -12.280 799 HD21 LEU 113 3HD2 LEU 113 106.161 -12.407 -8.840 800 HD22 LEU 113 1HD2 LEU 113 106.318 -13.627 -10.104 801 HD23 LEU 113 2HD2 LEU 113 104.994 -12.464 -10.160 802 H GLN 114 H GLN 114 109.841 -14.057 -8.506 803 HA GLN 114 HA GLN 114 112.619 -13.020 -8.571 804 HB2 GLN 114 1HB GLN 114 111.827 -13.757 -6.324 805 HB3 GLN 114 2HB GLN 114 111.549 -15.367 -6.987 806 HG2 GLN 114 1HG GLN 114 113.965 -15.428 -7.677 807 HG3 GLN 114 2HG GLN 114 114.199 -13.906 -6.819 808 HE21 GLN 114 1HE2 GLN 114 115.083 -14.278 -4.789 809 HE22 GLN 114 2HE2 GLN 114 114.708 -15.597 -3.789 810 H PHE 115 H PHE 115 114.084 -14.054 -9.844 811 HA PHE 115 HA PHE 115 113.192 -16.509 -11.252 812 HB2 PHE 115 1HB PHE 115 113.225 -14.434 -12.672 813 HB3 PHE 115 2HB PHE 115 114.950 -14.328 -12.378 814 HD1 PHE 115 HD2 PHE 115 112.272 -16.159 -14.101 815 HD2 PHE 115 HD1 PHE 115 116.503 -15.916 -13.408 816 HE1 PHE 115 HE2 PHE 115 112.672 -17.689 -16.011 817 HE2 PHE 115 HE1 PHE 115 116.904 -17.448 -15.316 818 HZ PHE 115 HZ PHE 115 114.988 -18.333 -16.619 819 H ASN 116 H ASN 116 114.634 -18.164 -11.348 820 HA ASN 116 HA ASN 116 117.243 -17.754 -10.001 821 HB2 ASN 116 1HB ASN 116 115.239 -19.988 -9.761 822 HB3 ASN 116 2HB ASN 116 116.923 -20.183 -9.281 823 HD21 ASN 116 1HD2 ASN 116 117.517 -19.381 -7.236 824 HD22 ASN 116 2HD2 ASN 116 116.502 -18.440 -6.254 825 HA PRO 117 HA PRO 117 118.127 -19.652 -14.108 826 HB2 PRO 117 1HB PRO 117 120.415 -18.314 -14.678 827 HB3 PRO 117 2HB PRO 117 118.810 -17.609 -14.958 828 HG2 PRO 117 1HG PRO 117 120.744 -17.095 -12.769 829 HG3 PRO 117 2HG PRO 117 119.645 -15.979 -13.596 830 HD2 PRO 117 1HD PRO 117 119.161 -17.101 -11.104 831 HD3 PRO 117 2HD PRO 117 117.913 -16.432 -12.172 832 H MET 118 H MET 118 120.649 -20.295 -14.865 833 HA MET 118 HA MET 118 121.330 -22.499 -13.285 834 HB2 MET 118 1HB MET 118 123.029 -20.953 -15.256 835 HB3 MET 118 2HB MET 118 123.433 -22.544 -14.608 836 HG2 MET 118 1HG MET 118 121.236 -23.387 -15.499 837 HG3 MET 118 2HG MET 118 121.015 -21.825 -16.287 838 HE1 MET 118 3HE MET 118 124.270 -24.112 -15.743 839 HE2 MET 118 1HE MET 118 124.068 -25.102 -17.193 840 HE3 MET 118 2HE MET 118 122.808 -25.069 -15.962 841 H GLU 119 H GLU 119 122.607 -19.198 -13.274 842 HA GLU 119 HA GLU 119 124.785 -19.574 -11.549 843 HB2 GLU 119 1HB GLU 119 122.966 -17.170 -11.849 844 HB3 GLU 119 2HB GLU 119 124.535 -17.161 -11.039 845 HG2 GLU 119 1HG GLU 119 125.595 -17.943 -13.151 846 HG3 GLU 119 2HG GLU 119 124.031 -17.847 -13.948 847 H ASN 120 H ASN 120 124.999 -19.170 -9.287 848 HA ASN 120 HA ASN 120 122.786 -20.220 -7.751 849 HB2 ASN 120 1HB ASN 120 124.334 -20.221 -5.888 850 HB3 ASN 120 2HB ASN 120 125.121 -20.888 -7.314 851 HD21 ASN 120 1HD2 ASN 120 126.630 -19.777 -5.140 852 HD22 ASN 120 2HD2 ASN 120 127.402 -18.372 -5.696 853 H VAL 121 H VAL 121 122.989 -17.256 -8.920 854 HA VAL 121 HA VAL 121 122.064 -15.942 -6.432 855 HB VAL 121 HB VAL 121 123.178 -14.640 -8.932 856 HG11 VAL 121 1HG1 VAL 121 123.163 -12.601 -7.568 857 HG12 VAL 121 2HG1 VAL 121 122.500 -13.501 -6.203 858 HG13 VAL 121 3HG1 VAL 121 121.535 -13.276 -7.663 859 HG21 VAL 121 3HG2 VAL 121 124.404 -15.275 -6.238 860 HG22 VAL 121 1HG2 VAL 121 125.070 -14.050 -7.318 861 HG23 VAL 121 2HG2 VAL 121 125.002 -15.736 -7.832 862 H ALA 122 H ALA 122 120.129 -14.779 -6.509 863 HA ALA 122 HA ALA 122 118.426 -15.366 -8.869 864 HB1 ALA 122 1HB ALA 122 117.791 -15.223 -5.923 865 HB2 ALA 122 2HB ALA 122 117.529 -16.567 -7.033 866 HB3 ALA 122 3HB ALA 122 116.538 -15.113 -7.158 867 H LEU 123 H LEU 123 116.932 -13.764 -9.520 868 HA LEU 123 HA LEU 123 117.745 -11.018 -8.741 869 HB2 LEU 123 1HB LEU 123 118.373 -11.711 -11.069 870 HB3 LEU 123 2HB LEU 123 116.658 -11.932 -11.416 871 HG LEU 123 HG LEU 123 116.393 -9.493 -10.560 872 HD11 LEU 123 1HD1 LEU 123 119.337 -9.489 -11.288 873 HD12 LEU 123 2HD1 LEU 123 118.722 -9.392 -9.638 874 HD13 LEU 123 3HD1 LEU 123 118.375 -8.099 -10.785 875 HD21 LEU 123 3HD2 LEU 123 116.056 -10.079 -12.889 876 HD22 LEU 123 1HD2 LEU 123 117.795 -10.188 -13.158 877 HD23 LEU 123 2HD2 LEU 123 117.050 -8.623 -12.830 878 H ASP 124 H ASP 124 116.137 -9.565 -8.237 879 HA ASP 124 HA ASP 124 113.339 -10.530 -8.446 880 HB2 ASP 124 1HB ASP 124 114.558 -9.037 -6.110 881 HB3 ASP 124 2HB ASP 124 112.884 -9.568 -6.252 882 H PHE 125 H PHE 125 111.905 -9.076 -9.195 883 HA PHE 125 HA PHE 125 112.668 -6.222 -9.227 884 HB2 PHE 125 1HB PHE 125 111.880 -5.970 -11.498 885 HB3 PHE 125 2HB PHE 125 113.160 -7.167 -11.447 886 HD1 PHE 125 HD1 PHE 125 112.613 -9.589 -11.695 887 HD2 PHE 125 HD2 PHE 125 109.646 -6.519 -12.163 888 HE1 PHE 125 HE1 PHE 125 111.121 -11.206 -12.838 889 HE2 PHE 125 HE2 PHE 125 108.153 -8.135 -13.306 890 HZ PHE 125 HZ PHE 125 108.890 -10.479 -13.643 891 H SER 126 H SER 126 110.974 -4.808 -8.913 892 HA SER 126 HA SER 126 108.262 -5.917 -8.724 893 HB2 SER 126 1HB SER 126 109.517 -4.357 -6.459 894 HB3 SER 126 2HB SER 126 107.924 -5.105 -6.488 895 HG SER 126 HG SER 126 109.842 -6.253 -5.476 896 H TYR 127 H TYR 127 106.604 -4.351 -8.779 897 HA TYR 127 HA TYR 127 107.464 -1.622 -9.557 898 HB2 TYR 127 1HB TYR 127 106.232 -2.877 -11.300 899 HB3 TYR 127 2HB TYR 127 104.890 -3.077 -10.189 900 HD1 TYR 127 HD1 TYR 127 106.829 -0.631 -12.182 901 HD2 TYR 127 HD2 TYR 127 103.325 -1.297 -9.789 902 HE1 TYR 127 HE1 TYR 127 105.898 1.539 -12.942 903 HE2 TYR 127 HE2 TYR 127 102.394 0.874 -10.549 904 HH TYR 127 HH TYR 127 103.931 2.744 -13.085 905 H GLU 128 H GLU 128 107.135 -0.141 -8.024 906 HA GLU 128 HA GLU 128 105.066 -0.671 -5.965 907 HB2 GLU 128 1HB GLU 128 107.435 -0.709 -5.174 908 HB3 GLU 128 2HB GLU 128 107.588 0.973 -5.683 909 HG2 GLU 128 1HG GLU 128 107.054 1.000 -3.341 910 HG3 GLU 128 2HG GLU 128 105.607 1.507 -4.208 911 H GLN 129 H GLN 129 103.515 0.785 -5.654 912 HA GLN 129 HA GLN 129 103.826 3.489 -6.825 913 HB2 GLN 129 1HB GLN 129 102.163 2.084 -8.049 914 HB3 GLN 129 2HB GLN 129 101.256 1.910 -6.546 915 HG2 GLN 129 1HG GLN 129 101.085 4.397 -6.413 916 HG3 GLN 129 2HG GLN 129 101.881 4.507 -7.973 917 HE21 GLN 129 1HE2 GLN 129 100.007 1.813 -8.466 918 HE22 GLN 129 2HE2 GLN 129 98.576 2.562 -8.980 919 H SER 130 H SER 130 103.488 5.153 -5.450 920 HA SER 130 HA SER 130 102.285 4.562 -2.805 921 HB2 SER 130 1HB SER 130 104.648 6.370 -3.379 922 HB3 SER 130 2HB SER 130 103.879 6.148 -1.810 923 HG SER 130 HG SER 130 105.708 4.611 -3.081 924 H ARG 131 H ARG 131 100.820 6.023 -2.072 925 HA ARG 131 HA ARG 131 100.287 8.381 -3.796 926 HB2 ARG 131 1HB ARG 131 98.325 6.635 -2.295 927 HB3 ARG 131 2HB ARG 131 97.909 8.106 -3.174 928 HG2 ARG 131 1HG ARG 131 98.843 7.091 -5.250 929 HG3 ARG 131 2HG ARG 131 99.135 5.597 -4.356 930 HD2 ARG 131 1HD ARG 131 96.680 5.556 -3.786 931 HD3 ARG 131 2HD ARG 131 96.460 6.913 -4.887 932 HE ARG 131 HE ARG 131 97.819 4.906 -6.285 933 HH11 ARG 131 1HH1 ARG 131 94.657 5.351 -4.828 934 HH12 ARG 131 2HH1 ARG 131 93.883 4.269 -5.936 935 HH21 ARG 131 1HH2 ARG 131 96.768 3.523 -7.684 936 HH22 ARG 131 2HH2 ARG 131 95.064 3.247 -7.533 937 H ILE 132 H ILE 132 100.402 10.305 -2.837 938 HA ILE 132 HA ILE 132 99.614 10.494 0.013 939 HB ILE 132 HB ILE 132 101.722 12.171 -1.402 940 HG12 ILE 132 1HG1 ILE 132 102.074 10.268 0.924 941 HG13 ILE 132 2HG1 ILE 132 102.410 9.816 -0.749 942 HG21 ILE 132 1HG2 ILE 132 102.030 13.217 0.795 943 HG22 ILE 132 2HG2 ILE 132 100.773 12.185 1.480 944 HG23 ILE 132 3HG2 ILE 132 100.356 13.398 0.271 945 HD11 ILE 132 3HD1 ILE 132 103.722 12.073 0.795 946 HD12 ILE 132 1HD1 ILE 132 104.015 11.711 -0.906 947 HD13 ILE 132 2HD1 ILE 132 104.479 10.548 0.335 948 H ARG 133 H ARG 133 97.653 11.632 -0.024 949 HA ARG 133 HA ARG 133 96.390 11.852 -2.441 950 HB2 ARG 133 1HB ARG 133 95.287 11.820 -0.211 951 HB3 ARG 133 2HB ARG 133 95.714 13.520 -0.013 952 HG2 ARG 133 1HG ARG 133 94.468 14.037 -2.116 953 HG3 ARG 133 2HG ARG 133 93.961 12.349 -2.192 954 HD2 ARG 133 1HD ARG 133 93.377 14.253 0.093 955 HD3 ARG 133 2HD ARG 133 92.224 13.759 -1.143 956 HE ARG 133 HE ARG 133 93.326 11.466 0.107 957 HH11 ARG 133 1HH1 ARG 133 91.078 14.078 0.785 958 HH12 ARG 133 2HH1 ARG 133 90.177 13.138 1.927 959 HH21 ARG 133 1HH2 ARG 133 92.126 10.307 1.587 960 HH22 ARG 133 2HH2 ARG 133 90.763 11.029 2.374 961 H SER 134 H SER 134 97.431 12.857 -3.990 962 HA SER 134 HA SER 134 96.988 15.257 -5.013 963 HB2 SER 134 1HB SER 134 99.125 15.612 -2.921 964 HB3 SER 134 2HB SER 134 99.179 16.560 -4.402 965 HG SER 134 HG SER 134 97.954 17.718 -2.994 966 H VAL 135 H VAL 135 99.886 13.377 -4.077 967 HA VAL 135 HA VAL 135 100.911 13.720 -6.828 968 HB VAL 135 HB VAL 135 102.279 14.794 -5.089 969 HG11 VAL 135 1HG1 VAL 135 103.413 13.443 -3.394 970 HG12 VAL 135 2HG1 VAL 135 102.613 11.989 -3.989 971 HG13 VAL 135 3HG1 VAL 135 101.666 13.269 -3.230 972 HG21 VAL 135 3HG2 VAL 135 103.291 13.697 -7.142 973 HG22 VAL 135 1HG2 VAL 135 103.668 12.309 -6.121 974 HG23 VAL 135 2HG2 VAL 135 104.392 13.881 -5.776 975 H ASP 136 H ASP 136 101.404 11.985 -8.016 976 HA ASP 136 HA ASP 136 101.065 9.311 -6.798 977 HB2 ASP 136 1HB ASP 136 99.641 9.858 -8.772 978 HB3 ASP 136 2HB ASP 136 101.107 10.072 -9.730 979 H VAL 137 H VAL 137 102.920 8.224 -6.333 980 HA VAL 137 HA VAL 137 105.387 9.034 -7.767 981 HB VAL 137 HB VAL 137 105.128 7.765 -5.028 982 HG11 VAL 137 1HG1 VAL 137 107.244 7.296 -6.293 983 HG12 VAL 137 2HG1 VAL 137 107.504 8.243 -4.828 984 HG13 VAL 137 3HG1 VAL 137 107.514 9.035 -6.404 985 HG21 VAL 137 3HG2 VAL 137 105.788 10.623 -5.808 986 HG22 VAL 137 1HG2 VAL 137 105.755 9.979 -4.167 987 HG23 VAL 137 2HG2 VAL 137 104.262 10.094 -5.100 988 H GLY 138 H GLY 138 106.470 7.550 -8.910 989 HA2 GLY 138 1HA GLY 138 105.661 4.704 -8.649 990 HA3 GLY 138 2HA GLY 138 106.023 5.461 -10.199 991 H THR 139 H THR 139 107.291 3.275 -8.323 992 HA THR 139 HA THR 139 110.072 4.181 -8.759 993 HB THR 139 HB THR 139 109.109 2.698 -6.305 994 HG1 THR 139 HG1 THR 139 108.443 4.688 -5.922 995 HG21 THR 139 3HG2 THR 139 111.350 3.010 -5.497 996 HG22 THR 139 1HG2 THR 139 111.758 4.051 -6.861 997 HG23 THR 139 2HG2 THR 139 111.478 2.328 -7.118 998 H TRP 140 H TRP 140 111.419 2.685 -9.593 999 HA TRP 140 HA TRP 140 110.376 -0.053 -9.986 1000 HB2 TRP 140 1HB TRP 140 112.557 1.482 -11.408 1001 HB3 TRP 140 2HB TRP 140 112.187 -0.206 -11.705 1002 HD1 TRP 140 HD1 TRP 140 111.114 3.287 -12.539 1003 HE1 TRP 140 HE1 TRP 140 109.166 3.219 -14.225 1004 HE3 TRP 140 HE3 TRP 140 110.009 -1.696 -12.405 1005 HZ2 TRP 140 HZ2 TRP 140 107.374 1.300 -15.370 1006 HZ3 TRP 140 HZ3 TRP 140 108.184 -2.616 -13.800 1007 HH2 TRP 140 HH2 TRP 140 106.865 -1.130 -15.282 1008 H ILE 141 H ILE 141 111.376 -1.743 -9.011 1009 HA ILE 141 HA ILE 141 113.885 -1.177 -7.525 1010 HB ILE 141 HB ILE 141 111.625 -3.009 -6.678 1011 HG12 ILE 141 1HG1 ILE 141 112.472 -0.343 -5.505 1012 HG13 ILE 141 2HG1 ILE 141 111.086 -0.549 -6.577 1013 HG21 ILE 141 1HG2 ILE 141 113.928 -3.649 -5.924 1014 HG22 ILE 141 2HG2 ILE 141 112.865 -3.198 -4.590 1015 HG23 ILE 141 3HG2 ILE 141 114.082 -2.062 -5.171 1016 HD11 ILE 141 3HD1 ILE 141 111.484 -1.638 -3.793 1017 HD12 ILE 141 1HD1 ILE 141 110.318 -2.366 -4.897 1018 HD13 ILE 141 2HD1 ILE 141 110.142 -0.678 -4.417 1019 H ALA 142 H ALA 142 115.554 -2.468 -7.977 1020 HA ALA 142 HA ALA 142 115.023 -5.246 -8.790 1021 HB1 ALA 142 1HB ALA 142 115.386 -3.951 -10.873 1022 HB2 ALA 142 2HB ALA 142 116.676 -5.119 -10.590 1023 HB3 ALA 142 3HB ALA 142 116.944 -3.411 -10.247 1024 H GLY 143 H GLY 143 116.492 -6.706 -7.960 1025 HA2 GLY 143 1HA GLY 143 119.047 -5.828 -6.912 1026 HA3 GLY 143 2HA GLY 143 117.867 -6.218 -5.667 1027 H VAL 144 H VAL 144 119.828 -7.757 -5.334 1028 HA VAL 144 HA VAL 144 119.233 -10.307 -6.710 1029 HB VAL 144 HB VAL 144 121.648 -10.840 -6.659 1030 HG11 VAL 144 1HG1 VAL 144 122.291 -9.384 -8.510 1031 HG12 VAL 144 2HG1 VAL 144 121.054 -8.212 -8.054 1032 HG13 VAL 144 3HG1 VAL 144 120.583 -9.799 -8.666 1033 HG21 VAL 144 3HG2 VAL 144 123.243 -8.957 -6.243 1034 HG22 VAL 144 1HG2 VAL 144 122.334 -9.408 -4.801 1035 HG23 VAL 144 2HG2 VAL 144 121.885 -7.966 -5.710 1036 H GLY 145 H GLY 145 119.698 -12.197 -5.438 1037 HA2 GLY 145 1HA GLY 145 120.084 -11.716 -2.553 1038 HA3 GLY 145 2HA GLY 145 118.652 -12.577 -3.102 1039 H TYR 146 H TYR 146 120.666 -13.575 -1.343 1040 HA TYR 146 HA TYR 146 121.504 -15.935 -2.914 1041 HB2 TYR 146 1HB TYR 146 123.458 -14.479 -2.423 1042 HB3 TYR 146 2HB TYR 146 123.097 -14.610 -0.713 1043 HD1 TYR 146 HD2 TYR 146 124.391 -16.344 -3.684 1044 HD2 TYR 146 HD1 TYR 146 123.521 -16.689 0.508 1045 HE1 TYR 146 HE2 TYR 146 125.751 -18.415 -3.573 1046 HE2 TYR 146 HE1 TYR 146 124.880 -18.760 0.620 1047 HH TYR 146 HH TYR 146 125.788 -20.506 -2.026 1048 H ARG 147 H ARG 147 121.238 -17.895 -1.870 1049 HA ARG 147 HA ARG 147 119.842 -17.787 0.746 1050 HB2 ARG 147 1HB ARG 147 118.375 -18.373 -1.189 1051 HB3 ARG 147 2HB ARG 147 119.398 -19.780 -1.485 1052 HG2 ARG 147 1HG ARG 147 118.897 -20.664 0.732 1053 HG3 ARG 147 2HG ARG 147 117.961 -19.221 1.125 1054 HD2 ARG 147 1HD ARG 147 116.396 -20.934 0.484 1055 HD3 ARG 147 2HD ARG 147 116.459 -19.762 -0.826 1056 HE ARG 147 HE ARG 147 117.483 -22.501 -0.869 1057 HH11 ARG 147 1HH1 ARG 147 117.320 -19.409 -2.530 1058 HH12 ARG 147 2HH1 ARG 147 117.722 -20.104 -4.064 1059 HH21 ARG 147 1HH2 ARG 147 117.999 -23.331 -2.871 1060 HH22 ARG 147 2HH2 ARG 147 118.103 -22.295 -4.254 1061 H PHE 148 H PHE 148 120.512 -19.139 2.316 1062 HA PHE 148 HA PHE 148 122.352 -21.327 1.661 1063 HB2 PHE 148 1HB PHE 148 123.978 -20.626 3.315 1064 HB3 PHE 148 2HB PHE 148 123.777 -19.376 2.102 1065 HD1 PHE 148 HD2 PHE 148 122.718 -17.239 2.658 1066 HD2 PHE 148 HD1 PHE 148 123.224 -20.318 5.611 1067 HE1 PHE 148 HE2 PHE 148 122.236 -15.597 4.453 1068 HE2 PHE 148 HE1 PHE 148 122.741 -18.676 7.405 1069 HZ PHE 148 HZ PHE 148 122.246 -16.316 6.826 Start of MODEL 17 1 H1 ALA 1 3H ALA 1 115.945 -22.078 10.665 2 H2 ALA 1 2H ALA 1 115.246 -21.751 9.152 3 H3 ALA 1 HT3 ALA 1 116.671 -20.956 9.621 4 HA ALA 1 HA ALA 1 117.682 -23.288 9.774 5 HB1 ALA 1 2HB ALA 1 115.437 -23.815 7.813 6 HB2 ALA 1 3HB ALA 1 115.376 -24.331 9.499 7 HB3 ALA 1 1HB ALA 1 116.624 -24.966 8.427 8 H THR 2 H THR 2 115.984 -21.528 7.192 9 HA THR 2 HA THR 2 118.549 -21.344 5.712 10 HB THR 2 HB THR 2 115.762 -21.425 4.529 11 HG1 THR 2 HG1 THR 2 116.101 -23.506 4.187 12 HG21 THR 2 3HG2 THR 2 117.588 -20.164 3.297 13 HG22 THR 2 1HG2 THR 2 116.881 -21.514 2.410 14 HG23 THR 2 2HG2 THR 2 118.457 -21.695 3.179 15 H SER 3 H SER 3 119.125 -19.349 4.933 16 HA SER 3 HA SER 3 117.271 -17.099 5.441 17 HB2 SER 3 1HB SER 3 120.225 -17.160 6.110 18 HB3 SER 3 2HB SER 3 119.161 -15.767 6.270 19 HG SER 3 HG SER 3 118.039 -16.827 7.854 20 H THR 4 H THR 4 117.439 -15.372 4.009 21 HA THR 4 HA THR 4 119.358 -15.672 1.776 22 HB THR 4 HB THR 4 117.636 -14.979 0.199 23 HG1 THR 4 HG1 THR 4 115.803 -14.213 0.866 24 HG21 THR 4 3HG2 THR 4 116.883 -17.310 1.976 25 HG22 THR 4 1HG2 THR 4 117.816 -17.357 0.480 26 HG23 THR 4 2HG2 THR 4 116.095 -16.976 0.434 27 H VAL 5 H VAL 5 120.415 -13.849 1.241 28 HA VAL 5 HA VAL 5 119.549 -11.327 2.550 29 HB VAL 5 HB VAL 5 122.334 -12.121 1.652 30 HG11 VAL 5 1HG1 VAL 5 122.272 -9.777 1.596 31 HG12 VAL 5 2HG1 VAL 5 122.816 -10.100 3.242 32 HG13 VAL 5 3HG1 VAL 5 121.131 -9.679 2.938 33 HG21 VAL 5 3HG2 VAL 5 121.190 -11.901 4.456 34 HG22 VAL 5 1HG2 VAL 5 122.838 -12.365 4.029 35 HG23 VAL 5 2HG2 VAL 5 121.489 -13.424 3.617 36 H THR 6 H THR 6 118.982 -9.696 1.248 37 HA THR 6 HA THR 6 119.794 -9.775 -1.588 38 HB THR 6 HB THR 6 116.967 -9.296 -0.620 39 HG1 THR 6 HG1 THR 6 116.722 -11.352 -0.834 40 HG21 THR 6 3HG2 THR 6 118.098 -9.612 -3.414 41 HG22 THR 6 1HG2 THR 6 117.624 -8.077 -2.687 42 HG23 THR 6 2HG2 THR 6 116.410 -9.317 -2.999 43 H GLY 7 H GLY 7 120.018 -7.787 -2.569 44 HA2 GLY 7 1HA GLY 7 119.157 -5.390 -1.096 45 HA3 GLY 7 2HA GLY 7 120.853 -5.516 -1.569 46 H GLY 8 H GLY 8 118.817 -3.571 -2.483 47 HA2 GLY 8 1HA GLY 8 119.281 -3.897 -5.343 48 HA3 GLY 8 2HA GLY 8 117.594 -3.917 -4.846 49 H TYR 9 H TYR 9 118.307 -2.050 -6.573 50 HA TYR 9 HA TYR 9 118.455 0.459 -5.002 51 HB2 TYR 9 1HB TYR 9 119.459 -0.023 -7.812 52 HB3 TYR 9 2HB TYR 9 119.512 1.502 -6.948 53 HD1 TYR 9 HD2 TYR 9 121.123 1.871 -5.142 54 HD2 TYR 9 HD1 TYR 9 120.973 -1.854 -7.276 55 HE1 TYR 9 HE2 TYR 9 123.336 1.247 -4.210 56 HE2 TYR 9 HE1 TYR 9 123.185 -2.477 -6.344 57 HH TYR 9 HH TYR 9 125.219 -0.246 -4.792 58 H ALA 10 H ALA 10 116.991 2.067 -5.540 59 HA ALA 10 HA ALA 10 115.122 1.533 -7.749 60 HB1 ALA 10 1HB ALA 10 113.224 1.573 -6.449 61 HB2 ALA 10 2HB ALA 10 113.987 2.522 -5.172 62 HB3 ALA 10 3HB ALA 10 114.340 0.801 -5.322 63 H GLN 11 H GLN 11 114.231 3.338 -8.688 64 HA GLN 11 HA GLN 11 115.023 5.977 -7.597 65 HB2 GLN 11 1HB GLN 11 114.838 5.116 -10.497 66 HB3 GLN 11 2HB GLN 11 115.110 6.773 -9.952 67 HG2 GLN 11 1HG GLN 11 117.177 6.103 -8.835 68 HG3 GLN 11 2HG GLN 11 116.897 4.420 -9.275 69 HE21 GLN 11 1HE2 GLN 11 119.266 5.809 -10.092 70 HE22 GLN 11 2HE2 GLN 11 119.223 5.985 -11.780 71 H SER 12 H SER 12 113.412 7.559 -7.584 72 HA SER 12 HA SER 12 110.709 6.614 -8.378 73 HB2 SER 12 1HB SER 12 111.467 8.289 -5.972 74 HB3 SER 12 2HB SER 12 109.832 7.827 -6.436 75 HG SER 12 HG SER 12 111.958 6.017 -5.895 76 H ASP 13 H ASP 13 109.450 7.973 -9.475 77 HA ASP 13 HA ASP 13 110.447 10.712 -9.999 78 HB2 ASP 13 1HB ASP 13 108.797 8.889 -11.772 79 HB3 ASP 13 2HB ASP 13 109.226 10.556 -12.152 80 H ALA 14 H ALA 14 108.992 12.392 -9.779 81 HA ALA 14 HA ALA 14 106.486 11.694 -8.394 82 HB1 ALA 14 1HB ALA 14 106.774 13.520 -7.045 83 HB2 ALA 14 2HB ALA 14 107.594 14.457 -8.295 84 HB3 ALA 14 3HB ALA 14 108.467 13.204 -7.416 85 H GLN 15 H GLN 15 104.929 11.649 -9.833 86 HA GLN 15 HA GLN 15 104.740 13.522 -12.031 87 HB2 GLN 15 1HB GLN 15 103.948 11.166 -12.222 88 HB3 GLN 15 2HB GLN 15 102.691 11.526 -11.038 89 HG2 GLN 15 1HG GLN 15 101.775 13.263 -12.507 90 HG3 GLN 15 2HG GLN 15 103.051 12.965 -13.681 91 HE21 GLN 15 1HE2 GLN 15 100.499 12.686 -14.641 92 HE22 GLN 15 2HE2 GLN 15 100.098 11.048 -14.839 93 H GLY 16 H GLY 16 103.877 15.438 -11.924 94 HA2 GLY 16 1HA GLY 16 102.414 17.154 -11.327 95 HA3 GLY 16 2HA GLY 16 101.735 16.121 -10.078 96 H GLN 17 H GLN 17 104.711 15.627 -9.229 97 HA GLN 17 HA GLN 17 105.184 18.236 -7.913 98 HB2 GLN 17 1HB GLN 17 104.663 16.361 -6.351 99 HB3 GLN 17 2HB GLN 17 106.067 15.496 -6.975 100 HG2 GLN 17 1HG GLN 17 107.491 17.458 -6.324 101 HG3 GLN 17 2HG GLN 17 106.073 18.173 -5.558 102 HE21 GLN 17 1HE2 GLN 17 106.118 17.810 -3.344 103 HE22 GLN 17 2HE2 GLN 17 106.672 16.389 -2.598 104 H MET 18 H MET 18 107.268 19.108 -8.042 105 HA MET 18 HA MET 18 109.023 17.898 -10.048 106 HB2 MET 18 1HB MET 18 109.160 20.535 -8.566 107 HB3 MET 18 2HB MET 18 110.330 20.011 -9.777 108 HG2 MET 18 1HG MET 18 108.476 19.795 -11.429 109 HG3 MET 18 2HG MET 18 107.359 20.426 -10.219 110 HE1 MET 18 3HE MET 18 107.894 22.293 -13.208 111 HE2 MET 18 1HE MET 18 107.138 23.427 -12.080 112 HE3 MET 18 2HE MET 18 106.716 21.717 -12.032 113 H ASN 19 H ASN 19 110.048 16.169 -9.109 114 HA ASN 19 HA ASN 19 112.224 16.615 -7.362 115 HB2 ASN 19 1HB ASN 19 110.238 16.862 -5.769 116 HB3 ASN 19 2HB ASN 19 109.966 15.139 -6.015 117 HD21 ASN 19 1HD2 ASN 19 110.761 14.126 -4.159 118 HD22 ASN 19 2HD2 ASN 19 112.287 14.429 -3.478 119 H LYS 20 H LYS 20 113.546 14.835 -7.196 120 HA LYS 20 HA LYS 20 112.502 12.231 -8.087 121 HB2 LYS 20 1HB LYS 20 114.442 11.828 -9.470 122 HB3 LYS 20 2HB LYS 20 113.685 13.332 -9.983 123 HG2 LYS 20 1HG LYS 20 115.351 14.586 -8.594 124 HG3 LYS 20 2HG LYS 20 116.148 13.054 -8.235 125 HD2 LYS 20 1HD LYS 20 116.336 12.707 -10.753 126 HD3 LYS 20 2HD LYS 20 115.843 14.392 -10.930 127 HE2 LYS 20 1HE LYS 20 118.220 13.458 -9.296 128 HE3 LYS 20 2HE LYS 20 118.323 14.120 -10.927 129 HZ1 LYS 20 3HZ LYS 20 116.907 16.017 -9.789 130 HZ2 LYS 20 1HZ LYS 20 118.603 16.017 -9.750 131 HZ3 LYS 20 2HZ LYS 20 117.723 15.463 -8.406 132 H MET 21 H MET 21 113.522 10.407 -7.120 133 HA MET 21 HA MET 21 115.332 11.066 -4.862 134 HB2 MET 21 1HB MET 21 112.924 9.232 -4.748 135 HB3 MET 21 2HB MET 21 114.047 9.547 -3.430 136 HG2 MET 21 1HG MET 21 112.267 11.603 -4.772 137 HG3 MET 21 2HG MET 21 112.010 10.904 -3.177 138 HE1 MET 21 3HE MET 21 113.520 11.032 -1.282 139 HE2 MET 21 1HE MET 21 114.835 12.184 -1.020 140 HE3 MET 21 2HE MET 21 115.088 10.771 -2.042 141 H GLY 22 H GLY 22 116.813 9.512 -4.293 142 HA2 GLY 22 1HA GLY 22 116.808 6.990 -5.858 143 HA3 GLY 22 2HA GLY 22 118.288 7.920 -5.606 144 H GLY 23 H GLY 23 117.065 5.169 -4.610 145 HA2 GLY 23 1HA GLY 23 118.084 5.443 -1.880 146 HA3 GLY 23 2HA GLY 23 116.402 4.975 -2.050 147 H PHE 24 H PHE 24 118.025 3.347 -0.710 148 HA PHE 24 HA PHE 24 118.328 1.029 -2.525 149 HB2 PHE 24 1HB PHE 24 120.298 0.315 -1.300 150 HB3 PHE 24 2HB PHE 24 120.558 1.911 -1.977 151 HD1 PHE 24 HD1 PHE 24 120.540 3.914 -0.495 152 HD2 PHE 24 HD2 PHE 24 120.280 -0.080 1.064 153 HE1 PHE 24 HE1 PHE 24 121.141 4.754 1.759 154 HE2 PHE 24 HE2 PHE 24 120.879 0.760 3.319 155 HZ PHE 24 HZ PHE 24 121.310 3.177 3.666 156 H ASN 25 H ASN 25 118.024 -1.041 -1.447 157 HA ASN 25 HA ASN 25 116.731 -0.902 1.187 158 HB2 ASN 25 1HB ASN 25 114.775 -2.150 0.385 159 HB3 ASN 25 2HB ASN 25 114.918 -0.596 -0.435 160 HD21 ASN 25 1HD2 ASN 25 114.992 -0.642 -2.701 161 HD22 ASN 25 2HD2 ASN 25 115.199 -2.053 -3.622 162 H LEU 26 H LEU 26 116.662 -2.850 2.315 163 HA LEU 26 HA LEU 26 118.062 -5.144 1.078 164 HB2 LEU 26 1HB LEU 26 118.991 -5.645 3.352 165 HB3 LEU 26 2HB LEU 26 119.657 -4.200 2.602 166 HG LEU 26 HG LEU 26 117.260 -3.902 4.383 167 HD11 LEU 26 1HD1 LEU 26 118.516 -5.159 5.905 168 HD12 LEU 26 2HD1 LEU 26 119.056 -3.515 6.249 169 HD13 LEU 26 3HD1 LEU 26 120.054 -4.582 5.261 170 HD21 LEU 26 3HD2 LEU 26 118.775 -1.827 4.971 171 HD22 LEU 26 1HD2 LEU 26 117.895 -1.857 3.445 172 HD23 LEU 26 2HD2 LEU 26 119.610 -2.260 3.481 173 H LYS 27 H LYS 27 117.180 -7.145 1.490 174 HA LYS 27 HA LYS 27 114.635 -7.137 3.015 175 HB2 LYS 27 1HB LYS 27 115.305 -8.589 0.448 176 HB3 LYS 27 2HB LYS 27 113.814 -8.795 1.367 177 HG2 LYS 27 1HG LYS 27 113.371 -6.353 1.124 178 HG3 LYS 27 2HG LYS 27 114.803 -6.223 0.103 179 HD2 LYS 27 1HD LYS 27 113.804 -7.917 -1.439 180 HD3 LYS 27 2HD LYS 27 112.339 -7.898 -0.457 181 HE2 LYS 27 1HE LYS 27 112.304 -5.361 -0.838 182 HE3 LYS 27 2HE LYS 27 113.512 -5.643 -2.092 183 HZ1 LYS 27 3HZ LYS 27 111.137 -7.333 -2.138 184 HZ2 LYS 27 1HZ LYS 27 112.029 -6.678 -3.424 185 HZ3 LYS 27 2HZ LYS 27 110.924 -5.704 -2.574 186 H TYR 28 H TYR 28 114.241 -8.762 4.375 187 HA TYR 28 HA TYR 28 116.147 -11.033 4.475 188 HB2 TYR 28 1HB TYR 28 116.352 -9.493 6.411 189 HB3 TYR 28 2HB TYR 28 114.656 -9.753 6.773 190 HD1 TYR 28 HD1 TYR 28 113.881 -11.870 7.724 191 HD2 TYR 28 HD2 TYR 28 118.029 -11.211 6.826 192 HE1 TYR 28 HE1 TYR 28 114.490 -13.849 9.087 193 HE2 TYR 28 HE2 TYR 28 118.639 -13.191 8.189 194 HH TYR 28 HH TYR 28 117.794 -15.072 9.177 195 H ARG 29 H ARG 29 115.268 -13.079 4.624 196 HA ARG 29 HA ARG 29 112.327 -13.285 4.692 197 HB2 ARG 29 1HB ARG 29 114.135 -14.568 2.637 198 HB3 ARG 29 2HB ARG 29 112.405 -14.868 2.803 199 HG2 ARG 29 1HG ARG 29 111.958 -12.466 2.417 200 HG3 ARG 29 2HG ARG 29 113.686 -12.186 2.205 201 HD2 ARG 29 1HD ARG 29 112.732 -12.424 0.007 202 HD3 ARG 29 2HD ARG 29 113.649 -13.889 0.344 203 HE ARG 29 HE ARG 29 110.825 -14.004 1.032 204 HH11 ARG 29 1HH1 ARG 29 113.238 -14.682 -1.427 205 HH12 ARG 29 2HH1 ARG 29 112.234 -15.839 -2.235 206 HH21 ARG 29 1HH2 ARG 29 109.579 -15.503 -0.051 207 HH22 ARG 29 2HH2 ARG 29 110.188 -16.298 -1.464 208 H TYR 30 H TYR 30 111.499 -15.063 5.662 209 HA TYR 30 HA TYR 30 113.411 -17.107 6.644 210 HB2 TYR 30 1HB TYR 30 112.670 -15.601 8.450 211 HB3 TYR 30 2HB TYR 30 111.001 -15.986 8.081 212 HD1 TYR 30 HD1 TYR 30 114.185 -17.303 9.429 213 HD2 TYR 30 HD2 TYR 30 110.000 -18.051 8.813 214 HE1 TYR 30 HE1 TYR 30 114.306 -19.242 10.969 215 HE2 TYR 30 HE2 TYR 30 110.120 -19.990 10.354 216 HH TYR 30 HH TYR 30 111.439 -21.269 11.597 217 H GLU 31 H GLU 31 112.822 -19.207 6.371 218 HA GLU 31 HA GLU 31 110.077 -19.787 5.448 219 HB2 GLU 31 1HB GLU 31 112.636 -20.782 4.173 220 HB3 GLU 31 2HB GLU 31 111.018 -21.356 3.772 221 HG2 GLU 31 1HG GLU 31 111.445 -19.710 2.141 222 HG3 GLU 31 2HG GLU 31 110.449 -18.879 3.330 223 H GLU 32 H GLU 32 109.279 -21.821 5.979 224 HA GLU 32 HA GLU 32 110.822 -23.276 8.023 225 HB2 GLU 32 1HB GLU 32 107.889 -23.412 7.290 226 HB3 GLU 32 2HB GLU 32 108.657 -24.339 8.578 227 HG2 GLU 32 1HG GLU 32 109.368 -22.206 9.647 228 HG3 GLU 32 2HG GLU 32 108.507 -21.317 8.398 229 H ASP 33 H ASP 33 111.190 -25.494 7.873 230 HA ASP 33 HA ASP 33 111.779 -26.381 5.240 231 HB2 ASP 33 1HB ASP 33 111.807 -27.854 7.877 232 HB3 ASP 33 2HB ASP 33 112.464 -28.487 6.371 233 H ASN 34 H ASN 34 109.251 -27.373 7.568 234 HA ASN 34 HA ASN 34 108.261 -29.305 5.574 235 HB2 ASN 34 1HB ASN 34 107.634 -28.990 8.510 236 HB3 ASN 34 2HB ASN 34 106.946 -30.223 7.455 237 HD21 ASN 34 1HD2 ASN 34 108.655 -30.759 9.784 238 HD22 ASN 34 2HD2 ASN 34 110.052 -31.524 9.198 239 H SER 35 H SER 35 107.448 -26.199 6.802 240 HA SER 35 HA SER 35 104.974 -26.287 5.247 241 HB2 SER 35 1HB SER 35 105.054 -25.424 8.151 242 HB3 SER 35 2HB SER 35 103.684 -25.206 7.067 243 HG SER 35 HG SER 35 103.239 -27.120 7.933 244 HA PRO 36 HA PRO 36 107.815 -22.652 4.892 245 HB2 PRO 36 1HB PRO 36 107.630 -22.267 2.185 246 HB3 PRO 36 2HB PRO 36 108.754 -23.412 2.941 247 HG2 PRO 36 1HG PRO 36 106.133 -23.923 1.638 248 HG3 PRO 36 2HG PRO 36 107.631 -24.870 1.579 249 HD2 PRO 36 1HD PRO 36 105.517 -25.560 3.163 250 HD3 PRO 36 2HD PRO 36 107.203 -25.938 3.582 251 H LEU 37 H LEU 37 107.209 -20.645 5.237 252 HA LEU 37 HA LEU 37 104.839 -19.543 3.850 253 HB2 LEU 37 1HB LEU 37 104.812 -19.958 6.483 254 HB3 LEU 37 2HB LEU 37 105.762 -18.481 6.503 255 HG LEU 37 HG LEU 37 103.422 -17.929 6.808 256 HD11 LEU 37 1HD1 LEU 37 103.804 -17.172 3.941 257 HD12 LEU 37 2HD1 LEU 37 104.994 -16.621 5.121 258 HD13 LEU 37 3HD1 LEU 37 103.297 -16.183 5.310 259 HD21 LEU 37 3HD2 LEU 37 101.674 -18.710 5.494 260 HD22 LEU 37 1HD2 LEU 37 102.757 -20.102 5.475 261 HD23 LEU 37 2HD2 LEU 37 102.714 -19.000 4.099 262 H GLY 38 H GLY 38 105.273 -17.600 2.742 263 HA2 GLY 38 1HA GLY 38 108.113 -16.860 2.709 264 HA3 GLY 38 2HA GLY 38 106.907 -16.422 1.502 265 H VAL 39 H VAL 39 108.717 -15.244 4.026 266 HA VAL 39 HA VAL 39 106.880 -12.931 4.319 267 HB VAL 39 HB VAL 39 106.977 -14.236 6.409 268 HG11 VAL 39 1HG1 VAL 39 109.280 -15.170 5.979 269 HG12 VAL 39 2HG1 VAL 39 109.043 -14.552 7.613 270 HG13 VAL 39 3HG1 VAL 39 109.937 -13.597 6.430 271 HG21 VAL 39 3HG2 VAL 39 108.578 -11.675 6.658 272 HG22 VAL 39 1HG2 VAL 39 107.530 -12.399 7.878 273 HG23 VAL 39 2HG2 VAL 39 106.832 -11.718 6.409 274 H ILE 40 H ILE 40 107.724 -11.068 3.684 275 HA ILE 40 HA ILE 40 110.677 -10.804 3.569 276 HB ILE 40 HB ILE 40 110.396 -9.387 1.590 277 HG12 ILE 40 1HG1 ILE 40 107.930 -9.795 0.523 278 HG13 ILE 40 2HG1 ILE 40 107.504 -9.798 2.229 279 HG21 ILE 40 1HG2 ILE 40 109.444 -12.222 1.620 280 HG22 ILE 40 2HG2 ILE 40 110.884 -11.521 0.883 281 HG23 ILE 40 3HG2 ILE 40 109.313 -11.315 0.114 282 HD11 ILE 40 3HD1 ILE 40 108.455 -7.578 0.515 283 HD12 ILE 40 1HD1 ILE 40 109.129 -7.610 2.144 284 HD13 ILE 40 2HD1 ILE 40 107.385 -7.543 1.914 285 H GLY 41 H GLY 41 111.471 -9.174 4.712 286 HA2 GLY 41 1HA GLY 41 109.744 -6.802 5.195 287 HA3 GLY 41 2HA GLY 41 110.909 -7.397 6.380 288 H SER 42 H SER 42 110.544 -4.917 4.436 289 HA SER 42 HA SER 42 113.383 -4.832 3.591 290 HB2 SER 42 1HB SER 42 111.719 -5.191 1.695 291 HB3 SER 42 2HB SER 42 111.116 -3.577 2.049 292 HG SER 42 HG SER 42 113.073 -2.732 1.513 293 H PHE 43 H PHE 43 114.480 -3.032 4.120 294 HA PHE 43 HA PHE 43 112.945 -0.696 5.121 295 HB2 PHE 43 1HB PHE 43 115.787 -1.550 5.712 296 HB3 PHE 43 2HB PHE 43 115.034 -0.078 6.296 297 HD1 PHE 43 HD1 PHE 43 115.199 -3.736 6.615 298 HD2 PHE 43 HD2 PHE 43 113.343 -0.142 8.064 299 HE1 PHE 43 HE1 PHE 43 114.339 -4.974 8.584 300 HE2 PHE 43 HE2 PHE 43 112.483 -1.381 10.033 301 HZ PHE 43 HZ PHE 43 112.981 -3.797 10.293 302 H THR 44 H THR 44 113.039 1.110 3.870 303 HA THR 44 HA THR 44 115.117 1.180 1.744 304 HB THR 44 HB THR 44 112.309 2.298 1.611 305 HG1 THR 44 HG1 THR 44 111.846 0.513 0.398 306 HG21 THR 44 3HG2 THR 44 112.981 2.233 -0.894 307 HG22 THR 44 1HG2 THR 44 114.635 2.117 -0.295 308 HG23 THR 44 2HG2 THR 44 113.647 3.521 0.108 309 H TYR 45 H TYR 45 116.316 2.958 1.563 310 HA TYR 45 HA TYR 45 115.508 5.381 3.072 311 HB2 TYR 45 1HB TYR 45 117.433 4.232 4.116 312 HB3 TYR 45 2HB TYR 45 118.301 4.322 2.595 313 HD1 TYR 45 HD1 TYR 45 116.967 6.260 5.443 314 HD2 TYR 45 HD2 TYR 45 119.336 6.381 1.864 315 HE1 TYR 45 HE1 TYR 45 117.829 8.494 6.090 316 HE2 TYR 45 HE2 TYR 45 120.199 8.614 2.510 317 HH TYR 45 HH TYR 45 119.184 10.165 5.558 318 H THR 46 H THR 46 115.191 7.085 1.786 319 HA THR 46 HA THR 46 116.537 7.152 -0.856 320 HB THR 46 HB THR 46 114.393 8.558 -1.443 321 HG1 THR 46 HG1 THR 46 113.388 6.802 0.531 322 HG21 THR 46 3HG2 THR 46 114.940 6.506 -2.591 323 HG22 THR 46 1HG2 THR 46 113.243 6.428 -2.120 324 HG23 THR 46 2HG2 THR 46 114.456 5.542 -1.195 325 H GLU 47 H GLU 47 117.351 9.090 -1.524 326 HA GLU 47 HA GLU 47 117.143 11.379 0.338 327 HB2 GLU 47 1HB GLU 47 119.305 10.127 0.599 328 HB3 GLU 47 2HB GLU 47 119.667 10.502 -1.085 329 HG2 GLU 47 1HG GLU 47 119.447 12.925 -0.563 330 HG3 GLU 47 2HG GLU 47 119.175 12.516 1.126 331 H LYS 48 H LYS 48 117.178 13.405 -0.607 332 HA LYS 48 HA LYS 48 116.631 13.485 -3.481 333 HB2 LYS 48 1HB LYS 48 115.147 14.681 -1.868 334 HB3 LYS 48 2HB LYS 48 116.513 15.709 -1.432 335 HG2 LYS 48 1HG LYS 48 116.690 16.517 -3.728 336 HG3 LYS 48 2HG LYS 48 115.407 15.422 -4.240 337 HD2 LYS 48 1HD LYS 48 114.417 17.599 -3.934 338 HD3 LYS 48 2HD LYS 48 113.876 16.578 -2.603 339 HE2 LYS 48 1HE LYS 48 114.590 18.838 -1.835 340 HE3 LYS 48 2HE LYS 48 115.561 17.551 -1.123 341 HZ1 LYS 48 3HZ LYS 48 116.689 19.625 -2.188 342 HZ2 LYS 48 1HZ LYS 48 116.446 18.780 -3.639 343 HZ3 LYS 48 2HZ LYS 48 117.369 18.081 -2.395 344 H SER 49 H SER 49 117.975 14.395 -4.965 345 HA SER 49 HA SER 49 120.552 15.475 -3.971 346 HB2 SER 49 1HB SER 49 121.530 14.698 -6.064 347 HB3 SER 49 2HB SER 49 120.718 13.361 -5.255 348 HG SER 49 HG SER 49 119.886 13.236 -7.232 349 H ARG 50 H ARG 50 121.318 17.382 -4.781 350 HA ARG 50 HA ARG 50 119.755 18.762 -6.853 351 HB2 ARG 50 1HB ARG 50 118.898 19.497 -4.636 352 HB3 ARG 50 2HB ARG 50 120.526 20.013 -4.203 353 HG2 ARG 50 1HG ARG 50 119.448 21.983 -4.964 354 HG3 ARG 50 2HG ARG 50 120.448 21.473 -6.321 355 HD2 ARG 50 1HD ARG 50 118.471 20.345 -7.323 356 HD3 ARG 50 2HD ARG 50 117.485 20.929 -5.986 357 HE ARG 50 HE ARG 50 118.683 23.178 -7.037 358 HH11 ARG 50 1HH1 ARG 50 116.584 20.674 -8.320 359 HH12 ARG 50 2HH1 ARG 50 115.879 21.729 -9.497 360 HH21 ARG 50 1HH2 ARG 50 117.739 24.490 -8.573 361 HH22 ARG 50 2HH2 ARG 50 116.525 23.862 -9.638 362 H THR 51 H THR 51 120.969 20.086 -8.168 363 HA THR 51 HA THR 51 123.796 19.685 -8.194 364 HB THR 51 HB THR 51 122.173 21.736 -9.721 365 HG1 THR 51 HG1 THR 51 122.484 19.940 -11.341 366 HG21 THR 51 3HG2 THR 51 124.407 22.312 -10.061 367 HG22 THR 51 1HG2 THR 51 124.136 21.169 -11.376 368 HG23 THR 51 2HG2 THR 51 124.965 20.647 -9.909 369 H ALA 52 H ALA 52 125.418 20.936 -7.435 370 HA ALA 52 HA ALA 52 124.706 23.069 -5.592 371 HB1 ALA 52 1HB ALA 52 126.375 21.514 -4.834 372 HB2 ALA 52 2HB ALA 52 127.176 23.060 -5.115 373 HB3 ALA 52 3HB ALA 52 127.339 21.757 -6.292 374 H SER 53 H SER 53 125.017 25.201 -5.889 375 HA SER 53 HA SER 53 126.864 26.303 -7.764 376 HB2 SER 53 1HB SER 53 123.994 26.013 -8.571 377 HB3 SER 53 2HB SER 53 124.879 27.454 -9.059 378 HG SER 53 HG SER 53 126.534 25.887 -9.793 379 H SER 54 H SER 54 123.601 27.233 -6.655 380 HA SER 54 HA SER 54 124.324 29.861 -5.926 381 HB2 SER 54 1HB SER 54 122.155 29.975 -4.859 382 HB3 SER 54 2HB SER 54 122.002 29.086 -6.369 383 HG SER 54 HG SER 54 121.816 28.224 -3.729 384 H GLY 55 H GLY 55 124.496 26.833 -4.150 385 HA2 GLY 55 1HA GLY 55 125.991 26.576 -2.302 386 HA3 GLY 55 2HA GLY 55 125.779 28.278 -1.930 387 H ASP 56 H ASP 56 122.704 27.230 -2.524 388 HA ASP 56 HA ASP 56 122.052 27.107 0.280 389 HB2 ASP 56 1HB ASP 56 119.741 26.910 -0.482 390 HB3 ASP 56 2HB ASP 56 120.561 28.201 -1.355 391 H TYR 57 H TYR 57 121.501 25.351 1.489 392 HA TYR 57 HA TYR 57 121.783 22.695 0.200 393 HB2 TYR 57 1HB TYR 57 123.586 23.260 1.792 394 HB3 TYR 57 2HB TYR 57 122.387 23.498 3.048 395 HD1 TYR 57 HD1 TYR 57 124.033 21.003 0.867 396 HD2 TYR 57 HD2 TYR 57 121.371 21.629 4.181 397 HE1 TYR 57 HE1 TYR 57 124.155 18.589 1.422 398 HE2 TYR 57 HE2 TYR 57 121.495 19.215 4.735 399 HH TYR 57 HH TYR 57 123.440 17.308 4.212 400 H ASN 58 H ASN 58 120.057 21.425 0.239 401 HA ASN 58 HA ASN 58 117.892 22.002 2.180 402 HB2 ASN 58 1HB ASN 58 117.716 20.697 -0.547 403 HB3 ASN 58 2HB ASN 58 116.364 20.998 0.543 404 HD21 ASN 58 1HD2 ASN 58 116.942 23.608 1.439 405 HD22 ASN 58 2HD2 ASN 58 116.902 24.674 0.118 406 H LYS 59 H LYS 59 117.347 20.437 3.585 407 HA LYS 59 HA LYS 59 118.643 17.795 3.271 408 HB2 LYS 59 1HB LYS 59 119.250 19.148 5.282 409 HB3 LYS 59 2HB LYS 59 117.562 19.089 5.784 410 HG2 LYS 59 1HG LYS 59 118.608 17.310 6.957 411 HG3 LYS 59 2HG LYS 59 117.770 16.533 5.614 412 HD2 LYS 59 1HD LYS 59 119.842 16.439 4.325 413 HD3 LYS 59 2HD LYS 59 120.699 17.317 5.593 414 HE2 LYS 59 1HE LYS 59 120.673 15.506 7.055 415 HE3 LYS 59 2HE LYS 59 119.255 14.782 6.296 416 HZ1 LYS 59 3HZ LYS 59 120.491 13.890 4.613 417 HZ2 LYS 59 1HZ LYS 59 121.621 13.813 5.876 418 HZ3 LYS 59 2HZ LYS 59 121.718 15.059 4.727 419 H ASN 60 H ASN 60 117.216 16.484 2.276 420 HA ASN 60 HA ASN 60 114.534 16.206 3.502 421 HB2 ASN 60 1HB ASN 60 114.541 17.308 1.209 422 HB3 ASN 60 2HB ASN 60 115.125 15.774 0.573 423 HD21 ASN 60 1HD2 ASN 60 112.682 16.624 -0.382 424 HD22 ASN 60 2HD2 ASN 60 111.424 15.708 0.295 425 H GLN 61 H GLN 61 114.090 14.195 4.204 426 HA GLN 61 HA GLN 61 115.536 11.921 2.982 427 HB2 GLN 61 1HB GLN 61 115.243 12.458 5.945 428 HB3 GLN 61 2HB GLN 61 115.792 10.929 5.259 429 HG2 GLN 61 1HG GLN 61 117.680 12.055 4.185 430 HG3 GLN 61 2HG GLN 61 117.119 13.614 4.787 431 HE21 GLN 61 1HE2 GLN 61 119.716 12.496 5.440 432 HE22 GLN 61 2HE2 GLN 61 119.736 12.199 7.112 433 H TYR 62 H TYR 62 114.375 10.049 2.799 434 HA TYR 62 HA TYR 62 111.685 9.967 4.032 435 HB2 TYR 62 1HB TYR 62 112.498 9.476 1.194 436 HB3 TYR 62 2HB TYR 62 111.118 8.630 1.864 437 HD1 TYR 62 HD1 TYR 62 112.519 12.102 1.586 438 HD2 TYR 62 HD2 TYR 62 109.022 9.607 1.638 439 HE1 TYR 62 HE1 TYR 62 111.104 14.074 1.077 440 HE2 TYR 62 HE2 TYR 62 107.607 11.580 1.132 441 HH TYR 62 HH TYR 62 108.233 14.011 -0.138 442 H TYR 63 H TYR 63 111.143 8.061 4.968 443 HA TYR 63 HA TYR 63 112.949 5.740 4.563 444 HB2 TYR 63 1HB TYR 63 111.536 6.491 7.126 445 HB3 TYR 63 2HB TYR 63 112.662 5.169 6.894 446 HD1 TYR 63 HD1 TYR 63 115.084 5.611 6.649 447 HD2 TYR 63 HD2 TYR 63 112.273 8.768 7.411 448 HE1 TYR 63 HE1 TYR 63 116.947 7.113 7.300 449 HE2 TYR 63 HE2 TYR 63 114.136 10.270 8.062 450 HH TYR 63 HH TYR 63 117.076 9.291 8.904 451 H GLY 64 H GLY 64 111.917 3.745 4.280 452 HA2 GLY 64 1HA GLY 64 108.952 3.762 4.453 453 HA3 GLY 64 2HA GLY 64 109.783 3.150 3.027 454 H ILE 65 H ILE 65 108.107 2.081 5.495 455 HA ILE 65 HA ILE 65 109.773 -0.346 5.885 456 HB ILE 65 HB ILE 65 107.562 0.670 7.684 457 HG12 ILE 65 1HG1 ILE 65 109.483 2.197 7.795 458 HG13 ILE 65 2HG1 ILE 65 109.365 1.252 9.274 459 HG21 ILE 65 1HG2 ILE 65 107.835 -1.733 7.791 460 HG22 ILE 65 2HG2 ILE 65 108.533 -1.026 9.248 461 HG23 ILE 65 3HG2 ILE 65 109.585 -1.568 7.939 462 HD11 ILE 65 3HD1 ILE 65 111.108 -0.294 8.404 463 HD12 ILE 65 1HD1 ILE 65 111.695 1.362 8.522 464 HD13 ILE 65 2HD1 ILE 65 111.242 0.700 6.953 465 H THR 66 H THR 66 108.955 -2.190 5.027 466 HA THR 66 HA THR 66 106.064 -2.341 4.509 467 HB THR 66 HB THR 66 107.114 -1.474 2.457 468 HG1 THR 66 HG1 THR 66 106.303 -4.175 2.215 469 HG21 THR 66 3HG2 THR 66 108.682 -4.064 2.561 470 HG22 THR 66 1HG2 THR 66 109.342 -2.433 2.671 471 HG23 THR 66 2HG2 THR 66 108.613 -2.988 1.165 472 H ALA 67 H ALA 67 105.288 -4.467 4.040 473 HA ALA 67 HA ALA 67 107.080 -6.724 4.534 474 HB1 ALA 67 1HB ALA 67 106.219 -6.080 6.779 475 HB2 ALA 67 2HB ALA 67 105.649 -7.671 6.274 476 HB3 ALA 67 3HB ALA 67 104.573 -6.277 6.179 477 H GLY 68 H GLY 68 106.231 -8.701 3.698 478 HA2 GLY 68 1HA GLY 68 103.628 -8.573 2.369 479 HA3 GLY 68 2HA GLY 68 105.035 -8.753 1.345 480 HA PRO 69 HA PRO 69 104.122 -13.072 3.071 481 HB2 PRO 69 1HB PRO 69 101.637 -13.552 1.634 482 HB3 PRO 69 2HB PRO 69 101.983 -13.755 3.357 483 HG2 PRO 69 1HG PRO 69 100.328 -11.853 2.337 484 HG3 PRO 69 2HG PRO 69 101.172 -11.719 3.889 485 HD2 PRO 69 1HD PRO 69 101.858 -10.451 1.262 486 HD3 PRO 69 2HD PRO 69 102.016 -9.798 2.910 487 H ALA 70 H ALA 70 104.386 -15.018 1.596 488 HA ALA 70 HA ALA 70 104.427 -14.343 -1.268 489 HB1 ALA 70 1HB ALA 70 106.650 -14.486 -1.525 490 HB2 ALA 70 2HB ALA 70 106.773 -15.928 -0.525 491 HB3 ALA 70 3HB ALA 70 106.765 -14.332 0.224 492 H TYR 71 H TYR 71 104.292 -16.147 -2.666 493 HA TYR 71 HA TYR 71 103.437 -18.656 -1.339 494 HB2 TYR 71 1HB TYR 71 102.272 -17.367 -3.810 495 HB3 TYR 71 2HB TYR 71 101.818 -18.936 -3.174 496 HD1 TYR 71 HD1 TYR 71 100.707 -19.072 -0.907 497 HD2 TYR 71 HD2 TYR 71 101.355 -15.352 -2.955 498 HE1 TYR 71 HE1 TYR 71 99.018 -17.980 0.544 499 HE2 TYR 71 HE2 TYR 71 99.666 -14.260 -1.504 500 HH TYR 71 HH TYR 71 97.442 -15.848 0.244 501 H ARG 72 H ARG 72 104.492 -20.426 -1.999 502 HA ARG 72 HA ARG 72 106.053 -20.278 -4.517 503 HB2 ARG 72 1HB ARG 72 107.398 -20.511 -2.433 504 HB3 ARG 72 2HB ARG 72 106.552 -22.020 -2.091 505 HG2 ARG 72 1HG ARG 72 107.380 -23.006 -4.152 506 HG3 ARG 72 2HG ARG 72 108.139 -21.483 -4.617 507 HD2 ARG 72 1HD ARG 72 109.863 -22.877 -3.678 508 HD3 ARG 72 2HD ARG 72 109.505 -21.620 -2.498 509 HE ARG 72 HE ARG 72 107.913 -23.944 -2.036 510 HH11 ARG 72 1HH1 ARG 72 111.166 -22.707 -1.571 511 HH12 ARG 72 2HH1 ARG 72 111.474 -23.743 -0.219 512 HH21 ARG 72 1HH2 ARG 72 108.369 -25.255 -0.290 513 HH22 ARG 72 2HH2 ARG 72 109.910 -25.168 0.496 514 H ILE 73 H ILE 73 104.864 -21.233 -6.053 515 HA ILE 73 HA ILE 73 103.026 -23.359 -5.575 516 HB ILE 73 HB ILE 73 104.272 -22.469 -8.190 517 HG12 ILE 73 1HG1 ILE 73 101.631 -21.668 -6.931 518 HG13 ILE 73 2HG1 ILE 73 103.082 -20.668 -6.894 519 HG21 ILE 73 1HG2 ILE 73 103.173 -24.699 -8.262 520 HG22 ILE 73 2HG2 ILE 73 102.288 -23.499 -9.205 521 HG23 ILE 73 3HG2 ILE 73 101.702 -23.977 -7.611 522 HD11 ILE 73 3HD1 ILE 73 101.418 -21.472 -9.273 523 HD12 ILE 73 1HD1 ILE 73 103.095 -20.962 -9.472 524 HD13 ILE 73 2HD1 ILE 73 101.913 -19.856 -8.770 525 H ASN 74 H ASN 74 106.274 -23.268 -7.049 526 HA ASN 74 HA ASN 74 106.568 -26.135 -6.426 527 HB2 ASN 74 1HB ASN 74 107.212 -24.804 -9.069 528 HB3 ASN 74 2HB ASN 74 107.665 -26.451 -8.636 529 HD21 ASN 74 1HD2 ASN 74 105.866 -25.731 -10.838 530 HD22 ASN 74 2HD2 ASN 74 104.354 -26.414 -10.479 531 H ASP 75 H ASP 75 109.061 -26.608 -7.287 532 HA ASP 75 HA ASP 75 110.730 -25.662 -5.316 533 HB2 ASP 75 1HB ASP 75 111.189 -27.587 -6.834 534 HB3 ASP 75 2HB ASP 75 111.613 -26.437 -8.101 535 H TRP 76 H TRP 76 109.991 -24.135 -8.396 536 HA TRP 76 HA TRP 76 111.631 -21.811 -7.576 537 HB2 TRP 76 1HB TRP 76 112.229 -21.444 -9.906 538 HB3 TRP 76 2HB TRP 76 112.777 -23.020 -9.367 539 HD1 TRP 76 HD1 TRP 76 111.318 -25.156 -10.228 540 HE1 TRP 76 HE1 TRP 76 110.011 -25.478 -12.425 541 HE3 TRP 76 HE3 TRP 76 110.858 -20.288 -11.698 542 HZ2 TRP 76 HZ2 TRP 76 108.913 -23.878 -14.533 543 HZ3 TRP 76 HZ3 TRP 76 109.682 -19.716 -13.798 544 HH2 TRP 76 HH2 TRP 76 108.709 -21.500 -15.217 545 H ALA 77 H ALA 77 110.994 -19.891 -9.113 546 HA ALA 77 HA ALA 77 109.421 -18.330 -9.672 547 HB1 ALA 77 1HB ALA 77 108.559 -19.455 -11.462 548 HB2 ALA 77 2HB ALA 77 107.127 -19.492 -10.435 549 HB3 ALA 77 3HB ALA 77 108.188 -20.898 -10.523 550 H SER 78 H SER 78 109.220 -17.452 -7.627 551 HA SER 78 HA SER 78 106.728 -18.181 -6.198 552 HB2 SER 78 1HB SER 78 107.795 -17.489 -4.116 553 HB3 SER 78 2HB SER 78 108.763 -18.742 -4.885 554 HG SER 78 HG SER 78 109.184 -15.936 -4.849 555 H ILE 79 H ILE 79 105.544 -16.385 -5.291 556 HA ILE 79 HA ILE 79 106.274 -13.759 -6.465 557 HB ILE 79 HB ILE 79 103.909 -13.378 -7.003 558 HG12 ILE 79 1HG1 ILE 79 103.504 -16.292 -6.255 559 HG13 ILE 79 2HG1 ILE 79 103.004 -14.935 -5.244 560 HG21 ILE 79 1HG2 ILE 79 104.921 -15.990 -8.164 561 HG22 ILE 79 2HG2 ILE 79 105.464 -14.392 -8.676 562 HG23 ILE 79 3HG2 ILE 79 103.786 -14.875 -8.922 563 HD11 ILE 79 3HD1 ILE 79 101.066 -15.527 -6.497 564 HD12 ILE 79 1HD1 ILE 79 101.989 -15.677 -7.993 565 HD13 ILE 79 2HD1 ILE 79 101.709 -14.086 -7.285 566 H TYR 80 H TYR 80 105.552 -11.922 -5.282 567 HA TYR 80 HA TYR 80 104.300 -12.451 -2.679 568 HB2 TYR 80 1HB TYR 80 106.001 -11.337 -1.435 569 HB3 TYR 80 2HB TYR 80 106.767 -12.586 -2.394 570 HD1 TYR 80 HD1 TYR 80 108.055 -11.941 -4.466 571 HD2 TYR 80 HD2 TYR 80 106.566 -9.047 -1.665 572 HE1 TYR 80 HE1 TYR 80 109.615 -10.246 -5.387 573 HE2 TYR 80 HE2 TYR 80 108.123 -7.350 -2.587 574 HH TYR 80 HH TYR 80 110.190 -8.086 -5.386 575 H GLY 81 H GLY 81 103.509 -10.547 -1.623 576 HA2 GLY 81 1HA GLY 81 103.314 -8.140 -3.347 577 HA3 GLY 81 2HA GLY 81 101.873 -8.813 -2.581 578 H VAL 82 H VAL 82 103.148 -6.147 -2.154 579 HA VAL 82 HA VAL 82 103.855 -6.410 0.704 580 HB VAL 82 HB VAL 82 105.726 -4.844 0.371 581 HG11 VAL 82 1HG1 VAL 82 106.097 -7.300 0.274 582 HG12 VAL 82 2HG1 VAL 82 107.234 -6.420 -0.745 583 HG13 VAL 82 3HG1 VAL 82 105.856 -7.248 -1.472 584 HG21 VAL 82 3HG2 VAL 82 104.987 -3.645 -1.603 585 HG22 VAL 82 1HG2 VAL 82 104.957 -5.133 -2.550 586 HG23 VAL 82 2HG2 VAL 82 106.496 -4.465 -2.005 587 H VAL 83 H VAL 83 103.323 -4.726 1.996 588 HA VAL 83 HA VAL 83 102.367 -2.232 0.744 589 HB VAL 83 HB VAL 83 100.591 -2.067 2.450 590 HG11 VAL 83 1HG1 VAL 83 100.221 -4.773 1.199 591 HG12 VAL 83 2HG1 VAL 83 100.407 -3.365 0.156 592 HG13 VAL 83 3HG1 VAL 83 99.082 -3.432 1.317 593 HG21 VAL 83 3HG2 VAL 83 101.357 -4.915 3.172 594 HG22 VAL 83 1HG2 VAL 83 100.064 -3.957 3.896 595 HG23 VAL 83 2HG2 VAL 83 101.749 -3.504 4.155 596 H GLY 84 H GLY 84 102.772 -0.341 2.078 597 HA2 GLY 84 1HA GLY 84 104.042 -0.632 4.648 598 HA3 GLY 84 2HA GLY 84 105.193 -0.252 3.375 599 H VAL 85 H VAL 85 105.292 1.549 5.122 600 HA VAL 85 HA VAL 85 103.581 3.791 4.219 601 HB VAL 85 HB VAL 85 104.518 3.307 7.063 602 HG11 VAL 85 1HG1 VAL 85 104.349 5.664 6.627 603 HG12 VAL 85 2HG1 VAL 85 102.882 5.204 7.490 604 HG13 VAL 85 3HG1 VAL 85 102.836 5.454 5.746 605 HG21 VAL 85 3HG2 VAL 85 102.765 1.744 6.667 606 HG22 VAL 85 1HG2 VAL 85 101.860 2.892 5.680 607 HG23 VAL 85 2HG2 VAL 85 101.974 3.127 7.423 608 H GLY 86 H GLY 86 104.653 5.659 3.803 609 HA2 GLY 86 1HA GLY 86 107.581 5.685 4.297 610 HA3 GLY 86 2HA GLY 86 106.843 6.318 2.828 611 H TYR 87 H TYR 87 108.374 7.438 5.324 612 HA TYR 87 HA TYR 87 106.583 9.771 5.714 613 HB2 TYR 87 1HB TYR 87 108.568 8.608 7.676 614 HB3 TYR 87 2HB TYR 87 107.602 10.050 7.928 615 HD1 TYR 87 HD1 TYR 87 105.092 9.839 8.104 616 HD2 TYR 87 HD2 TYR 87 107.709 6.433 8.078 617 HE1 TYR 87 HE1 TYR 87 103.278 8.438 9.051 618 HE2 TYR 87 HE2 TYR 87 105.895 5.031 9.025 619 HH TYR 87 HH TYR 87 102.841 6.445 10.077 620 H GLY 88 H GLY 88 107.500 11.761 5.394 621 HA2 GLY 88 1HA GLY 88 110.394 11.853 4.784 622 HA3 GLY 88 2HA GLY 88 109.220 12.519 3.656 623 H LYS 89 H LYS 89 111.428 13.758 5.205 624 HA LYS 89 HA LYS 89 109.855 16.005 6.276 625 HB2 LYS 89 1HB LYS 89 110.643 14.616 8.190 626 HB3 LYS 89 2HB LYS 89 112.303 14.856 7.641 627 HG2 LYS 89 1HG LYS 89 112.087 17.272 7.922 628 HG3 LYS 89 2HG LYS 89 110.391 17.092 8.374 629 HD2 LYS 89 1HD LYS 89 111.673 17.325 10.409 630 HD3 LYS 89 2HD LYS 89 111.135 15.649 10.299 631 HE2 LYS 89 1HE LYS 89 113.286 14.907 9.563 632 HE3 LYS 89 2HE LYS 89 113.837 16.560 9.290 633 HZ1 LYS 89 3HZ LYS 89 113.234 15.275 11.894 634 HZ2 LYS 89 1HZ LYS 89 113.518 16.937 11.713 635 HZ3 LYS 89 2HZ LYS 89 114.742 15.822 11.338 636 H PHE 90 H PHE 90 110.605 17.955 5.640 637 HA PHE 90 HA PHE 90 113.329 18.135 4.514 638 HB2 PHE 90 1HB PHE 90 112.477 19.532 2.697 639 HB3 PHE 90 2HB PHE 90 111.774 17.926 2.647 640 HD1 PHE 90 HD1 PHE 90 111.150 21.494 3.261 641 HD2 PHE 90 HD2 PHE 90 109.404 17.574 3.142 642 HE1 PHE 90 HE1 PHE 90 108.885 22.504 3.261 643 HE2 PHE 90 HE2 PHE 90 107.138 18.582 3.144 644 HZ PHE 90 HZ PHE 90 106.879 21.048 3.203 645 H GLN 91 H GLN 91 114.199 20.326 4.524 646 HA GLN 91 HA GLN 91 113.079 21.878 6.780 647 HB2 GLN 91 1HB GLN 91 115.379 20.952 7.034 648 HB3 GLN 91 2HB GLN 91 115.887 21.934 5.660 649 HG2 GLN 91 1HG GLN 91 115.222 23.976 6.846 650 HG3 GLN 91 2HG GLN 91 114.655 23.018 8.209 651 HE21 GLN 91 1HE2 GLN 91 116.569 24.893 8.804 652 HE22 GLN 91 2HE2 GLN 91 118.075 24.158 9.073 653 H THR 92 H THR 92 112.016 23.629 6.254 654 HA THR 92 HA THR 92 113.236 25.543 4.402 655 HB THR 92 HB THR 92 111.002 26.056 3.415 656 HG1 THR 92 HG1 THR 92 109.810 25.073 5.132 657 HG21 THR 92 3HG2 THR 92 112.552 24.649 2.167 658 HG22 THR 92 1HG2 THR 92 110.911 24.040 1.952 659 HG23 THR 92 2HG2 THR 92 112.016 23.223 3.054 660 H THR 93 H THR 93 112.075 27.749 4.671 661 HA THR 93 HA THR 93 111.420 28.099 7.526 662 HB THR 93 HB THR 93 111.783 30.489 7.111 663 HG1 THR 93 HG1 THR 93 112.493 31.096 5.016 664 HG21 THR 93 3HG2 THR 93 113.728 29.062 7.639 665 HG22 THR 93 1HG2 THR 93 114.182 30.381 6.560 666 HG23 THR 93 2HG2 THR 93 113.965 28.752 5.919 667 H GLU 94 H GLU 94 109.416 28.374 8.153 668 HA GLU 94 HA GLU 94 107.394 29.885 7.004 669 HB2 GLU 94 1HB GLU 94 105.899 28.099 6.102 670 HB3 GLU 94 2HB GLU 94 107.334 28.343 5.113 671 HG2 GLU 94 1HG GLU 94 108.424 26.441 6.328 672 HG3 GLU 94 2HG GLU 94 106.908 26.161 7.174 673 H TYR 95 H TYR 95 105.541 29.880 8.364 674 HA TYR 95 HA TYR 95 105.758 28.335 10.790 675 HB2 TYR 95 1HB TYR 95 103.676 29.426 11.454 676 HB3 TYR 95 2HB TYR 95 104.865 30.583 10.901 677 HD1 TYR 95 HD1 TYR 95 104.589 31.652 8.634 678 HD2 TYR 95 HD2 TYR 95 101.562 29.172 10.403 679 HE1 TYR 95 HE1 TYR 95 102.909 32.582 7.065 680 HE2 TYR 95 HE2 TYR 95 99.882 30.099 8.833 681 HH TYR 95 HH TYR 95 100.791 32.085 6.135 682 HA PRO 96 HA PRO 96 103.737 25.070 8.435 683 HB2 PRO 96 1HB PRO 96 103.751 23.044 10.231 684 HB3 PRO 96 2HB PRO 96 105.224 23.599 9.408 685 HG2 PRO 96 1HG PRO 96 104.274 24.168 12.165 686 HG3 PRO 96 2HG PRO 96 105.917 23.860 11.575 687 HD2 PRO 96 1HD PRO 96 104.928 26.379 12.110 688 HD3 PRO 96 2HD PRO 96 106.260 26.050 10.983 689 H THR 97 H THR 97 101.622 24.775 8.006 690 HA THR 97 HA THR 97 99.780 24.342 10.292 691 HB THR 97 HB THR 97 99.066 25.234 7.484 692 HG1 THR 97 HG1 THR 97 99.226 27.203 8.199 693 HG21 THR 97 3HG2 THR 97 97.346 23.920 8.742 694 HG22 THR 97 1HG2 THR 97 96.848 25.580 8.414 695 HG23 THR 97 2HG2 THR 97 97.415 25.131 10.022 696 H TYR 98 H TYR 98 99.232 22.244 10.517 697 HA TYR 98 HA TYR 98 98.534 20.652 8.217 698 HB2 TYR 98 1HB TYR 98 101.122 20.607 8.519 699 HB3 TYR 98 2HB TYR 98 100.771 19.538 9.864 700 HD1 TYR 98 HD1 TYR 98 100.358 19.989 6.196 701 HD2 TYR 98 HD2 TYR 98 100.206 17.257 9.503 702 HE1 TYR 98 HE1 TYR 98 100.171 18.087 4.615 703 HE2 TYR 98 HE2 TYR 98 100.017 15.352 7.924 704 HH TYR 98 HH TYR 98 99.433 14.863 5.700 705 H LYS 99 H LYS 99 97.738 18.502 8.826 706 HA LYS 99 HA LYS 99 96.594 18.537 11.537 707 HB2 LYS 99 1HB LYS 99 94.895 17.049 10.688 708 HB3 LYS 99 2HB LYS 99 95.044 18.422 9.598 709 HG2 LYS 99 1HG LYS 99 96.521 17.031 8.129 710 HG3 LYS 99 2HG LYS 99 96.213 15.652 9.186 711 HD2 LYS 99 1HD LYS 99 93.729 16.054 8.775 712 HD3 LYS 99 2HD LYS 99 94.215 17.168 7.496 713 HE2 LYS 99 1HE LYS 99 93.960 15.156 6.325 714 HE3 LYS 99 2HE LYS 99 95.690 15.174 6.667 715 HZ1 LYS 99 3HZ LYS 99 95.204 13.125 7.447 716 HZ2 LYS 99 1HZ LYS 99 93.588 13.503 7.799 717 HZ3 LYS 99 2HZ LYS 99 94.824 13.996 8.856 718 H HIS 100 H HIS 100 96.520 16.611 12.788 719 HA HIS 100 HA HIS 100 97.379 14.752 13.769 720 HB2 HIS 100 1HB HIS 100 96.796 13.696 11.609 721 HB3 HIS 100 2HB HIS 100 98.406 14.050 11.018 722 HD1 HIS 100 HD1 HIS 100 96.864 12.243 14.011 723 HD2 HIS 100 HD2 HIS 100 100.111 11.931 11.413 724 HE1 HIS 100 HE1 HIS 100 98.082 10.115 14.641 725 H ASP 101 H ASP 101 100.037 15.033 11.385 726 HA ASP 101 HA ASP 101 101.770 16.038 13.540 727 HB2 ASP 101 1HB ASP 101 103.480 14.349 12.985 728 HB3 ASP 101 2HB ASP 101 102.008 13.624 13.617 729 H THR 102 H THR 102 103.790 16.913 12.804 730 HA THR 102 HA THR 102 103.479 18.633 10.602 731 HB THR 102 HB THR 102 106.069 17.833 11.943 732 HG1 THR 102 HG1 THR 102 105.563 19.255 13.477 733 HG21 THR 102 3HG2 THR 102 105.208 20.330 10.454 734 HG22 THR 102 1HG2 THR 102 106.352 19.121 9.871 735 HG23 THR 102 2HG2 THR 102 106.757 20.115 11.271 736 H SER 103 H SER 103 105.199 15.550 10.919 737 HA SER 103 HA SER 103 106.532 15.689 8.414 738 HB2 SER 103 1HB SER 103 105.764 13.256 10.045 739 HB3 SER 103 2HB SER 103 106.934 13.288 8.730 740 HG SER 103 HG SER 103 108.239 14.599 9.947 741 H ASP 104 H ASP 104 106.095 14.440 6.496 742 HA ASP 104 HA ASP 104 103.193 14.186 5.990 743 HB2 ASP 104 1HB ASP 104 105.524 14.439 4.073 744 HB3 ASP 104 2HB ASP 104 103.836 14.275 3.596 745 H TYR 105 H TYR 105 102.333 12.266 5.162 746 HA TYR 105 HA TYR 105 104.184 9.981 4.921 747 HB2 TYR 105 1HB TYR 105 102.825 8.600 6.317 748 HB3 TYR 105 2HB TYR 105 103.241 10.048 7.210 749 HD1 TYR 105 HD2 TYR 105 101.534 11.709 7.780 750 HD2 TYR 105 HD1 TYR 105 100.544 8.148 5.592 751 HE1 TYR 105 HE2 TYR 105 99.127 12.100 8.233 752 HE2 TYR 105 HE1 TYR 105 98.137 8.538 6.044 753 HH TYR 105 HH TYR 105 96.937 11.472 7.192 754 H GLY 106 H GLY 106 103.422 8.217 3.706 755 HA2 GLY 106 1HA GLY 106 100.847 8.474 2.331 756 HA3 GLY 106 2HA GLY 106 102.294 8.459 1.327 757 H PHE 107 H PHE 107 100.570 6.503 0.820 758 HA PHE 107 HA PHE 107 101.530 4.110 2.296 759 HB2 PHE 107 1HB PHE 107 98.929 4.545 0.822 760 HB3 PHE 107 2HB PHE 107 99.432 3.032 1.551 761 HD1 PHE 107 HD1 PHE 107 98.218 6.445 2.172 762 HD2 PHE 107 HD2 PHE 107 99.440 2.745 3.981 763 HE1 PHE 107 HE1 PHE 107 97.221 7.168 4.325 764 HE2 PHE 107 HE2 PHE 107 98.444 3.468 6.134 765 HZ PHE 107 HZ PHE 107 97.334 5.680 6.306 766 H SER 108 H SER 108 102.231 2.313 1.119 767 HA SER 108 HA SER 108 102.418 2.671 -1.819 768 HB2 SER 108 1HB SER 108 104.573 1.607 0.019 769 HB3 SER 108 2HB SER 108 104.667 1.700 -1.736 770 HG SER 108 HG SER 108 105.303 3.556 -0.004 771 H TYR 109 H TYR 109 102.133 0.897 -3.061 772 HA TYR 109 HA TYR 109 101.815 -1.742 -1.774 773 HB2 TYR 109 1HB TYR 109 99.942 -0.550 -3.829 774 HB3 TYR 109 2HB TYR 109 99.834 -2.162 -3.149 775 HD1 TYR 109 HD2 TYR 109 99.304 1.427 -2.557 776 HD2 TYR 109 HD1 TYR 109 99.004 -2.513 -0.876 777 HE1 TYR 109 HE2 TYR 109 97.881 2.315 -0.731 778 HE2 TYR 109 HE1 TYR 109 97.588 -1.625 0.955 779 HH TYR 109 HH TYR 109 96.031 1.212 0.859 780 H GLY 110 H GLY 110 102.533 -3.483 -3.094 781 HA2 GLY 110 1HA GLY 110 102.877 -3.174 -5.927 782 HA3 GLY 110 2HA GLY 110 104.412 -3.059 -5.079 783 H ALA 111 H ALA 111 104.440 -5.006 -6.748 784 HA ALA 111 HA ALA 111 104.394 -7.403 -5.079 785 HB1 ALA 111 1HB ALA 111 103.116 -7.432 -7.821 786 HB2 ALA 111 2HB ALA 111 102.189 -7.301 -6.326 787 HB3 ALA 111 3HB ALA 111 103.159 -8.740 -6.640 788 H GLY 112 H GLY 112 105.717 -9.150 -6.027 789 HA2 GLY 112 1HA GLY 112 107.471 -8.334 -8.225 790 HA3 GLY 112 2HA GLY 112 108.229 -8.556 -6.654 791 H LEU 113 H LEU 113 108.883 -10.023 -8.959 792 HA LEU 113 HA LEU 113 108.045 -12.750 -8.158 793 HB2 LEU 113 1HB LEU 113 108.721 -11.766 -10.943 794 HB3 LEU 113 2HB LEU 113 108.361 -13.435 -10.504 795 HG LEU 113 HG LEU 113 106.162 -12.361 -9.487 796 HD11 LEU 113 1HD1 LEU 113 106.435 -10.067 -9.816 797 HD12 LEU 113 2HD1 LEU 113 105.503 -10.511 -11.243 798 HD13 LEU 113 3HD1 LEU 113 107.247 -10.283 -11.366 799 HD21 LEU 113 3HD2 LEU 113 106.098 -14.011 -11.255 800 HD22 LEU 113 1HD2 LEU 113 106.687 -12.840 -12.435 801 HD23 LEU 113 2HD2 LEU 113 105.073 -12.662 -11.747 802 H GLN 114 H GLN 114 109.661 -14.317 -8.098 803 HA GLN 114 HA GLN 114 112.429 -13.270 -8.175 804 HB2 GLN 114 1HB GLN 114 111.599 -14.065 -5.966 805 HB3 GLN 114 2HB GLN 114 111.345 -15.663 -6.670 806 HG2 GLN 114 1HG GLN 114 113.731 -15.824 -7.216 807 HG3 GLN 114 2HG GLN 114 114.003 -14.207 -6.573 808 HE21 GLN 114 1HE2 GLN 114 115.496 -16.205 -5.418 809 HE22 GLN 114 2HE2 GLN 114 114.907 -16.582 -3.871 810 H PHE 115 H PHE 115 113.866 -14.160 -9.555 811 HA PHE 115 HA PHE 115 113.080 -16.643 -10.977 812 HB2 PHE 115 1HB PHE 115 112.902 -14.549 -12.353 813 HB3 PHE 115 2HB PHE 115 114.626 -14.324 -12.134 814 HD1 PHE 115 HD1 PHE 115 112.063 -16.650 -13.509 815 HD2 PHE 115 HD2 PHE 115 116.185 -15.442 -13.528 816 HE1 PHE 115 HE1 PHE 115 112.481 -18.109 -15.470 817 HE2 PHE 115 HE2 PHE 115 116.603 -16.902 -15.489 818 HZ PHE 115 HZ PHE 115 114.752 -18.235 -16.460 819 H ASN 116 H ASN 116 114.647 -18.176 -11.236 820 HA ASN 116 HA ASN 116 117.294 -17.603 -10.030 821 HB2 ASN 116 1HB ASN 116 115.498 -20.005 -9.717 822 HB3 ASN 116 2HB ASN 116 117.218 -20.051 -9.331 823 HD21 ASN 116 1HD2 ASN 116 114.269 -18.111 -8.581 824 HD22 ASN 116 2HD2 ASN 116 114.738 -17.753 -6.989 825 HA PRO 117 HA PRO 117 118.016 -19.301 -14.262 826 HB2 PRO 117 1HB PRO 117 120.160 -17.755 -14.907 827 HB3 PRO 117 2HB PRO 117 118.487 -17.202 -15.109 828 HG2 PRO 117 1HG PRO 117 120.445 -16.556 -12.971 829 HG3 PRO 117 2HG PRO 117 119.245 -15.517 -13.760 830 HD2 PRO 117 1HD PRO 117 118.884 -16.648 -11.274 831 HD3 PRO 117 2HD PRO 117 117.554 -16.167 -12.349 832 H MET 118 H MET 118 120.525 -19.718 -15.181 833 HA MET 118 HA MET 118 121.500 -21.881 -13.709 834 HB2 MET 118 1HB MET 118 122.914 -20.130 -15.730 835 HB3 MET 118 2HB MET 118 123.532 -21.674 -15.142 836 HG2 MET 118 1HG MET 118 121.388 -22.745 -15.913 837 HG3 MET 118 2HG MET 118 120.949 -21.208 -16.656 838 HE1 MET 118 3HE MET 118 124.002 -20.217 -17.642 839 HE2 MET 118 1HE MET 118 122.351 -19.933 -18.208 840 HE3 MET 118 2HE MET 118 123.568 -20.569 -19.312 841 H GLU 119 H GLU 119 122.414 -18.469 -13.604 842 HA GLU 119 HA GLU 119 124.765 -18.626 -12.117 843 HB2 GLU 119 1HB GLU 119 122.587 -16.526 -12.005 844 HB3 GLU 119 2HB GLU 119 124.217 -16.332 -11.358 845 HG2 GLU 119 1HG GLU 119 125.137 -16.769 -13.628 846 HG3 GLU 119 2HG GLU 119 123.497 -16.861 -14.253 847 H ASN 120 H ASN 120 125.169 -18.334 -9.860 848 HA ASN 120 HA ASN 120 123.380 -19.904 -8.218 849 HB2 ASN 120 1HB ASN 120 125.963 -18.505 -7.505 850 HB3 ASN 120 2HB ASN 120 125.120 -19.694 -6.513 851 HD21 ASN 120 1HD2 ASN 120 124.391 -21.614 -8.440 852 HD22 ASN 120 2HD2 ASN 120 125.794 -22.281 -9.124 853 H VAL 121 H VAL 121 122.909 -16.857 -9.085 854 HA VAL 121 HA VAL 121 121.973 -16.035 -6.397 855 HB VAL 121 HB VAL 121 122.333 -13.693 -7.104 856 HG11 VAL 121 1HG1 VAL 121 124.789 -15.456 -7.363 857 HG12 VAL 121 2HG1 VAL 121 124.088 -14.895 -5.846 858 HG13 VAL 121 3HG1 VAL 121 124.795 -13.737 -6.971 859 HG21 VAL 121 3HG2 VAL 121 122.144 -14.032 -9.538 860 HG22 VAL 121 1HG2 VAL 121 123.629 -14.984 -9.528 861 HG23 VAL 121 2HG2 VAL 121 123.682 -13.264 -9.141 862 H ALA 122 H ALA 122 120.046 -14.696 -6.410 863 HA ALA 122 HA ALA 122 118.283 -15.324 -8.713 864 HB1 ALA 122 1HB ALA 122 117.701 -15.168 -5.752 865 HB2 ALA 122 2HB ALA 122 117.496 -16.553 -6.824 866 HB3 ALA 122 3HB ALA 122 116.433 -15.155 -6.978 867 H LEU 123 H LEU 123 116.702 -13.729 -9.268 868 HA LEU 123 HA LEU 123 117.449 -10.989 -8.405 869 HB2 LEU 123 1HB LEU 123 116.937 -10.224 -10.665 870 HB3 LEU 123 2HB LEU 123 118.195 -11.453 -10.693 871 HG LEU 123 HG LEU 123 116.028 -13.060 -10.970 872 HD11 LEU 123 1HD1 LEU 123 114.278 -11.493 -11.056 873 HD12 LEU 123 2HD1 LEU 123 114.616 -11.788 -12.758 874 HD13 LEU 123 3HD1 LEU 123 115.235 -10.334 -11.976 875 HD21 LEU 123 3HD2 LEU 123 116.395 -12.764 -13.509 876 HD22 LEU 123 1HD2 LEU 123 117.792 -13.228 -12.538 877 HD23 LEU 123 2HD2 LEU 123 117.600 -11.556 -13.063 878 H ASP 124 H ASP 124 115.786 -9.529 -8.072 879 HA ASP 124 HA ASP 124 113.037 -10.641 -8.177 880 HB2 ASP 124 1HB ASP 124 112.515 -9.386 -6.158 881 HB3 ASP 124 2HB ASP 124 113.865 -10.474 -5.854 882 H PHE 125 H PHE 125 111.672 -9.537 -9.367 883 HA PHE 125 HA PHE 125 112.306 -6.724 -10.068 884 HB2 PHE 125 1HB PHE 125 112.457 -8.289 -11.978 885 HB3 PHE 125 2HB PHE 125 110.805 -8.797 -11.680 886 HD1 PHE 125 HD1 PHE 125 112.964 -6.030 -12.836 887 HD2 PHE 125 HD2 PHE 125 108.931 -7.428 -12.350 888 HE1 PHE 125 HE1 PHE 125 112.152 -4.194 -14.289 889 HE2 PHE 125 HE2 PHE 125 108.119 -5.591 -13.805 890 HZ PHE 125 HZ PHE 125 109.728 -3.974 -14.775 891 H SER 126 H SER 126 110.835 -5.260 -9.395 892 HA SER 126 HA SER 126 108.064 -6.123 -8.939 893 HB2 SER 126 1HB SER 126 109.219 -6.419 -6.783 894 HB3 SER 126 2HB SER 126 109.756 -4.744 -6.843 895 HG SER 126 HG SER 126 107.477 -5.690 -5.919 896 H TYR 127 H TYR 127 106.545 -4.506 -9.087 897 HA TYR 127 HA TYR 127 107.530 -1.800 -9.789 898 HB2 TYR 127 1HB TYR 127 105.577 -1.527 -11.162 899 HB3 TYR 127 2HB TYR 127 106.397 -3.001 -11.637 900 HD1 TYR 127 HD1 TYR 127 105.428 -5.218 -11.035 901 HD2 TYR 127 HD2 TYR 127 103.359 -1.536 -10.252 902 HE1 TYR 127 HE1 TYR 127 103.312 -6.473 -10.724 903 HE2 TYR 127 HE2 TYR 127 101.243 -2.790 -9.942 904 HH TYR 127 HH TYR 127 100.717 -5.354 -9.215 905 H GLU 128 H GLU 128 107.056 -0.263 -8.356 906 HA GLU 128 HA GLU 128 104.900 -0.790 -6.388 907 HB2 GLU 128 1HB GLU 128 107.516 0.683 -6.012 908 HB3 GLU 128 2HB GLU 128 106.252 0.523 -4.792 909 HG2 GLU 128 1HG GLU 128 106.463 -1.952 -4.941 910 HG3 GLU 128 2HG GLU 128 107.783 -1.750 -6.085 911 H GLN 129 H GLN 129 103.421 0.747 -6.029 912 HA GLN 129 HA GLN 129 103.830 3.424 -7.230 913 HB2 GLN 129 1HB GLN 129 101.272 1.802 -7.107 914 HB3 GLN 129 2HB GLN 129 101.376 3.482 -7.635 915 HG2 GLN 129 1HG GLN 129 102.876 2.852 -9.459 916 HG3 GLN 129 2HG GLN 129 102.878 1.179 -8.909 917 HE21 GLN 129 1HE2 GLN 129 102.010 1.890 -11.545 918 HE22 GLN 129 2HE2 GLN 129 100.345 1.576 -11.659 919 H SER 130 H SER 130 103.317 5.141 -5.914 920 HA SER 130 HA SER 130 102.177 4.508 -3.252 921 HB2 SER 130 1HB SER 130 104.538 6.319 -3.808 922 HB3 SER 130 2HB SER 130 103.790 6.048 -2.238 923 HG SER 130 HG SER 130 105.733 4.707 -3.140 924 H ARG 131 H ARG 131 100.894 6.047 -2.342 925 HA ARG 131 HA ARG 131 100.267 8.429 -3.991 926 HB2 ARG 131 1HB ARG 131 98.420 6.751 -3.807 927 HB3 ARG 131 2HB ARG 131 98.437 6.985 -2.059 928 HG2 ARG 131 1HG ARG 131 97.919 9.358 -2.336 929 HG3 ARG 131 2HG ARG 131 97.980 9.188 -4.091 930 HD2 ARG 131 1HD ARG 131 95.660 9.106 -3.444 931 HD3 ARG 131 2HD ARG 131 96.139 7.477 -3.910 932 HE ARG 131 HE ARG 131 95.724 6.809 -1.744 933 HH11 ARG 131 1HH1 ARG 131 96.173 10.291 -1.713 934 HH12 ARG 131 2HH1 ARG 131 95.767 10.428 -0.034 935 HH21 ARG 131 1HH2 ARG 131 95.211 7.047 0.413 936 HH22 ARG 131 2HH2 ARG 131 95.230 8.613 1.153 937 H ILE 132 H ILE 132 100.790 10.305 -3.092 938 HA ILE 132 HA ILE 132 101.011 10.496 -0.151 939 HB ILE 132 HB ILE 132 102.956 11.696 -2.153 940 HG12 ILE 132 1HG1 ILE 132 103.414 9.500 -0.110 941 HG13 ILE 132 2HG1 ILE 132 103.176 9.210 -1.834 942 HG21 ILE 132 1HG2 ILE 132 104.174 12.447 -0.185 943 HG22 ILE 132 2HG2 ILE 132 103.025 11.636 0.879 944 HG23 ILE 132 3HG2 ILE 132 102.512 13.027 -0.076 945 HD11 ILE 132 3HD1 ILE 132 105.515 9.282 -1.642 946 HD12 ILE 132 1HD1 ILE 132 105.471 10.586 -0.454 947 HD13 ILE 132 2HD1 ILE 132 105.114 10.923 -2.149 948 H ARG 133 H ARG 133 99.188 11.675 0.127 949 HA ARG 133 HA ARG 133 97.295 12.759 -0.817 950 HB2 ARG 133 1HB ARG 133 98.255 13.871 1.174 951 HB3 ARG 133 2HB ARG 133 99.189 14.918 0.113 952 HG2 ARG 133 1HG ARG 133 97.265 16.182 0.677 953 HG3 ARG 133 2HG ARG 133 96.932 15.583 -0.944 954 HD2 ARG 133 1HD ARG 133 95.641 13.700 0.048 955 HD3 ARG 133 2HD ARG 133 95.933 14.372 1.648 956 HE ARG 133 HE ARG 133 94.813 16.457 0.345 957 HH11 ARG 133 1HH1 ARG 133 93.805 13.106 0.628 958 HH12 ARG 133 2HH1 ARG 133 92.123 13.495 0.480 959 HH21 ARG 133 1HH2 ARG 133 92.636 16.896 0.160 960 HH22 ARG 133 2HH2 ARG 133 91.471 15.616 0.218 961 H SER 134 H SER 134 97.242 12.483 -3.078 962 HA SER 134 HA SER 134 96.582 13.489 -5.033 963 HB2 SER 134 1HB SER 134 96.146 15.560 -3.699 964 HB3 SER 134 2HB SER 134 97.798 16.065 -4.040 965 HG SER 134 HG SER 134 95.672 15.580 -5.854 966 H VAL 135 H VAL 135 99.821 13.273 -3.974 967 HA VAL 135 HA VAL 135 100.818 13.860 -6.690 968 HB VAL 135 HB VAL 135 102.372 13.365 -4.134 969 HG11 VAL 135 1HG1 VAL 135 103.611 12.804 -6.191 970 HG12 VAL 135 2HG1 VAL 135 104.265 14.264 -5.448 971 HG13 VAL 135 3HG1 VAL 135 103.220 14.387 -6.863 972 HG21 VAL 135 3HG2 VAL 135 102.740 15.768 -4.089 973 HG22 VAL 135 1HG2 VAL 135 101.002 15.473 -4.136 974 HG23 VAL 135 2HG2 VAL 135 101.851 15.970 -5.599 975 H ASP 136 H ASP 136 101.603 12.247 -7.970 976 HA ASP 136 HA ASP 136 101.250 9.496 -6.939 977 HB2 ASP 136 1HB ASP 136 99.886 10.161 -8.909 978 HB3 ASP 136 2HB ASP 136 101.372 10.457 -9.805 979 H VAL 137 H VAL 137 103.032 8.303 -6.566 980 HA VAL 137 HA VAL 137 105.567 9.149 -7.861 981 HB VAL 137 HB VAL 137 105.207 7.740 -5.203 982 HG11 VAL 137 1HG1 VAL 137 107.589 8.102 -4.931 983 HG12 VAL 137 2HG1 VAL 137 107.665 9.015 -6.439 984 HG13 VAL 137 3HG1 VAL 137 107.332 7.283 -6.473 985 HG21 VAL 137 3HG2 VAL 137 105.883 9.880 -4.205 986 HG22 VAL 137 1HG2 VAL 137 104.419 10.100 -5.164 987 HG23 VAL 137 2HG2 VAL 137 105.980 10.613 -5.806 988 H GLY 138 H GLY 138 106.632 7.691 -9.050 989 HA2 GLY 138 1HA GLY 138 105.717 4.866 -8.968 990 HA3 GLY 138 2HA GLY 138 106.156 5.691 -10.463 991 H THR 139 H THR 139 107.295 3.365 -8.659 992 HA THR 139 HA THR 139 110.113 4.287 -8.787 993 HB THR 139 HB THR 139 108.938 2.443 -6.696 994 HG1 THR 139 HG1 THR 139 108.190 4.409 -6.183 995 HG21 THR 139 3HG2 THR 139 111.100 2.699 -5.617 996 HG22 THR 139 1HG2 THR 139 111.622 3.841 -6.856 997 HG23 THR 139 2HG2 THR 139 111.356 2.148 -7.272 998 H TRP 140 H TRP 140 111.496 2.997 -9.805 999 HA TRP 140 HA TRP 140 110.609 0.288 -10.597 1000 HB2 TRP 140 1HB TRP 140 111.318 2.015 -12.343 1001 HB3 TRP 140 2HB TRP 140 112.938 1.860 -11.695 1002 HD1 TRP 140 HD1 TRP 140 114.084 -0.615 -11.926 1003 HE1 TRP 140 HE1 TRP 140 113.793 -2.380 -13.780 1004 HE3 TRP 140 HE3 TRP 140 109.719 1.012 -14.015 1005 HZ2 TRP 140 HZ2 TRP 140 111.951 -3.017 -15.880 1006 HZ3 TRP 140 HZ3 TRP 140 108.721 -0.186 -15.937 1007 HH2 TRP 140 HH2 TRP 140 109.828 -2.196 -16.873 1008 H ILE 141 H ILE 141 111.538 -1.388 -9.535 1009 HA ILE 141 HA ILE 141 114.079 -0.887 -8.092 1010 HB ILE 141 HB ILE 141 112.167 -0.753 -6.552 1011 HG12 ILE 141 1HG1 ILE 141 113.625 -3.368 -6.111 1012 HG13 ILE 141 2HG1 ILE 141 114.401 -1.799 -5.899 1013 HG21 ILE 141 1HG2 ILE 141 110.803 -2.769 -6.132 1014 HG22 ILE 141 2HG2 ILE 141 111.619 -3.593 -7.460 1015 HG23 ILE 141 3HG2 ILE 141 110.603 -2.188 -7.784 1016 HD11 ILE 141 3HD1 ILE 141 112.939 -1.188 -4.132 1017 HD12 ILE 141 1HD1 ILE 141 113.369 -2.866 -3.800 1018 HD13 ILE 141 2HD1 ILE 141 111.804 -2.483 -4.517 1019 H ALA 142 H ALA 142 115.594 -2.400 -8.251 1020 HA ALA 142 HA ALA 142 114.831 -5.157 -8.940 1021 HB1 ALA 142 1HB ALA 142 116.653 -3.371 -10.517 1022 HB2 ALA 142 2HB ALA 142 115.448 -4.522 -11.093 1023 HB3 ALA 142 3HB ALA 142 116.982 -5.102 -10.446 1024 H GLY 143 H GLY 143 116.073 -6.690 -7.905 1025 HA2 GLY 143 1HA GLY 143 118.548 -5.808 -6.574 1026 HA3 GLY 143 2HA GLY 143 117.251 -6.439 -5.569 1027 H VAL 144 H VAL 144 119.611 -7.674 -5.414 1028 HA VAL 144 HA VAL 144 119.101 -10.277 -6.687 1029 HB VAL 144 HB VAL 144 121.836 -8.976 -6.538 1030 HG11 VAL 144 1HG1 VAL 144 120.924 -11.579 -7.803 1031 HG12 VAL 144 2HG1 VAL 144 121.809 -11.452 -6.283 1032 HG13 VAL 144 3HG1 VAL 144 122.571 -10.949 -7.791 1033 HG21 VAL 144 3HG2 VAL 144 119.993 -9.518 -8.889 1034 HG22 VAL 144 1HG2 VAL 144 121.674 -9.001 -9.034 1035 HG23 VAL 144 2HG2 VAL 144 120.484 -7.934 -8.289 1036 H GLY 145 H GLY 145 119.691 -12.050 -5.380 1037 HA2 GLY 145 1HA GLY 145 120.893 -11.457 -2.768 1038 HA3 GLY 145 2HA GLY 145 119.269 -12.133 -2.780 1039 H TYR 146 H TYR 146 121.205 -13.488 -1.479 1040 HA TYR 146 HA TYR 146 121.578 -15.868 -3.179 1041 HB2 TYR 146 1HB TYR 146 123.788 -16.238 -2.347 1042 HB3 TYR 146 2HB TYR 146 123.715 -14.620 -3.012 1043 HD1 TYR 146 HD1 TYR 146 123.819 -12.651 -1.535 1044 HD2 TYR 146 HD2 TYR 146 124.109 -16.645 0.018 1045 HE1 TYR 146 HE1 TYR 146 124.696 -11.755 0.605 1046 HE2 TYR 146 HE2 TYR 146 124.985 -15.750 2.158 1047 HH TYR 146 HH TYR 146 125.803 -12.350 2.529 1048 H ARG 147 H ARG 147 121.328 -17.821 -2.159 1049 HA ARG 147 HA ARG 147 120.091 -17.678 0.515 1050 HB2 ARG 147 1HB ARG 147 118.735 -18.591 -1.360 1051 HB3 ARG 147 2HB ARG 147 119.935 -19.866 -1.572 1052 HG2 ARG 147 1HG ARG 147 119.545 -20.571 0.791 1053 HG3 ARG 147 2HG ARG 147 118.262 -19.365 0.907 1054 HD2 ARG 147 1HD ARG 147 118.343 -21.649 -1.085 1055 HD3 ARG 147 2HD ARG 147 117.350 -21.602 0.367 1056 HE ARG 147 HE ARG 147 116.808 -20.287 -2.120 1057 HH11 ARG 147 1HH1 ARG 147 116.340 -19.975 1.345 1058 HH12 ARG 147 2HH1 ARG 147 114.929 -18.985 1.166 1059 HH21 ARG 147 1HH2 ARG 147 114.986 -19.011 -2.288 1060 HH22 ARG 147 2HH2 ARG 147 114.173 -18.447 -0.866 1061 H PHE 148 H PHE 148 120.825 -18.916 2.203 1062 HA PHE 148 HA PHE 148 122.948 -20.878 1.726 1063 HB2 PHE 148 1HB PHE 148 124.076 -18.702 2.107 1064 HB3 PHE 148 2HB PHE 148 123.258 -18.573 3.653 1065 HD1 PHE 148 HD1 PHE 148 125.816 -20.419 1.724 1066 HD2 PHE 148 HD2 PHE 148 123.999 -19.834 5.572 1067 HE1 PHE 148 HE1 PHE 148 127.657 -21.698 2.788 1068 HE2 PHE 148 HE2 PHE 148 125.840 -21.112 6.635 1069 HZ PHE 148 HZ PHE 148 127.668 -22.044 5.243 Start of MODEL 18 1 H1 ALA 1 3H ALA 1 115.912 -25.063 6.810 2 H2 ALA 1 2H ALA 1 115.342 -25.304 8.392 3 H3 ALA 1 HT3 ALA 1 117.011 -25.218 8.092 4 HA ALA 1 HA ALA 1 115.036 -23.018 7.860 5 HB1 ALA 1 2HB ALA 1 115.673 -23.347 10.141 6 HB2 ALA 1 3HB ALA 1 116.651 -22.001 9.556 7 HB3 ALA 1 1HB ALA 1 117.362 -23.609 9.702 8 H THR 2 H THR 2 115.443 -21.951 6.018 9 HA THR 2 HA THR 2 118.266 -21.409 5.292 10 HB THR 2 HB THR 2 117.597 -21.442 2.943 11 HG1 THR 2 HG1 THR 2 115.475 -20.833 3.086 12 HG21 THR 2 3HG2 THR 2 117.364 -23.800 2.696 13 HG22 THR 2 1HG2 THR 2 116.537 -23.952 4.246 14 HG23 THR 2 2HG2 THR 2 118.257 -23.565 4.200 15 H SER 3 H SER 3 118.777 -19.336 4.723 16 HA SER 3 HA SER 3 116.592 -17.335 4.749 17 HB2 SER 3 1HB SER 3 118.005 -15.826 6.027 18 HB3 SER 3 2HB SER 3 117.834 -17.340 6.908 19 HG SER 3 HG SER 3 120.048 -16.169 5.808 20 H THR 4 H THR 4 116.959 -15.477 3.477 21 HA THR 4 HA THR 4 119.227 -15.640 1.584 22 HB THR 4 HB THR 4 116.385 -14.904 0.847 23 HG1 THR 4 HG1 THR 4 116.260 -17.023 1.001 24 HG21 THR 4 3HG2 THR 4 119.010 -15.054 -0.601 25 HG22 THR 4 1HG2 THR 4 117.756 -13.818 -0.695 26 HG23 THR 4 2HG2 THR 4 117.515 -15.380 -1.478 27 H VAL 5 H VAL 5 120.274 -13.760 1.244 28 HA VAL 5 HA VAL 5 119.083 -11.295 2.399 29 HB VAL 5 HB VAL 5 122.020 -11.980 2.089 30 HG11 VAL 5 1HG1 VAL 5 121.802 -9.620 2.003 31 HG12 VAL 5 2HG1 VAL 5 122.163 -9.965 3.695 32 HG13 VAL 5 3HG1 VAL 5 120.507 -9.614 3.201 33 HG21 VAL 5 3HG2 VAL 5 121.081 -13.365 3.834 34 HG22 VAL 5 1HG2 VAL 5 120.173 -12.005 4.494 35 HG23 VAL 5 2HG2 VAL 5 121.931 -12.034 4.617 36 H THR 6 H THR 6 118.737 -9.658 1.011 37 HA THR 6 HA THR 6 120.101 -9.716 -1.616 38 HB THR 6 HB THR 6 118.059 -9.166 -2.749 39 HG1 THR 6 HG1 THR 6 116.640 -9.365 -0.335 40 HG21 THR 6 3HG2 THR 6 118.309 -11.637 -1.286 41 HG22 THR 6 1HG2 THR 6 117.521 -11.341 -2.834 42 HG23 THR 6 2HG2 THR 6 116.614 -11.164 -1.336 43 H GLY 7 H GLY 7 120.267 -7.676 -2.667 44 HA2 GLY 7 1HA GLY 7 119.310 -5.303 -1.227 45 HA3 GLY 7 2HA GLY 7 121.032 -5.397 -1.603 46 H GLY 8 H GLY 8 119.028 -3.476 -2.655 47 HA2 GLY 8 1HA GLY 8 119.606 -3.859 -5.488 48 HA3 GLY 8 2HA GLY 8 117.903 -3.890 -5.052 49 H TYR 9 H TYR 9 118.650 -2.055 -6.800 50 HA TYR 9 HA TYR 9 118.762 0.495 -5.290 51 HB2 TYR 9 1HB TYR 9 119.674 0.026 -8.131 52 HB3 TYR 9 2HB TYR 9 119.856 1.495 -7.192 53 HD1 TYR 9 HD1 TYR 9 121.372 1.444 -5.139 54 HD2 TYR 9 HD2 TYR 9 121.290 -1.692 -8.072 55 HE1 TYR 9 HE1 TYR 9 123.579 0.642 -4.342 56 HE2 TYR 9 HE2 TYR 9 123.499 -2.494 -7.276 57 HH TYR 9 HH TYR 9 125.469 -0.659 -5.169 58 H ALA 10 H ALA 10 117.245 2.069 -5.852 59 HA ALA 10 HA ALA 10 115.374 1.427 -8.039 60 HB1 ALA 10 1HB ALA 10 113.451 1.751 -6.676 61 HB2 ALA 10 2HB ALA 10 114.420 2.328 -5.321 62 HB3 ALA 10 3HB ALA 10 114.488 0.631 -5.793 63 H GLN 11 H GLN 11 114.537 3.158 -9.091 64 HA GLN 11 HA GLN 11 115.157 5.863 -8.050 65 HB2 GLN 11 1HB GLN 11 115.087 4.912 -10.930 66 HB3 GLN 11 2HB GLN 11 115.275 6.592 -10.424 67 HG2 GLN 11 1HG GLN 11 117.341 6.043 -9.241 68 HG3 GLN 11 2HG GLN 11 117.141 4.338 -9.636 69 HE21 GLN 11 1HE2 GLN 11 119.471 5.794 -10.442 70 HE22 GLN 11 2HE2 GLN 11 119.462 5.919 -12.134 71 H SER 12 H SER 12 113.467 7.367 -8.143 72 HA SER 12 HA SER 12 110.836 6.238 -8.937 73 HB2 SER 12 1HB SER 12 111.424 8.029 -6.570 74 HB3 SER 12 2HB SER 12 109.853 7.380 -7.026 75 HG SER 12 HG SER 12 111.097 5.264 -6.894 76 H ASP 13 H ASP 13 109.456 7.533 -10.001 77 HA ASP 13 HA ASP 13 110.373 10.261 -10.682 78 HB2 ASP 13 1HB ASP 13 108.944 10.083 -12.659 79 HB3 ASP 13 2HB ASP 13 110.080 8.740 -12.615 80 H ALA 14 H ALA 14 109.017 11.983 -10.249 81 HA ALA 14 HA ALA 14 106.588 11.335 -8.678 82 HB1 ALA 14 1HB ALA 14 108.498 12.081 -7.266 83 HB2 ALA 14 2HB ALA 14 107.121 13.180 -7.203 84 HB3 ALA 14 3HB ALA 14 108.536 13.593 -8.172 85 H GLN 15 H GLN 15 104.970 11.846 -9.969 86 HA GLN 15 HA GLN 15 105.013 14.129 -11.737 87 HB2 GLN 15 1HB GLN 15 103.740 12.035 -12.248 88 HB3 GLN 15 2HB GLN 15 102.658 12.413 -10.907 89 HG2 GLN 15 1HG GLN 15 101.575 13.277 -12.841 90 HG3 GLN 15 2HG GLN 15 102.285 14.678 -12.042 91 HE21 GLN 15 1HE2 GLN 15 103.440 16.019 -13.426 92 HE22 GLN 15 2HE2 GLN 15 104.184 15.521 -14.868 93 H GLY 16 H GLY 16 104.572 16.115 -11.185 94 HA2 GLY 16 1HA GLY 16 103.389 17.873 -10.142 95 HA3 GLY 16 2HA GLY 16 102.826 16.745 -8.919 96 H GLN 17 H GLN 17 105.825 15.813 -8.791 97 HA GLN 17 HA GLN 17 106.865 18.113 -7.242 98 HB2 GLN 17 1HB GLN 17 106.361 16.021 -5.927 99 HB3 GLN 17 2HB GLN 17 107.593 15.200 -6.881 100 HG2 GLN 17 1HG GLN 17 108.689 15.916 -4.891 101 HG3 GLN 17 2HG GLN 17 109.205 17.037 -6.147 102 HE21 GLN 17 1HE2 GLN 17 109.054 19.197 -5.543 103 HE22 GLN 17 2HE2 GLN 17 107.980 19.811 -4.381 104 H MET 18 H MET 18 109.025 18.718 -7.590 105 HA MET 18 HA MET 18 110.088 17.930 -10.184 106 HB2 MET 18 1HB MET 18 110.984 19.992 -8.160 107 HB3 MET 18 2HB MET 18 111.778 19.716 -9.711 108 HG2 MET 18 1HG MET 18 109.616 20.175 -10.863 109 HG3 MET 18 2HG MET 18 108.894 20.553 -9.299 110 HE1 MET 18 3HE MET 18 108.116 22.752 -10.098 111 HE2 MET 18 1HE MET 18 108.837 22.629 -11.707 112 HE3 MET 18 2HE MET 18 109.099 24.071 -10.729 113 H ASN 19 H ASN 19 112.334 17.351 -10.465 114 HA ASN 19 HA ASN 19 114.255 16.193 -10.043 115 HB2 ASN 19 1HB ASN 19 113.690 16.715 -7.117 116 HB3 ASN 19 2HB ASN 19 115.227 16.241 -7.831 117 HD21 ASN 19 1HD2 ASN 19 115.333 17.923 -10.091 118 HD22 ASN 19 2HD2 ASN 19 115.383 19.542 -9.579 119 H LYS 20 H LYS 20 114.711 14.097 -10.023 120 HA LYS 20 HA LYS 20 112.696 12.208 -9.115 121 HB2 LYS 20 1HB LYS 20 115.365 11.753 -10.473 122 HB3 LYS 20 2HB LYS 20 114.128 10.526 -10.197 123 HG2 LYS 20 1HG LYS 20 112.528 11.988 -11.510 124 HG3 LYS 20 2HG LYS 20 113.915 12.985 -11.949 125 HD2 LYS 20 1HD LYS 20 113.706 10.008 -12.480 126 HD3 LYS 20 2HD LYS 20 113.383 11.262 -13.677 127 HE2 LYS 20 1HE LYS 20 115.715 12.135 -13.276 128 HE3 LYS 20 2HE LYS 20 116.011 10.713 -12.274 129 HZ1 LYS 20 3HZ LYS 20 116.684 10.560 -14.690 130 HZ2 LYS 20 1HZ LYS 20 115.029 10.504 -15.058 131 HZ3 LYS 20 2HZ LYS 20 115.725 9.291 -14.094 132 H MET 21 H MET 21 113.412 10.246 -7.858 133 HA MET 21 HA MET 21 115.242 11.111 -5.682 134 HB2 MET 21 1HB MET 21 112.756 9.388 -5.523 135 HB3 MET 21 2HB MET 21 113.832 9.754 -4.174 136 HG2 MET 21 1HG MET 21 113.398 12.200 -4.588 137 HG3 MET 21 2HG MET 21 112.177 11.727 -5.769 138 HE1 MET 21 3HE MET 21 112.272 11.639 -1.311 139 HE2 MET 21 1HE MET 21 113.604 11.583 -2.473 140 HE3 MET 21 2HE MET 21 112.856 10.090 -1.911 141 H GLY 22 H GLY 22 116.567 9.523 -4.730 142 HA2 GLY 22 1HA GLY 22 116.726 6.937 -6.180 143 HA3 GLY 22 2HA GLY 22 118.173 7.891 -5.860 144 H GLY 23 H GLY 23 117.074 5.159 -4.877 145 HA2 GLY 23 1HA GLY 23 117.879 5.563 -2.095 146 HA3 GLY 23 2HA GLY 23 116.249 4.960 -2.357 147 H PHE 24 H PHE 24 117.931 3.499 -0.893 148 HA PHE 24 HA PHE 24 118.658 1.218 -2.645 149 HB2 PHE 24 1HB PHE 24 119.898 1.981 0.007 150 HB3 PHE 24 2HB PHE 24 120.359 0.623 -1.002 151 HD1 PHE 24 HD1 PHE 24 120.501 4.268 -0.567 152 HD2 PHE 24 HD2 PHE 24 121.659 0.959 -3.050 153 HE1 PHE 24 HE1 PHE 24 122.126 5.722 -1.748 154 HE2 PHE 24 HE2 PHE 24 123.283 2.414 -4.230 155 HZ PHE 24 HZ PHE 24 123.518 4.796 -3.579 156 H ASN 25 H ASN 25 118.131 -0.883 -1.807 157 HA ASN 25 HA ASN 25 116.265 -0.871 0.493 158 HB2 ASN 25 1HB ASN 25 115.142 -0.822 -1.822 159 HB3 ASN 25 2HB ASN 25 115.749 -2.465 -2.007 160 HD21 ASN 25 1HD2 ASN 25 112.966 -2.015 -1.956 161 HD22 ASN 25 2HD2 ASN 25 112.325 -2.640 -0.515 162 H LEU 26 H LEU 26 116.458 -2.558 1.854 163 HA LEU 26 HA LEU 26 118.070 -4.891 0.992 164 HB2 LEU 26 1HB LEU 26 119.258 -3.421 2.647 165 HB3 LEU 26 2HB LEU 26 117.948 -3.730 3.787 166 HG LEU 26 HG LEU 26 118.432 -6.239 3.327 167 HD11 LEU 26 1HD1 LEU 26 121.210 -5.273 2.726 168 HD12 LEU 26 2HD1 LEU 26 120.055 -5.429 1.404 169 HD13 LEU 26 3HD1 LEU 26 120.472 -6.836 2.380 170 HD21 LEU 26 3HD2 LEU 26 120.347 -4.439 4.843 171 HD22 LEU 26 1HD2 LEU 26 120.283 -6.192 5.031 172 HD23 LEU 26 2HD2 LEU 26 118.890 -5.206 5.477 173 H LYS 27 H LYS 27 117.167 -6.893 1.435 174 HA LYS 27 HA LYS 27 114.563 -6.874 2.851 175 HB2 LYS 27 1HB LYS 27 115.137 -8.260 0.226 176 HB3 LYS 27 2HB LYS 27 113.619 -8.311 1.121 177 HG2 LYS 27 1HG LYS 27 113.552 -5.782 0.942 178 HG3 LYS 27 2HG LYS 27 114.904 -5.900 -0.180 179 HD2 LYS 27 1HD LYS 27 112.234 -7.290 -0.545 180 HD3 LYS 27 2HD LYS 27 112.708 -5.795 -1.350 181 HE2 LYS 27 1HE LYS 27 114.124 -8.464 -1.602 182 HE3 LYS 27 2HE LYS 27 113.099 -7.719 -2.829 183 HZ1 LYS 27 3HZ LYS 27 114.687 -5.751 -2.620 184 HZ2 LYS 27 1HZ LYS 27 115.241 -7.125 -3.448 185 HZ3 LYS 27 2HZ LYS 27 115.741 -6.838 -1.849 186 H TYR 28 H TYR 28 114.066 -8.620 4.043 187 HA TYR 28 HA TYR 28 115.983 -10.883 4.074 188 HB2 TYR 28 1HB TYR 28 114.490 -9.641 6.388 189 HB3 TYR 28 2HB TYR 28 115.422 -11.123 6.482 190 HD1 TYR 28 HD1 TYR 28 115.561 -7.460 6.193 191 HD2 TYR 28 HD2 TYR 28 117.866 -11.078 6.431 192 HE1 TYR 28 HE1 TYR 28 117.596 -6.132 6.687 193 HE2 TYR 28 HE2 TYR 28 119.900 -9.749 6.924 194 HH TYR 28 HH TYR 28 120.750 -7.520 6.651 195 H ARG 29 H ARG 29 115.117 -12.921 4.042 196 HA ARG 29 HA ARG 29 112.175 -13.168 4.201 197 HB2 ARG 29 1HB ARG 29 114.002 -14.421 2.143 198 HB3 ARG 29 2HB ARG 29 112.301 -14.838 2.358 199 HG2 ARG 29 1HG ARG 29 111.714 -12.435 1.977 200 HG3 ARG 29 2HG ARG 29 113.411 -12.117 1.616 201 HD2 ARG 29 1HD ARG 29 111.591 -14.023 0.119 202 HD3 ARG 29 2HD ARG 29 112.172 -12.467 -0.463 203 HE ARG 29 HE ARG 29 114.480 -13.750 0.043 204 HH11 ARG 29 1HH1 ARG 29 111.625 -14.823 -1.696 205 HH12 ARG 29 2HH1 ARG 29 112.528 -15.879 -2.729 206 HH21 ARG 29 1HH2 ARG 29 115.590 -15.127 -1.318 207 HH22 ARG 29 2HH2 ARG 29 114.744 -16.048 -2.516 208 H TYR 30 H TYR 30 111.393 -14.943 5.237 209 HA TYR 30 HA TYR 30 113.352 -16.938 6.216 210 HB2 TYR 30 1HB TYR 30 111.046 -15.740 7.755 211 HB3 TYR 30 2HB TYR 30 112.099 -17.021 8.325 212 HD1 TYR 30 HD2 TYR 30 114.401 -16.546 9.012 213 HD2 TYR 30 HD1 TYR 30 111.798 -13.427 7.616 214 HE1 TYR 30 HE2 TYR 30 115.962 -14.841 9.909 215 HE2 TYR 30 HE1 TYR 30 113.359 -11.723 8.513 216 HH TYR 30 HH TYR 30 116.276 -12.672 10.317 217 H GLU 31 H GLU 31 112.682 -19.056 6.241 218 HA GLU 31 HA GLU 31 109.926 -19.624 5.321 219 HB2 GLU 31 1HB GLU 31 111.581 -19.793 3.449 220 HB3 GLU 31 2HB GLU 31 112.409 -21.059 4.357 221 HG2 GLU 31 1HG GLU 31 110.293 -22.367 4.404 222 HG3 GLU 31 2HG GLU 31 109.529 -21.129 3.418 223 H GLU 32 H GLU 32 108.980 -21.485 6.135 224 HA GLU 32 HA GLU 32 110.332 -22.687 8.447 225 HB2 GLU 32 1HB GLU 32 107.470 -22.905 7.483 226 HB3 GLU 32 2HB GLU 32 108.103 -23.632 8.959 227 HG2 GLU 32 1HG GLU 32 108.762 -21.368 9.756 228 HG3 GLU 32 2HG GLU 32 108.035 -20.672 8.315 229 H ASP 33 H ASP 33 110.579 -24.946 8.675 230 HA ASP 33 HA ASP 33 111.415 -26.163 6.235 231 HB2 ASP 33 1HB ASP 33 112.145 -28.014 7.631 232 HB3 ASP 33 2HB ASP 33 112.613 -26.478 8.355 233 H ASN 34 H ASN 34 108.712 -26.882 8.475 234 HA ASN 34 HA ASN 34 107.863 -29.023 6.622 235 HB2 ASN 34 1HB ASN 34 107.014 -28.480 9.468 236 HB3 ASN 34 2HB ASN 34 106.522 -29.858 8.483 237 HD21 ASN 34 1HD2 ASN 34 108.947 -30.581 7.261 238 HD22 ASN 34 2HD2 ASN 34 110.062 -31.049 8.452 239 H SER 35 H SER 35 106.956 -25.840 7.561 240 HA SER 35 HA SER 35 104.574 -26.082 5.887 241 HB2 SER 35 1HB SER 35 104.047 -26.383 8.443 242 HB3 SER 35 2HB SER 35 104.279 -24.639 8.501 243 HG SER 35 HG SER 35 102.251 -26.138 7.411 244 HA PRO 36 HA PRO 36 107.315 -22.396 5.453 245 HB2 PRO 36 1HB PRO 36 107.541 -22.314 2.746 246 HB3 PRO 36 2HB PRO 36 108.516 -23.395 3.761 247 HG2 PRO 36 1HG PRO 36 106.112 -24.001 2.127 248 HG3 PRO 36 2HG PRO 36 107.570 -24.970 2.398 249 HD2 PRO 36 1HD PRO 36 105.181 -25.408 3.702 250 HD3 PRO 36 2HD PRO 36 106.767 -25.881 4.347 251 H LEU 37 H LEU 37 106.610 -20.407 5.500 252 HA LEU 37 HA LEU 37 104.514 -19.501 3.619 253 HB2 LEU 37 1HB LEU 37 105.011 -18.469 6.431 254 HB3 LEU 37 2HB LEU 37 103.766 -17.906 5.317 255 HG LEU 37 HG LEU 37 103.967 -20.742 6.372 256 HD11 LEU 37 1HD1 LEU 37 102.374 -18.333 7.244 257 HD12 LEU 37 2HD1 LEU 37 103.324 -19.440 8.236 258 HD13 LEU 37 3HD1 LEU 37 101.789 -19.969 7.548 259 HD21 LEU 37 3HD2 LEU 37 101.619 -20.844 5.447 260 HD22 LEU 37 1HD2 LEU 37 102.865 -20.658 4.213 261 HD23 LEU 37 2HD2 LEU 37 101.902 -19.267 4.709 262 H GLY 38 H GLY 38 105.082 -17.584 2.469 263 HA2 GLY 38 1HA GLY 38 107.942 -16.947 2.734 264 HA3 GLY 38 2HA GLY 38 106.920 -16.567 1.348 265 H VAL 39 H VAL 39 108.452 -15.258 3.970 266 HA VAL 39 HA VAL 39 106.645 -12.901 3.964 267 HB VAL 39 HB VAL 39 108.348 -13.888 6.272 268 HG11 VAL 39 1HG1 VAL 39 107.979 -11.409 6.097 269 HG12 VAL 39 2HG1 VAL 39 107.257 -12.124 7.537 270 HG13 VAL 39 3HG1 VAL 39 106.242 -11.709 6.156 271 HG21 VAL 39 3HG2 VAL 39 106.480 -15.394 6.011 272 HG22 VAL 39 1HG2 VAL 39 105.368 -14.052 5.739 273 HG23 VAL 39 2HG2 VAL 39 106.084 -14.295 7.333 274 H ILE 40 H ILE 40 107.575 -11.088 3.317 275 HA ILE 40 HA ILE 40 110.533 -10.884 3.399 276 HB ILE 40 HB ILE 40 109.732 -11.273 1.103 277 HG12 ILE 40 1HG1 ILE 40 110.486 -8.363 1.275 278 HG13 ILE 40 2HG1 ILE 40 111.632 -9.615 1.757 279 HG21 ILE 40 1HG2 ILE 40 107.464 -10.304 1.407 280 HG22 ILE 40 2HG2 ILE 40 108.289 -9.640 -0.003 281 HG23 ILE 40 3HG2 ILE 40 108.183 -8.695 1.482 282 HD11 ILE 40 3HD1 ILE 40 110.481 -9.047 -0.954 283 HD12 ILE 40 1HD1 ILE 40 110.969 -10.695 -0.558 284 HD13 ILE 40 2HD1 ILE 40 112.150 -9.387 -0.500 285 H GLY 41 H GLY 41 111.297 -9.165 4.409 286 HA2 GLY 41 1HA GLY 41 109.508 -6.829 4.834 287 HA3 GLY 41 2HA GLY 41 110.689 -7.373 6.029 288 H SER 42 H SER 42 110.275 -4.920 4.068 289 HA SER 42 HA SER 42 113.075 -4.863 3.082 290 HB2 SER 42 1HB SER 42 110.682 -3.631 1.705 291 HB3 SER 42 2HB SER 42 112.332 -3.728 1.099 292 HG SER 42 HG SER 42 110.664 -5.942 1.739 293 H PHE 43 H PHE 43 114.231 -3.088 3.533 294 HA PHE 43 HA PHE 43 112.827 -0.747 4.695 295 HB2 PHE 43 1HB PHE 43 114.428 -1.914 6.210 296 HB3 PHE 43 2HB PHE 43 115.706 -1.602 5.051 297 HD1 PHE 43 HD1 PHE 43 116.606 0.655 4.746 298 HD2 PHE 43 HD2 PHE 43 113.485 -0.143 7.587 299 HE1 PHE 43 HE1 PHE 43 117.010 2.859 5.808 300 HE2 PHE 43 HE2 PHE 43 113.887 2.063 8.648 301 HZ PHE 43 HZ PHE 43 115.650 3.563 7.759 302 H THR 44 H THR 44 112.808 1.017 3.408 303 HA THR 44 HA THR 44 114.901 1.216 1.303 304 HB THR 44 HB THR 44 112.710 0.731 0.334 305 HG1 THR 44 HG1 THR 44 112.668 2.498 -1.035 306 HG21 THR 44 3HG2 THR 44 110.829 2.261 0.646 307 HG22 THR 44 1HG2 THR 44 111.798 3.265 1.726 308 HG23 THR 44 2HG2 THR 44 111.349 1.629 2.208 309 H TYR 45 H TYR 45 116.020 3.041 1.166 310 HA TYR 45 HA TYR 45 115.104 5.410 2.693 311 HB2 TYR 45 1HB TYR 45 116.932 4.160 3.858 312 HB3 TYR 45 2HB TYR 45 117.948 4.412 2.454 313 HD1 TYR 45 HD1 TYR 45 118.869 6.626 1.950 314 HD2 TYR 45 HD2 TYR 45 116.380 5.966 5.387 315 HE1 TYR 45 HE1 TYR 45 119.600 8.799 2.896 316 HE2 TYR 45 HE2 TYR 45 117.109 8.139 6.333 317 HH TYR 45 HH TYR 45 119.579 9.659 5.753 318 H THR 46 H THR 46 114.976 7.184 1.435 319 HA THR 46 HA THR 46 116.527 7.247 -1.086 320 HB THR 46 HB THR 46 114.584 8.194 -2.225 321 HG1 THR 46 HG1 THR 46 113.629 9.142 -0.395 322 HG21 THR 46 3HG2 THR 46 114.454 5.503 -0.957 323 HG22 THR 46 1HG2 THR 46 114.424 5.957 -2.660 324 HG23 THR 46 2HG2 THR 46 112.966 6.106 -1.682 325 H GLU 47 H GLU 47 116.979 9.318 -1.909 326 HA GLU 47 HA GLU 47 116.485 11.599 -0.107 327 HB2 GLU 47 1HB GLU 47 119.137 10.845 -1.359 328 HB3 GLU 47 2HB GLU 47 118.810 12.382 -0.554 329 HG2 GLU 47 1HG GLU 47 118.546 9.650 0.734 330 HG3 GLU 47 2HG GLU 47 119.897 10.752 0.969 331 H LYS 48 H LYS 48 116.549 13.650 -1.139 332 HA LYS 48 HA LYS 48 116.455 13.616 -4.089 333 HB2 LYS 48 1HB LYS 48 114.138 13.549 -3.161 334 HB3 LYS 48 2HB LYS 48 114.471 15.057 -2.310 335 HG2 LYS 48 1HG LYS 48 114.888 16.205 -4.423 336 HG3 LYS 48 2HG LYS 48 114.671 14.699 -5.314 337 HD2 LYS 48 1HD LYS 48 112.599 15.937 -5.453 338 HD3 LYS 48 2HD LYS 48 112.336 14.568 -4.373 339 HE2 LYS 48 1HE LYS 48 112.436 15.927 -2.435 340 HE3 LYS 48 2HE LYS 48 113.169 17.268 -3.315 341 HZ1 LYS 48 3HZ LYS 48 111.023 17.968 -3.246 342 HZ2 LYS 48 1HZ LYS 48 110.377 16.398 -3.236 343 HZ3 LYS 48 2HZ LYS 48 110.957 17.069 -4.686 344 H SER 49 H SER 49 117.548 15.271 -5.006 345 HA SER 49 HA SER 49 118.495 17.452 -3.231 346 HB2 SER 49 1HB SER 49 120.282 15.935 -4.068 347 HB3 SER 49 2HB SER 49 119.820 16.345 -5.717 348 HG SER 49 HG SER 49 120.933 18.109 -5.498 349 H ARG 50 H ARG 50 118.135 19.512 -3.824 350 HA ARG 50 HA ARG 50 117.248 20.086 -6.563 351 HB2 ARG 50 1HB ARG 50 115.352 21.397 -5.782 352 HB3 ARG 50 2HB ARG 50 115.212 19.738 -5.207 353 HG2 ARG 50 1HG ARG 50 116.245 20.490 -3.030 354 HG3 ARG 50 2HG ARG 50 116.133 22.149 -3.619 355 HD2 ARG 50 1HD ARG 50 113.676 21.821 -3.937 356 HD3 ARG 50 2HD ARG 50 113.830 20.225 -3.208 357 HE ARG 50 HE ARG 50 114.955 21.917 -1.369 358 HH11 ARG 50 1HH1 ARG 50 111.815 21.791 -2.935 359 HH12 ARG 50 2HH1 ARG 50 111.005 22.529 -1.593 360 HH21 ARG 50 1HH2 ARG 50 113.857 22.863 0.327 361 HH22 ARG 50 2HH2 ARG 50 112.149 23.128 0.230 362 H THR 51 H THR 51 117.415 22.335 -7.153 363 HA THR 51 HA THR 51 119.227 23.902 -5.405 364 HB THR 51 HB THR 51 119.280 23.811 -8.431 365 HG1 THR 51 HG1 THR 51 120.078 21.898 -7.650 366 HG21 THR 51 3HG2 THR 51 121.368 25.079 -8.147 367 HG22 THR 51 1HG2 THR 51 121.150 25.059 -6.397 368 HG23 THR 51 2HG2 THR 51 120.014 25.943 -7.417 369 H ALA 52 H ALA 52 118.671 25.982 -5.060 370 HA ALA 52 HA ALA 52 116.506 27.153 -6.707 371 HB1 ALA 52 1HB ALA 52 115.387 26.560 -4.712 372 HB2 ALA 52 2HB ALA 52 115.773 28.269 -4.515 373 HB3 ALA 52 3HB ALA 52 116.751 27.045 -3.704 374 H SER 53 H SER 53 116.617 29.364 -7.049 375 HA SER 53 HA SER 53 119.159 30.558 -7.142 376 HB2 SER 53 1HB SER 53 117.204 31.217 -8.549 377 HB3 SER 53 2HB SER 53 116.482 31.967 -7.129 378 HG SER 53 HG SER 53 118.214 33.377 -7.037 379 H SER 54 H SER 54 116.597 30.740 -4.717 380 HA SER 54 HA SER 54 117.495 32.918 -3.225 381 HB2 SER 54 1HB SER 54 115.334 31.724 -2.880 382 HB3 SER 54 2HB SER 54 116.224 30.395 -2.144 383 HG SER 54 HG SER 54 115.605 31.738 -0.500 384 H GLY 55 H GLY 55 118.606 29.563 -3.212 385 HA2 GLY 55 1HA GLY 55 120.729 28.827 -2.543 386 HA3 GLY 55 2HA GLY 55 121.001 30.378 -1.765 387 H ASP 56 H ASP 56 118.016 28.747 -1.039 388 HA ASP 56 HA ASP 56 118.820 28.439 1.729 389 HB2 ASP 56 1HB ASP 56 116.548 29.230 1.082 390 HB3 ASP 56 2HB ASP 56 116.230 27.646 0.376 391 H TYR 57 H TYR 57 119.762 26.671 2.514 392 HA TYR 57 HA TYR 57 119.499 24.132 1.009 393 HB2 TYR 57 1HB TYR 57 121.701 25.047 2.861 394 HB3 TYR 57 2HB TYR 57 121.646 23.514 2.013 395 HD1 TYR 57 HD1 TYR 57 121.779 23.491 -0.508 396 HD2 TYR 57 HD2 TYR 57 122.472 27.035 1.819 397 HE1 TYR 57 HE1 TYR 57 122.914 24.542 -2.446 398 HE2 TYR 57 HE2 TYR 57 123.606 28.086 -0.121 399 HH TYR 57 HH TYR 57 124.908 26.814 -2.398 400 H ASN 58 H ASN 58 118.704 22.389 1.995 401 HA ASN 58 HA ASN 58 118.610 22.248 4.913 402 HB2 ASN 58 1HB ASN 58 116.222 21.745 4.956 403 HB3 ASN 58 2HB ASN 58 116.491 23.338 4.255 404 HD21 ASN 58 1HD2 ASN 58 114.100 21.847 3.721 405 HD22 ASN 58 2HD2 ASN 58 114.101 21.414 2.079 406 H LYS 59 H LYS 59 117.345 20.005 5.408 407 HA LYS 59 HA LYS 59 118.342 17.976 3.495 408 HB2 LYS 59 1HB LYS 59 119.886 18.202 5.445 409 HB3 LYS 59 2HB LYS 59 118.544 17.778 6.508 410 HG2 LYS 59 1HG LYS 59 118.292 15.619 5.395 411 HG3 LYS 59 2HG LYS 59 119.556 16.040 4.239 412 HD2 LYS 59 1HD LYS 59 120.563 14.650 5.934 413 HD3 LYS 59 2HD LYS 59 121.139 16.298 6.188 414 HE2 LYS 59 1HE LYS 59 119.822 16.611 8.087 415 HE3 LYS 59 2HE LYS 59 118.663 15.369 7.611 416 HZ1 LYS 59 3HZ LYS 59 120.076 14.624 9.427 417 HZ2 LYS 59 1HZ LYS 59 121.461 14.878 8.481 418 HZ3 LYS 59 2HZ LYS 59 120.335 13.686 8.034 419 H ASN 60 H ASN 60 116.752 16.738 2.821 420 HA ASN 60 HA ASN 60 114.533 16.086 4.673 421 HB2 ASN 60 1HB ASN 60 113.932 17.676 2.774 422 HB3 ASN 60 2HB ASN 60 114.260 16.337 1.675 423 HD21 ASN 60 1HD2 ASN 60 112.424 15.143 1.176 424 HD22 ASN 60 2HD2 ASN 60 111.079 14.952 2.193 425 H GLN 61 H GLN 61 114.013 13.946 4.827 426 HA GLN 61 HA GLN 61 115.268 12.077 2.917 427 HB2 GLN 61 1HB GLN 61 116.028 10.641 4.719 428 HB3 GLN 61 2HB GLN 61 116.715 12.250 4.921 429 HG2 GLN 61 1HG GLN 61 114.786 12.746 6.505 430 HG3 GLN 61 2HG GLN 61 114.403 11.027 6.443 431 HE21 GLN 61 1HE2 GLN 61 115.070 10.364 8.532 432 HE22 GLN 61 2HE2 GLN 61 116.654 10.554 9.114 433 H TYR 62 H TYR 62 114.211 10.087 2.665 434 HA TYR 62 HA TYR 62 111.537 9.883 3.925 435 HB2 TYR 62 1HB TYR 62 111.384 10.813 1.635 436 HB3 TYR 62 2HB TYR 62 112.228 9.409 1.022 437 HD1 TYR 62 HD1 TYR 62 111.105 7.232 0.873 438 HD2 TYR 62 HD2 TYR 62 109.064 10.714 2.344 439 HE1 TYR 62 HE1 TYR 62 108.929 6.081 0.576 440 HE2 TYR 62 HE2 TYR 62 106.888 9.561 2.051 441 HH TYR 62 HH TYR 62 106.714 6.303 0.625 442 H TYR 63 H TYR 63 111.127 7.897 4.747 443 HA TYR 63 HA TYR 63 112.658 5.595 3.700 444 HB2 TYR 63 1HB TYR 63 113.143 4.790 5.901 445 HB3 TYR 63 2HB TYR 63 113.745 6.429 5.766 446 HD1 TYR 63 HD1 TYR 63 111.260 4.224 7.341 447 HD2 TYR 63 HD2 TYR 63 112.726 8.250 7.041 448 HE1 TYR 63 HE1 TYR 63 109.999 4.837 9.388 449 HE2 TYR 63 HE2 TYR 63 111.464 8.863 9.086 450 HH TYR 63 HH TYR 63 109.751 8.168 10.464 451 H GLY 64 H GLY 64 111.621 3.561 3.955 452 HA2 GLY 64 1HA GLY 64 108.759 3.700 4.675 453 HA3 GLY 64 2HA GLY 64 109.224 3.145 3.071 454 H ILE 65 H ILE 65 107.961 1.898 5.599 455 HA ILE 65 HA ILE 65 109.704 -0.503 5.696 456 HB ILE 65 HB ILE 65 107.638 0.357 7.735 457 HG12 ILE 65 1HG1 ILE 65 109.506 1.935 7.776 458 HG13 ILE 65 2HG1 ILE 65 109.579 0.889 9.187 459 HG21 ILE 65 1HG2 ILE 65 107.985 -2.040 7.689 460 HG22 ILE 65 2HG2 ILE 65 108.789 -1.385 9.116 461 HG23 ILE 65 3HG2 ILE 65 109.735 -1.827 7.695 462 HD11 ILE 65 3HD1 ILE 65 111.108 -0.466 7.261 463 HD12 ILE 65 1HD1 ILE 65 111.721 0.478 8.617 464 HD13 ILE 65 2HD1 ILE 65 111.518 1.233 7.040 465 H THR 66 H THR 66 108.877 -2.286 4.776 466 HA THR 66 HA THR 66 105.954 -2.430 4.332 467 HB THR 66 HB THR 66 106.388 -3.355 2.093 468 HG1 THR 66 HG1 THR 66 108.457 -4.154 2.455 469 HG21 THR 66 3HG2 THR 66 105.945 -1.109 1.830 470 HG22 THR 66 1HG2 THR 66 107.594 -1.149 1.208 471 HG23 THR 66 2HG2 THR 66 107.289 -0.609 2.857 472 H ALA 67 H ALA 67 105.125 -4.549 3.989 473 HA ALA 67 HA ALA 67 106.888 -6.840 4.415 474 HB1 ALA 67 1HB ALA 67 105.190 -7.742 6.117 475 HB2 ALA 67 2HB ALA 67 104.626 -6.077 6.264 476 HB3 ALA 67 3HB ALA 67 106.290 -6.485 6.684 477 H GLY 68 H GLY 68 106.050 -8.744 3.490 478 HA2 GLY 68 1HA GLY 68 103.351 -8.622 2.354 479 HA3 GLY 68 2HA GLY 68 104.693 -8.757 1.240 480 HA PRO 69 HA PRO 69 103.935 -13.135 2.922 481 HB2 PRO 69 1HB PRO 69 101.336 -13.593 1.685 482 HB3 PRO 69 2HB PRO 69 101.830 -13.842 3.366 483 HG2 PRO 69 1HG PRO 69 100.086 -11.925 2.554 484 HG3 PRO 69 2HG PRO 69 101.072 -11.822 4.022 485 HD2 PRO 69 1HD PRO 69 101.508 -10.496 1.370 486 HD3 PRO 69 2HD PRO 69 101.804 -9.872 3.010 487 H ALA 70 H ALA 70 104.039 -15.050 1.409 488 HA ALA 70 HA ALA 70 104.200 -14.221 -1.434 489 HB1 ALA 70 1HB ALA 70 106.396 -14.751 0.069 490 HB2 ALA 70 2HB ALA 70 106.303 -15.035 -1.667 491 HB3 ALA 70 3HB ALA 70 106.037 -16.365 -0.542 492 H TYR 71 H TYR 71 103.852 -15.927 -2.979 493 HA TYR 71 HA TYR 71 102.230 -18.158 -1.903 494 HB2 TYR 71 1HB TYR 71 101.754 -16.555 -4.420 495 HB3 TYR 71 2HB TYR 71 100.826 -17.954 -3.911 496 HD1 TYR 71 HD1 TYR 71 99.456 -17.816 -1.789 497 HD2 TYR 71 HD2 TYR 71 101.306 -14.381 -3.586 498 HE1 TYR 71 HE1 TYR 71 97.955 -16.329 -0.491 499 HE2 TYR 71 HE2 TYR 71 99.805 -12.893 -2.287 500 HH TYR 71 HH TYR 71 98.488 -13.186 0.032 501 H ARG 72 H ARG 72 102.857 -20.120 -2.541 502 HA ARG 72 HA ARG 72 104.988 -20.353 -4.527 503 HB2 ARG 72 1HB ARG 72 105.129 -21.574 -2.357 504 HB3 ARG 72 2HB ARG 72 103.704 -22.503 -2.825 505 HG2 ARG 72 1HG ARG 72 104.917 -23.267 -4.867 506 HG3 ARG 72 2HG ARG 72 106.356 -22.424 -4.292 507 HD2 ARG 72 1HD ARG 72 104.911 -24.634 -2.804 508 HD3 ARG 72 2HD ARG 72 106.419 -24.823 -3.696 509 HE ARG 72 HE ARG 72 106.645 -22.737 -1.769 510 HH11 ARG 72 1HH1 ARG 72 106.592 -26.240 -2.002 511 HH12 ARG 72 2HH1 ARG 72 107.534 -26.449 -0.564 512 HH21 ARG 72 1HH2 ARG 72 107.857 -23.071 0.074 513 HH22 ARG 72 2HH2 ARG 72 108.242 -24.676 0.594 514 H ILE 73 H ILE 73 104.720 -21.122 -6.528 515 HA ILE 73 HA ILE 73 102.071 -22.215 -7.283 516 HB ILE 73 HB ILE 73 103.876 -20.435 -8.949 517 HG12 ILE 73 1HG1 ILE 73 101.151 -19.813 -7.773 518 HG13 ILE 73 2HG1 ILE 73 102.662 -19.330 -7.003 519 HG21 ILE 73 1HG2 ILE 73 102.645 -21.927 -10.381 520 HG22 ILE 73 2HG2 ILE 73 101.800 -20.382 -10.419 521 HG23 ILE 73 3HG2 ILE 73 101.170 -21.707 -9.442 522 HD11 ILE 73 3HD1 ILE 73 101.593 -18.463 -9.694 523 HD12 ILE 73 1HD1 ILE 73 103.275 -18.220 -9.223 524 HD13 ILE 73 2HD1 ILE 73 101.982 -17.452 -8.303 525 H ASN 74 H ASN 74 102.132 -23.698 -9.129 526 HA ASN 74 HA ASN 74 103.917 -25.785 -8.870 527 HB2 ASN 74 1HB ASN 74 102.403 -24.917 -11.339 528 HB3 ASN 74 2HB ASN 74 103.174 -26.488 -11.136 529 HD21 ASN 74 1HD2 ASN 74 100.293 -26.077 -11.484 530 HD22 ASN 74 2HD2 ASN 74 99.542 -26.638 -10.069 531 H ASP 75 H ASP 75 104.205 -22.941 -10.955 532 HA ASP 75 HA ASP 75 106.666 -23.750 -12.178 533 HB2 ASP 75 1HB ASP 75 105.139 -22.010 -13.124 534 HB3 ASP 75 2HB ASP 75 105.583 -20.950 -11.787 535 H TRP 76 H TRP 76 108.770 -23.166 -11.622 536 HA TRP 76 HA TRP 76 109.471 -23.237 -8.945 537 HB2 TRP 76 1HB TRP 76 110.980 -22.135 -11.309 538 HB3 TRP 76 2HB TRP 76 111.691 -22.346 -9.722 539 HD1 TRP 76 HD1 TRP 76 110.942 -24.133 -12.890 540 HE1 TRP 76 HE1 TRP 76 111.606 -26.615 -12.689 541 HE3 TRP 76 HE3 TRP 76 111.746 -24.424 -7.856 542 HZ2 TRP 76 HZ2 TRP 76 112.378 -28.481 -10.657 543 HZ3 TRP 76 HZ3 TRP 76 112.443 -26.559 -6.816 544 HH2 TRP 76 HH2 TRP 76 112.761 -28.586 -8.206 545 H ALA 77 H ALA 77 108.786 -20.423 -10.955 546 HA ALA 77 HA ALA 77 109.891 -18.451 -9.266 547 HB1 ALA 77 1HB ALA 77 107.541 -18.216 -11.158 548 HB2 ALA 77 2HB ALA 77 109.238 -18.027 -11.605 549 HB3 ALA 77 3HB ALA 77 108.482 -16.877 -10.501 550 H SER 78 H SER 78 109.051 -17.220 -7.642 551 HA SER 78 HA SER 78 106.398 -17.989 -6.570 552 HB2 SER 78 1HB SER 78 108.849 -17.113 -5.016 553 HB3 SER 78 2HB SER 78 107.274 -17.501 -4.330 554 HG SER 78 HG SER 78 109.168 -19.165 -4.646 555 H ILE 79 H ILE 79 105.181 -16.238 -5.568 556 HA ILE 79 HA ILE 79 106.059 -13.558 -6.509 557 HB ILE 79 HB ILE 79 103.729 -13.075 -7.127 558 HG12 ILE 79 1HG1 ILE 79 103.200 -16.026 -6.683 559 HG13 ILE 79 2HG1 ILE 79 102.752 -14.786 -5.512 560 HG21 ILE 79 1HG2 ILE 79 105.223 -13.886 -8.865 561 HG22 ILE 79 2HG2 ILE 79 103.630 -14.600 -9.110 562 HG23 ILE 79 3HG2 ILE 79 104.924 -15.559 -8.390 563 HD11 ILE 79 3HD1 ILE 79 101.262 -13.732 -7.059 564 HD12 ILE 79 1HD1 ILE 79 100.918 -15.460 -7.143 565 HD13 ILE 79 2HD1 ILE 79 101.876 -14.689 -8.407 566 H TYR 80 H TYR 80 105.361 -11.785 -5.246 567 HA TYR 80 HA TYR 80 103.851 -12.394 -2.810 568 HB2 TYR 80 1HB TYR 80 105.486 -11.450 -1.337 569 HB3 TYR 80 2HB TYR 80 106.246 -12.724 -2.267 570 HD1 TYR 80 HD1 TYR 80 107.873 -12.163 -4.061 571 HD2 TYR 80 HD2 TYR 80 106.159 -9.151 -1.525 572 HE1 TYR 80 HE1 TYR 80 109.641 -10.571 -4.758 573 HE2 TYR 80 HE2 TYR 80 107.926 -7.557 -2.222 574 HH TYR 80 HH TYR 80 109.565 -7.601 -4.696 575 H GLY 81 H GLY 81 103.097 -10.493 -1.695 576 HA2 GLY 81 1HA GLY 81 103.229 -7.989 -3.284 577 HA3 GLY 81 2HA GLY 81 101.677 -8.596 -2.704 578 H VAL 82 H VAL 82 103.088 -6.066 -2.017 579 HA VAL 82 HA VAL 82 103.435 -6.485 0.887 580 HB VAL 82 HB VAL 82 105.398 -4.970 0.839 581 HG11 VAL 82 1HG1 VAL 82 106.905 -6.660 -0.491 582 HG12 VAL 82 2HG1 VAL 82 105.415 -7.593 -0.626 583 HG13 VAL 82 3HG1 VAL 82 106.069 -7.198 0.964 584 HG21 VAL 82 3HG2 VAL 82 105.290 -5.359 -2.166 585 HG22 VAL 82 1HG2 VAL 82 106.464 -4.403 -1.261 586 HG23 VAL 82 2HG2 VAL 82 104.780 -3.883 -1.345 587 H VAL 83 H VAL 83 102.961 -4.764 2.174 588 HA VAL 83 HA VAL 83 102.157 -2.225 0.888 589 HB VAL 83 HB VAL 83 100.785 -3.474 3.287 590 HG11 VAL 83 1HG1 VAL 83 100.669 -1.095 3.415 591 HG12 VAL 83 2HG1 VAL 83 99.121 -1.614 2.746 592 HG13 VAL 83 3HG1 VAL 83 100.360 -0.946 1.685 593 HG21 VAL 83 3HG2 VAL 83 98.827 -3.405 1.478 594 HG22 VAL 83 1HG2 VAL 83 99.922 -4.782 1.576 595 HG23 VAL 83 2HG2 VAL 83 100.178 -3.541 0.352 596 H GLY 84 H GLY 84 102.632 -0.342 2.226 597 HA2 GLY 84 1HA GLY 84 103.876 -0.725 4.808 598 HA3 GLY 84 2HA GLY 84 105.026 -0.318 3.542 599 H VAL 85 H VAL 85 105.128 1.405 5.373 600 HA VAL 85 HA VAL 85 103.442 3.704 4.566 601 HB VAL 85 HB VAL 85 104.396 3.089 7.378 602 HG11 VAL 85 1HG1 VAL 85 103.061 5.022 8.013 603 HG12 VAL 85 2HG1 VAL 85 102.510 5.231 6.352 604 HG13 VAL 85 3HG1 VAL 85 104.203 5.511 6.761 605 HG21 VAL 85 3HG2 VAL 85 101.612 2.972 6.173 606 HG22 VAL 85 1HG2 VAL 85 102.010 2.709 7.870 607 HG23 VAL 85 2HG2 VAL 85 102.579 1.575 6.645 608 H GLY 86 H GLY 86 104.539 5.594 4.239 609 HA2 GLY 86 1HA GLY 86 107.477 5.516 4.647 610 HA3 GLY 86 2HA GLY 86 106.714 6.241 3.237 611 H TYR 87 H TYR 87 108.443 7.301 5.501 612 HA TYR 87 HA TYR 87 106.686 9.554 6.293 613 HB2 TYR 87 1HB TYR 87 109.008 8.421 7.857 614 HB3 TYR 87 2HB TYR 87 107.951 9.729 8.352 615 HD1 TYR 87 HD1 TYR 87 108.292 6.097 7.920 616 HD2 TYR 87 HD2 TYR 87 105.678 9.275 9.149 617 HE1 TYR 87 HE1 TYR 87 106.795 4.445 9.005 618 HE2 TYR 87 HE2 TYR 87 104.180 7.622 10.235 619 HH TYR 87 HH TYR 87 105.014 4.164 10.317 620 H GLY 88 H GLY 88 107.378 11.502 5.712 621 HA2 GLY 88 1HA GLY 88 110.186 11.835 4.828 622 HA3 GLY 88 2HA GLY 88 108.827 12.759 4.190 623 H LYS 89 H LYS 89 111.430 13.265 5.897 624 HA LYS 89 HA LYS 89 110.156 15.182 7.740 625 HB2 LYS 89 1HB LYS 89 110.763 13.117 9.001 626 HB3 LYS 89 2HB LYS 89 112.438 13.344 8.504 627 HG2 LYS 89 1HG LYS 89 112.296 14.319 10.667 628 HG3 LYS 89 2HG LYS 89 112.269 15.682 9.550 629 HD2 LYS 89 1HD LYS 89 109.834 15.815 9.712 630 HD3 LYS 89 2HD LYS 89 109.803 14.386 10.747 631 HE2 LYS 89 1HE LYS 89 109.655 16.327 12.177 632 HE3 LYS 89 2HE LYS 89 111.265 15.637 12.378 633 HZ1 LYS 89 3HZ LYS 89 112.242 17.334 11.228 634 HZ2 LYS 89 1HZ LYS 89 110.960 18.172 11.956 635 HZ3 LYS 89 2HZ LYS 89 110.845 17.695 10.329 636 H PHE 90 H PHE 90 111.235 17.099 7.959 637 HA PHE 90 HA PHE 90 113.786 17.394 6.474 638 HB2 PHE 90 1HB PHE 90 113.084 19.673 5.946 639 HB3 PHE 90 2HB PHE 90 111.945 18.498 5.316 640 HD1 PHE 90 HD2 PHE 90 109.693 18.299 6.257 641 HD2 PHE 90 HD1 PHE 90 112.504 21.169 7.775 642 HE1 PHE 90 HE2 PHE 90 107.856 19.468 7.444 643 HE2 PHE 90 HE1 PHE 90 110.667 22.339 8.964 644 HZ PHE 90 HZ PHE 90 108.343 21.488 8.798 645 H GLN 91 H GLN 91 115.240 19.035 7.303 646 HA GLN 91 HA GLN 91 114.976 19.339 10.241 647 HB2 GLN 91 1HB GLN 91 117.497 19.179 8.575 648 HB3 GLN 91 2HB GLN 91 117.412 19.294 10.331 649 HG2 GLN 91 1HG GLN 91 116.330 17.017 8.644 650 HG3 GLN 91 2HG GLN 91 117.783 16.966 9.636 651 HE21 GLN 91 1HE2 GLN 91 114.800 15.748 9.715 652 HE22 GLN 91 2HE2 GLN 91 114.441 15.861 11.370 653 H THR 92 H THR 92 115.005 21.294 11.089 654 HA THR 92 HA THR 92 116.210 23.531 9.598 655 HB THR 92 HB THR 92 114.341 24.990 10.204 656 HG1 THR 92 HG1 THR 92 112.803 24.335 11.496 657 HG21 THR 92 3HG2 THR 92 113.594 22.436 8.768 658 HG22 THR 92 1HG2 THR 92 114.131 23.954 8.052 659 HG23 THR 92 2HG2 THR 92 112.545 23.852 8.819 660 H THR 93 H THR 93 116.395 25.501 11.155 661 HA THR 93 HA THR 93 117.364 24.495 13.751 662 HB THR 93 HB THR 93 117.760 27.222 12.493 663 HG1 THR 93 HG1 THR 93 119.386 26.380 11.473 664 HG21 THR 93 3HG2 THR 93 119.275 25.842 14.723 665 HG22 THR 93 1HG2 THR 93 117.984 27.013 14.996 666 HG23 THR 93 2HG2 THR 93 119.465 27.508 14.176 667 H GLU 94 H GLU 94 116.296 24.896 15.570 668 HA GLU 94 HA GLU 94 114.588 27.014 16.206 669 HB2 GLU 94 1HB GLU 94 113.266 26.097 14.246 670 HB3 GLU 94 2HB GLU 94 113.052 24.615 15.174 671 HG2 GLU 94 1HG GLU 94 111.991 25.934 16.990 672 HG3 GLU 94 2HG GLU 94 112.157 27.386 16.012 673 H TYR 95 H TYR 95 113.704 26.731 18.298 674 HA TYR 95 HA TYR 95 114.711 24.462 19.789 675 HB2 TYR 95 1HB TYR 95 112.988 26.827 20.544 676 HB3 TYR 95 2HB TYR 95 113.425 25.563 21.679 677 HD1 TYR 95 HD1 TYR 95 115.843 25.219 22.280 678 HD2 TYR 95 HD2 TYR 95 114.499 28.567 19.950 679 HE1 TYR 95 HE1 TYR 95 117.966 26.406 22.761 680 HE2 TYR 95 HE2 TYR 95 116.621 29.754 20.431 681 HH TYR 95 HH TYR 95 118.396 29.701 22.201 682 HA PRO 96 HA PRO 96 111.531 21.840 18.709 683 HB2 PRO 96 1HB PRO 96 111.116 20.259 20.933 684 HB3 PRO 96 2HB PRO 96 112.495 20.099 19.829 685 HG2 PRO 96 1HG PRO 96 112.347 21.428 22.480 686 HG3 PRO 96 2HG PRO 96 113.649 20.457 21.771 687 HD2 PRO 96 1HD PRO 96 113.760 23.171 21.863 688 HD3 PRO 96 2HD PRO 96 114.504 22.231 20.549 689 H THR 97 H THR 97 109.434 22.021 18.417 690 HA THR 97 HA THR 97 107.688 22.858 20.654 691 HB THR 97 HB THR 97 107.214 23.248 17.686 692 HG1 THR 97 HG1 THR 97 108.645 24.763 18.099 693 HG21 THR 97 3HG2 THR 97 105.400 24.758 18.546 694 HG22 THR 97 1HG2 THR 97 105.732 24.154 20.169 695 HG23 THR 97 2HG2 THR 97 105.141 23.054 18.923 696 H TYR 98 H TYR 98 105.680 21.722 20.867 697 HA TYR 98 HA TYR 98 105.667 19.093 19.539 698 HB2 TYR 98 1HB TYR 98 104.097 18.417 21.230 699 HB3 TYR 98 2HB TYR 98 105.465 19.194 22.002 700 HD1 TYR 98 HD1 TYR 98 105.225 21.479 22.964 701 HD2 TYR 98 HD2 TYR 98 101.879 19.324 21.348 702 HE1 TYR 98 HE1 TYR 98 103.670 23.023 24.124 703 HE2 TYR 98 HE2 TYR 98 100.324 20.868 22.509 704 HH TYR 98 HH TYR 98 101.554 23.521 24.553 705 H LYS 99 H LYS 99 104.451 18.787 17.818 706 HA LYS 99 HA LYS 99 102.100 20.535 17.373 707 HB2 LYS 99 1HB LYS 99 103.894 19.138 15.375 708 HB3 LYS 99 2HB LYS 99 102.436 20.040 14.961 709 HG2 LYS 99 1HG LYS 99 103.421 22.058 16.050 710 HG3 LYS 99 2HG LYS 99 104.905 21.147 16.329 711 HD2 LYS 99 1HD LYS 99 105.072 20.748 13.868 712 HD3 LYS 99 2HD LYS 99 103.664 21.786 13.638 713 HE2 LYS 99 1HE LYS 99 104.811 23.710 14.400 714 HE3 LYS 99 2HE LYS 99 106.093 22.754 15.143 715 HZ1 LYS 99 3HZ LYS 99 105.561 22.922 12.226 716 HZ2 LYS 99 1HZ LYS 99 106.826 22.066 12.965 717 HZ3 LYS 99 2HZ LYS 99 106.789 23.762 13.046 718 H HIS 100 H HIS 100 100.156 19.602 16.749 719 HA HIS 100 HA HIS 100 99.583 16.930 17.445 720 HB2 HIS 100 1HB HIS 100 97.886 18.729 17.214 721 HB3 HIS 100 2HB HIS 100 98.125 18.701 15.477 722 HD1 HIS 100 HD1 HIS 100 97.205 16.196 18.213 723 HD2 HIS 100 HD2 HIS 100 96.293 17.065 14.239 724 HE1 HIS 100 HE1 HIS 100 95.415 14.549 17.514 725 H ASP 101 H ASP 101 100.230 18.457 14.311 726 HA ASP 101 HA ASP 101 101.175 15.866 13.286 727 HB2 ASP 101 1HB ASP 101 99.257 17.720 11.850 728 HB3 ASP 101 2HB ASP 101 100.065 16.341 11.109 729 H THR 102 H THR 102 102.597 16.128 11.388 730 HA THR 102 HA THR 102 103.482 18.664 10.496 731 HB THR 102 HB THR 102 104.392 18.888 12.750 732 HG1 THR 102 HG1 THR 102 106.106 19.704 11.885 733 HG21 THR 102 3HG2 THR 102 104.535 16.377 13.121 734 HG22 THR 102 1HG2 THR 102 105.924 17.302 13.691 735 HG23 THR 102 2HG2 THR 102 106.025 16.405 12.176 736 H SER 103 H SER 103 104.372 15.296 11.121 737 HA SER 103 HA SER 103 106.298 15.178 8.993 738 HB2 SER 103 1HB SER 103 106.381 13.676 10.970 739 HB3 SER 103 2HB SER 103 104.884 12.921 10.433 740 HG SER 103 HG SER 103 106.737 11.780 9.715 741 H ASP 104 H ASP 104 106.105 14.061 7.010 742 HA ASP 104 HA ASP 104 103.377 14.112 5.917 743 HB2 ASP 104 1HB ASP 104 105.195 15.317 4.721 744 HB3 ASP 104 2HB ASP 104 106.028 13.781 4.493 745 H TYR 105 H TYR 105 102.260 12.283 5.614 746 HA TYR 105 HA TYR 105 103.719 9.708 5.771 747 HB2 TYR 105 1HB TYR 105 100.831 10.259 6.449 748 HB3 TYR 105 2HB TYR 105 101.705 8.760 6.703 749 HD1 TYR 105 HD1 TYR 105 101.155 12.194 7.889 750 HD2 TYR 105 HD2 TYR 105 103.307 8.534 8.539 751 HE1 TYR 105 HE1 TYR 105 101.801 12.976 10.152 752 HE2 TYR 105 HE2 TYR 105 103.954 9.317 10.803 753 HH TYR 105 HH TYR 105 102.766 12.419 12.081 754 H GLY 106 H GLY 106 103.449 8.223 4.185 755 HA2 GLY 106 1HA GLY 106 101.254 8.598 2.247 756 HA3 GLY 106 2HA GLY 106 102.906 8.417 1.664 757 H PHE 107 H PHE 107 100.842 6.660 0.948 758 HA PHE 107 HA PHE 107 101.514 4.182 2.446 759 HB2 PHE 107 1HB PHE 107 99.064 4.829 0.800 760 HB3 PHE 107 2HB PHE 107 99.389 3.286 1.568 761 HD1 PHE 107 HD1 PHE 107 99.353 3.088 4.046 762 HD2 PHE 107 HD2 PHE 107 98.268 6.726 2.037 763 HE1 PHE 107 HE1 PHE 107 98.272 3.912 6.121 764 HE2 PHE 107 HE2 PHE 107 97.186 7.550 4.112 765 HZ PHE 107 HZ PHE 107 97.188 6.142 6.154 766 H SER 108 H SER 108 102.177 2.354 1.291 767 HA SER 108 HA SER 108 102.527 2.712 -1.634 768 HB2 SER 108 1HB SER 108 104.659 3.155 -0.438 769 HB3 SER 108 2HB SER 108 104.570 1.544 0.266 770 HG SER 108 HG SER 108 105.790 1.932 -1.820 771 H TYR 109 H TYR 109 102.137 0.976 -2.872 772 HA TYR 109 HA TYR 109 101.809 -1.675 -1.616 773 HB2 TYR 109 1HB TYR 109 99.895 -0.487 -3.632 774 HB3 TYR 109 2HB TYR 109 99.773 -2.062 -2.874 775 HD1 TYR 109 HD2 TYR 109 99.333 1.559 -2.439 776 HD2 TYR 109 HD1 TYR 109 99.010 -2.287 -0.558 777 HE1 TYR 109 HE2 TYR 109 97.980 2.563 -0.620 778 HE2 TYR 109 HE1 TYR 109 97.660 -1.284 1.264 779 HH TYR 109 HH TYR 109 96.166 0.759 1.530 780 H GLY 110 H GLY 110 102.535 -3.385 -2.949 781 HA2 GLY 110 1HA GLY 110 102.795 -3.078 -5.789 782 HA3 GLY 110 2HA GLY 110 104.350 -2.908 -4.985 783 H ALA 111 H ALA 111 104.473 -4.857 -6.603 784 HA ALA 111 HA ALA 111 104.342 -7.269 -4.936 785 HB1 ALA 111 1HB ALA 111 102.306 -7.146 -6.471 786 HB2 ALA 111 2HB ALA 111 103.295 -8.599 -6.612 787 HB3 ALA 111 3HB ALA 111 103.432 -7.319 -7.817 788 H GLY 112 H GLY 112 105.753 -9.001 -5.774 789 HA2 GLY 112 1HA GLY 112 107.795 -8.099 -7.682 790 HA3 GLY 112 2HA GLY 112 108.319 -8.502 -6.051 791 H LEU 113 H LEU 113 109.204 -9.796 -8.398 792 HA LEU 113 HA LEU 113 108.165 -12.532 -7.953 793 HB2 LEU 113 1HB LEU 113 107.532 -11.517 -10.175 794 HB3 LEU 113 2HB LEU 113 109.247 -11.453 -10.566 795 HG LEU 113 HG LEU 113 108.151 -14.069 -9.600 796 HD11 LEU 113 1HD1 LEU 113 107.640 -12.899 -12.347 797 HD12 LEU 113 2HD1 LEU 113 106.441 -13.487 -11.196 798 HD13 LEU 113 3HD1 LEU 113 107.534 -14.623 -11.988 799 HD21 LEU 113 3HD2 LEU 113 109.735 -14.727 -11.607 800 HD22 LEU 113 1HD2 LEU 113 110.437 -14.200 -10.081 801 HD23 LEU 113 2HD2 LEU 113 110.321 -13.073 -11.429 802 H GLN 114 H GLN 114 109.676 -14.071 -7.569 803 HA GLN 114 HA GLN 114 112.509 -13.214 -7.548 804 HB2 GLN 114 1HB GLN 114 111.482 -13.807 -5.347 805 HB3 GLN 114 2HB GLN 114 111.194 -15.433 -5.962 806 HG2 GLN 114 1HG GLN 114 113.247 -15.584 -4.782 807 HG3 GLN 114 2HG GLN 114 113.708 -15.509 -6.481 808 HE21 GLN 114 1HE2 GLN 114 115.421 -14.096 -6.813 809 HE22 GLN 114 2HE2 GLN 114 115.701 -12.676 -5.926 810 H PHE 115 H PHE 115 113.904 -14.236 -8.861 811 HA PHE 115 HA PHE 115 113.086 -16.825 -10.057 812 HB2 PHE 115 1HB PHE 115 112.998 -14.910 -11.656 813 HB3 PHE 115 2HB PHE 115 114.706 -14.637 -11.366 814 HD1 PHE 115 HD1 PHE 115 112.232 -17.073 -12.698 815 HD2 PHE 115 HD2 PHE 115 116.364 -15.916 -12.499 816 HE1 PHE 115 HE1 PHE 115 112.776 -18.712 -14.479 817 HE2 PHE 115 HE2 PHE 115 116.909 -17.555 -14.277 818 HZ PHE 115 HZ PHE 115 115.115 -18.953 -15.268 819 H ASN 116 H ASN 116 114.673 -18.402 -10.197 820 HA ASN 116 HA ASN 116 117.213 -17.777 -8.797 821 HB2 ASN 116 1HB ASN 116 117.137 -20.115 -7.957 822 HB3 ASN 116 2HB ASN 116 115.801 -19.127 -7.370 823 HD21 ASN 116 1HD2 ASN 116 116.554 -22.070 -8.931 824 HD22 ASN 116 2HD2 ASN 116 114.994 -22.446 -9.482 825 HA PRO 117 HA PRO 117 118.389 -19.392 -12.995 826 HB2 PRO 117 1HB PRO 117 120.747 -17.663 -12.502 827 HB3 PRO 117 2HB PRO 117 119.697 -17.760 -13.927 828 HG2 PRO 117 1HG PRO 117 119.638 -15.677 -12.256 829 HG3 PRO 117 2HG PRO 117 118.186 -16.268 -13.087 830 HD2 PRO 117 1HD PRO 117 119.005 -16.658 -10.231 831 HD3 PRO 117 2HD PRO 117 117.382 -16.415 -10.916 832 H MET 118 H MET 118 120.366 -18.731 -10.130 833 HA MET 118 HA MET 118 121.534 -21.443 -10.357 834 HB2 MET 118 1HB MET 118 122.876 -18.895 -9.418 835 HB3 MET 118 2HB MET 118 123.573 -20.508 -9.265 836 HG2 MET 118 1HG MET 118 123.400 -20.785 -11.735 837 HG3 MET 118 2HG MET 118 122.808 -19.127 -11.853 838 HE1 MET 118 3HE MET 118 124.420 -18.786 -13.528 839 HE2 MET 118 1HE MET 118 125.632 -20.071 -13.451 840 HE3 MET 118 2HE MET 118 126.122 -18.384 -13.306 841 H GLU 119 H GLU 119 122.103 -22.408 -8.284 842 HA GLU 119 HA GLU 119 120.000 -22.223 -6.420 843 HB2 GLU 119 1HB GLU 119 122.754 -23.444 -6.132 844 HB3 GLU 119 2HB GLU 119 121.418 -23.699 -5.009 845 HG2 GLU 119 1HG GLU 119 120.046 -24.586 -6.885 846 HG3 GLU 119 2HG GLU 119 121.429 -24.403 -7.956 847 H ASN 120 H ASN 120 123.226 -20.773 -6.458 848 HA ASN 120 HA ASN 120 122.757 -19.611 -3.805 849 HB2 ASN 120 1HB ASN 120 125.105 -19.040 -3.813 850 HB3 ASN 120 2HB ASN 120 124.904 -20.734 -4.248 851 HD21 ASN 120 1HD2 ASN 120 127.229 -19.120 -4.963 852 HD22 ASN 120 2HD2 ASN 120 127.267 -19.023 -6.658 853 H VAL 121 H VAL 121 121.939 -18.640 -6.844 854 HA VAL 121 HA VAL 121 122.204 -15.798 -6.072 855 HB VAL 121 HB VAL 121 122.597 -16.885 -8.873 856 HG11 VAL 121 1HG1 VAL 121 121.558 -14.642 -8.796 857 HG12 VAL 121 2HG1 VAL 121 123.212 -14.555 -9.401 858 HG13 VAL 121 3HG1 VAL 121 122.855 -14.081 -7.741 859 HG21 VAL 121 3HG2 VAL 121 124.619 -15.554 -7.050 860 HG22 VAL 121 1HG2 VAL 121 124.922 -16.315 -8.612 861 HG23 VAL 121 2HG2 VAL 121 124.482 -17.303 -7.220 862 H ALA 122 H ALA 122 120.366 -14.665 -6.206 863 HA ALA 122 HA ALA 122 118.234 -15.595 -8.012 864 HB1 ALA 122 1HB ALA 122 116.574 -15.608 -6.359 865 HB2 ALA 122 2HB ALA 122 117.556 -14.673 -5.231 866 HB3 ALA 122 3HB ALA 122 117.942 -16.366 -5.544 867 H LEU 123 H LEU 123 116.755 -13.938 -8.631 868 HA LEU 123 HA LEU 123 117.730 -11.185 -8.117 869 HB2 LEU 123 1HB LEU 123 116.935 -12.543 -10.681 870 HB3 LEU 123 2HB LEU 123 116.700 -10.810 -10.504 871 HG LEU 123 HG LEU 123 118.855 -11.386 -11.598 872 HD11 LEU 123 1HD1 LEU 123 119.503 -10.221 -8.905 873 HD12 LEU 123 2HD1 LEU 123 118.442 -9.360 -10.021 874 HD13 LEU 123 3HD1 LEU 123 120.097 -9.744 -10.496 875 HD21 LEU 123 3HD2 LEU 123 119.927 -12.341 -8.966 876 HD22 LEU 123 1HD2 LEU 123 120.527 -12.647 -10.597 877 HD23 LEU 123 2HD2 LEU 123 119.090 -13.487 -10.013 878 H ASP 124 H ASP 124 116.154 -9.600 -7.833 879 HA ASP 124 HA ASP 124 113.352 -10.570 -7.720 880 HB2 ASP 124 1HB ASP 124 113.051 -9.223 -5.678 881 HB3 ASP 124 2HB ASP 124 114.261 -10.484 -5.447 882 H PHE 125 H PHE 125 111.997 -9.367 -8.852 883 HA PHE 125 HA PHE 125 112.692 -6.527 -9.378 884 HB2 PHE 125 1HB PHE 125 111.242 -8.476 -11.177 885 HB3 PHE 125 2HB PHE 125 111.441 -6.764 -11.502 886 HD1 PHE 125 HD1 PHE 125 113.096 -10.043 -11.372 887 HD2 PHE 125 HD2 PHE 125 113.612 -5.854 -12.174 888 HE1 PHE 125 HE1 PHE 125 115.265 -10.521 -12.474 889 HE2 PHE 125 HE2 PHE 125 115.782 -6.333 -13.275 890 HZ PHE 125 HZ PHE 125 116.608 -8.667 -13.426 891 H SER 126 H SER 126 111.148 -5.060 -8.819 892 HA SER 126 HA SER 126 108.413 -6.006 -8.318 893 HB2 SER 126 1HB SER 126 109.636 -6.195 -6.168 894 HB3 SER 126 2HB SER 126 110.032 -4.484 -6.266 895 HG SER 126 HG SER 126 107.637 -5.756 -5.685 896 H TYR 127 H TYR 127 106.851 -4.503 -8.633 897 HA TYR 127 HA TYR 127 107.709 -1.756 -9.347 898 HB2 TYR 127 1HB TYR 127 106.712 -3.050 -11.210 899 HB3 TYR 127 2HB TYR 127 105.264 -3.289 -10.250 900 HD1 TYR 127 HD1 TYR 127 107.320 -0.811 -12.069 901 HD2 TYR 127 HD2 TYR 127 103.630 -1.532 -9.991 902 HE1 TYR 127 HE1 TYR 127 106.415 1.332 -12.930 903 HE2 TYR 127 HE2 TYR 127 102.726 0.610 -10.852 904 HH TYR 127 HH TYR 127 104.397 3.014 -11.912 905 H GLU 128 H GLU 128 107.058 -0.207 -7.987 906 HA GLU 128 HA GLU 128 104.795 -0.788 -6.159 907 HB2 GLU 128 1HB GLU 128 107.392 0.633 -5.529 908 HB3 GLU 128 2HB GLU 128 106.026 0.470 -4.424 909 HG2 GLU 128 1HG GLU 128 106.210 -2.006 -4.612 910 HG3 GLU 128 2HG GLU 128 107.627 -1.803 -5.633 911 H GLN 129 H GLN 129 103.310 0.766 -5.887 912 HA GLN 129 HA GLN 129 103.814 3.428 -7.090 913 HB2 GLN 129 1HB GLN 129 101.210 1.905 -6.792 914 HB3 GLN 129 2HB GLN 129 101.338 3.574 -7.347 915 HG2 GLN 129 1HG GLN 129 102.702 2.873 -9.250 916 HG3 GLN 129 2HG GLN 129 102.679 1.206 -8.680 917 HE21 GLN 129 1HE2 GLN 129 101.652 2.001 -11.268 918 HE22 GLN 129 2HE2 GLN 129 99.980 1.713 -11.267 919 H SER 130 H SER 130 103.386 5.211 -5.810 920 HA SER 130 HA SER 130 102.394 4.687 -3.071 921 HB2 SER 130 1HB SER 130 104.876 4.790 -3.072 922 HB3 SER 130 2HB SER 130 104.786 6.400 -3.780 923 HG SER 130 HG SER 130 104.320 5.547 -1.204 924 H ARG 131 H ARG 131 101.126 6.212 -2.208 925 HA ARG 131 HA ARG 131 100.605 8.660 -3.797 926 HB2 ARG 131 1HB ARG 131 98.675 7.085 -3.585 927 HB3 ARG 131 2HB ARG 131 98.759 7.276 -1.834 928 HG2 ARG 131 1HG ARG 131 98.428 9.722 -2.103 929 HG3 ARG 131 2HG ARG 131 98.275 9.493 -3.845 930 HD2 ARG 131 1HD ARG 131 96.356 7.949 -3.431 931 HD3 ARG 131 2HD ARG 131 96.473 8.316 -1.712 932 HE ARG 131 HE ARG 131 96.216 10.655 -3.393 933 HH11 ARG 131 1HH1 ARG 131 94.429 8.194 -1.640 934 HH12 ARG 131 2HH1 ARG 131 93.006 9.173 -1.519 935 HH21 ARG 131 1HH2 ARG 131 94.355 11.868 -3.205 936 HH22 ARG 131 2HH2 ARG 131 92.966 11.227 -2.394 937 H ILE 132 H ILE 132 101.323 10.472 -2.893 938 HA ILE 132 HA ILE 132 101.618 10.607 0.045 939 HB ILE 132 HB ILE 132 103.633 11.620 -1.987 940 HG12 ILE 132 1HG1 ILE 132 103.903 9.389 0.050 941 HG13 ILE 132 2HG1 ILE 132 103.609 9.127 -1.670 942 HG21 ILE 132 1HG2 ILE 132 104.971 12.196 -0.013 943 HG22 ILE 132 2HG2 ILE 132 103.700 11.584 1.046 944 HG23 ILE 132 3HG2 ILE 132 103.410 13.014 0.056 945 HD11 ILE 132 3HD1 ILE 132 106.055 10.257 -0.330 946 HD12 ILE 132 1HD1 ILE 132 105.705 10.641 -2.016 947 HD13 ILE 132 2HD1 ILE 132 105.945 8.964 -1.524 948 H ARG 133 H ARG 133 99.920 11.954 0.375 949 HA ARG 133 HA ARG 133 98.128 13.237 -0.521 950 HB2 ARG 133 1HB ARG 133 100.300 15.061 0.504 951 HB3 ARG 133 2HB ARG 133 98.615 15.538 0.289 952 HG2 ARG 133 1HG ARG 133 97.910 13.737 1.827 953 HG3 ARG 133 2HG ARG 133 99.599 13.279 2.058 954 HD2 ARG 133 1HD ARG 133 98.981 14.695 3.907 955 HD3 ARG 133 2HD ARG 133 100.043 15.626 2.858 956 HE ARG 133 HE ARG 133 98.230 16.981 2.263 957 HH11 ARG 133 1HH1 ARG 133 97.102 14.294 4.223 958 HH12 ARG 133 2HH1 ARG 133 95.541 15.001 4.471 959 HH21 ARG 133 1HH2 ARG 133 96.203 17.840 2.619 960 HH22 ARG 133 2HH2 ARG 133 95.040 16.984 3.574 961 H SER 134 H SER 134 98.010 12.999 -2.781 962 HA SER 134 HA SER 134 97.427 14.078 -4.714 963 HB2 SER 134 1HB SER 134 97.422 16.382 -4.913 964 HB3 SER 134 2HB SER 134 97.352 16.158 -3.171 965 HG SER 134 HG SER 134 98.990 17.545 -3.397 966 H VAL 135 H VAL 135 100.631 13.529 -3.716 967 HA VAL 135 HA VAL 135 101.653 14.084 -6.426 968 HB VAL 135 HB VAL 135 103.173 13.324 -3.916 969 HG11 VAL 135 1HG1 VAL 135 104.106 14.361 -6.611 970 HG12 VAL 135 2HG1 VAL 135 104.300 12.709 -6.028 971 HG13 VAL 135 3HG1 VAL 135 105.141 14.032 -5.222 972 HG21 VAL 135 3HG2 VAL 135 102.260 15.515 -3.567 973 HG22 VAL 135 1HG2 VAL 135 102.605 15.993 -5.230 974 HG23 VAL 135 2HG2 VAL 135 103.928 15.756 -4.088 975 H ASP 136 H ASP 136 102.197 12.458 -7.775 976 HA ASP 136 HA ASP 136 101.616 9.709 -6.841 977 HB2 ASP 136 1HB ASP 136 100.254 10.584 -8.730 978 HB3 ASP 136 2HB ASP 136 101.732 10.773 -9.671 979 H VAL 137 H VAL 137 103.315 8.374 -6.536 980 HA VAL 137 HA VAL 137 105.842 8.993 -7.970 981 HB VAL 137 HB VAL 137 105.530 7.717 -5.240 982 HG11 VAL 137 1HG1 VAL 137 107.949 7.935 -5.113 983 HG12 VAL 137 2HG1 VAL 137 107.994 8.748 -6.677 984 HG13 VAL 137 3HG1 VAL 137 107.541 7.045 -6.581 985 HG21 VAL 137 3HG2 VAL 137 106.551 9.874 -4.449 986 HG22 VAL 137 1HG2 VAL 137 104.926 10.067 -5.106 987 HG23 VAL 137 2HG2 VAL 137 106.328 10.523 -6.073 988 H GLY 138 H GLY 138 106.708 7.426 -9.171 989 HA2 GLY 138 1HA GLY 138 105.696 4.654 -8.845 990 HA3 GLY 138 2HA GLY 138 106.074 5.359 -10.417 991 H THR 139 H THR 139 107.251 3.175 -8.394 992 HA THR 139 HA THR 139 110.083 3.982 -8.776 993 HB THR 139 HB THR 139 108.955 2.365 -6.480 994 HG1 THR 139 HG1 THR 139 108.323 4.351 -6.013 995 HG21 THR 139 3HG2 THR 139 111.686 3.340 -7.277 996 HG22 THR 139 1HG2 THR 139 111.202 1.747 -6.694 997 HG23 THR 139 2HG2 THR 139 111.295 3.105 -5.573 998 H TRP 140 H TRP 140 111.353 2.587 -9.789 999 HA TRP 140 HA TRP 140 110.443 -0.215 -10.121 1000 HB2 TRP 140 1HB TRP 140 110.651 1.031 -12.236 1001 HB3 TRP 140 2HB TRP 140 112.311 1.430 -11.839 1002 HD1 TRP 140 HD1 TRP 140 110.669 -2.030 -11.454 1003 HE1 TRP 140 HE1 TRP 140 111.940 -3.700 -12.949 1004 HE3 TRP 140 HE3 TRP 140 113.888 1.164 -13.801 1005 HZ2 TRP 140 HZ2 TRP 140 114.049 -3.683 -14.888 1006 HZ3 TRP 140 HZ3 TRP 140 115.513 0.314 -15.464 1007 HH2 TRP 140 HH2 TRP 140 115.598 -2.102 -16.011 1008 H ILE 141 H ILE 141 111.603 -1.680 -9.020 1009 HA ILE 141 HA ILE 141 114.343 -0.952 -8.156 1010 HB ILE 141 HB ILE 141 112.743 -0.672 -6.310 1011 HG12 ILE 141 1HG1 ILE 141 114.356 -3.187 -5.845 1012 HG13 ILE 141 2HG1 ILE 141 115.104 -1.595 -5.982 1013 HG21 ILE 141 1HG2 ILE 141 111.032 -2.262 -7.032 1014 HG22 ILE 141 2HG2 ILE 141 111.583 -2.671 -5.408 1015 HG23 ILE 141 3HG2 ILE 141 112.149 -3.605 -6.792 1016 HD11 ILE 141 3HD1 ILE 141 114.402 -2.526 -3.614 1017 HD12 ILE 141 1HD1 ILE 141 112.803 -1.956 -4.091 1018 HD13 ILE 141 2HD1 ILE 141 114.153 -0.825 -4.007 1019 H ALA 142 H ALA 142 115.866 -2.467 -8.346 1020 HA ALA 142 HA ALA 142 115.072 -5.279 -8.724 1021 HB1 ALA 142 1HB ALA 142 116.727 -5.495 -10.574 1022 HB2 ALA 142 2HB ALA 142 116.939 -3.744 -10.551 1023 HB3 ALA 142 3HB ALA 142 115.377 -4.437 -10.987 1024 H GLY 143 H GLY 143 116.505 -6.739 -7.814 1025 HA2 GLY 143 1HA GLY 143 119.118 -5.782 -6.902 1026 HA3 GLY 143 2HA GLY 143 117.971 -6.240 -5.650 1027 H VAL 144 H VAL 144 120.162 -7.603 -5.523 1028 HA VAL 144 HA VAL 144 119.503 -10.256 -6.599 1029 HB VAL 144 HB VAL 144 121.217 -9.298 -8.093 1030 HG11 VAL 144 1HG1 VAL 144 122.854 -9.078 -5.551 1031 HG12 VAL 144 2HG1 VAL 144 122.275 -7.734 -6.536 1032 HG13 VAL 144 3HG1 VAL 144 123.485 -8.844 -7.180 1033 HG21 VAL 144 3HG2 VAL 144 121.161 -11.768 -7.266 1034 HG22 VAL 144 1HG2 VAL 144 122.607 -11.327 -6.357 1035 HG23 VAL 144 2HG2 VAL 144 122.597 -11.198 -8.116 1036 H GLY 145 H GLY 145 120.216 -11.986 -5.261 1037 HA2 GLY 145 1HA GLY 145 121.561 -11.309 -2.754 1038 HA3 GLY 145 2HA GLY 145 119.908 -11.894 -2.621 1039 H TYR 146 H TYR 146 121.517 -13.390 -1.310 1040 HA TYR 146 HA TYR 146 121.965 -15.777 -2.977 1041 HB2 TYR 146 1HB TYR 146 124.083 -16.219 -1.944 1042 HB3 TYR 146 2HB TYR 146 124.124 -14.611 -2.634 1043 HD1 TYR 146 HD1 TYR 146 124.050 -12.611 -1.153 1044 HD2 TYR 146 HD2 TYR 146 124.287 -16.602 0.418 1045 HE1 TYR 146 HE1 TYR 146 124.756 -11.705 1.044 1046 HE2 TYR 146 HE2 TYR 146 124.994 -15.694 2.615 1047 HH TYR 146 HH TYR 146 125.718 -12.277 3.044 1048 H ARG 147 H ARG 147 121.524 -17.716 -1.981 1049 HA ARG 147 HA ARG 147 120.224 -17.518 0.669 1050 HB2 ARG 147 1HB ARG 147 118.831 -18.306 -1.249 1051 HB3 ARG 147 2HB ARG 147 119.922 -19.679 -1.429 1052 HG2 ARG 147 1HG ARG 147 119.416 -20.420 0.847 1053 HG3 ARG 147 2HG ARG 147 118.382 -19.013 1.097 1054 HD2 ARG 147 1HD ARG 147 116.948 -20.868 0.537 1055 HD3 ARG 147 2HD ARG 147 116.990 -19.790 -0.855 1056 HE ARG 147 HE ARG 147 119.019 -21.644 -1.250 1057 HH11 ARG 147 1HH1 ARG 147 115.526 -21.758 -0.914 1058 HH12 ARG 147 2HH1 ARG 147 115.379 -23.180 -1.893 1059 HH21 ARG 147 1HH2 ARG 147 118.766 -23.473 -2.502 1060 HH22 ARG 147 2HH2 ARG 147 117.191 -24.137 -2.780 1061 H PHE 148 H PHE 148 120.855 -18.805 2.332 1062 HA PHE 148 HA PHE 148 122.703 -21.005 1.929 1063 HB2 PHE 148 1HB PHE 148 124.169 -19.004 1.940 1064 HB3 PHE 148 2HB PHE 148 123.554 -18.589 3.528 1065 HD1 PHE 148 HD1 PHE 148 125.570 -21.024 1.603 1066 HD2 PHE 148 HD2 PHE 148 124.329 -19.725 5.506 1067 HE1 PHE 148 HE1 PHE 148 127.311 -22.459 2.634 1068 HE2 PHE 148 HE2 PHE 148 126.070 -21.159 6.536 1069 HZ PHE 148 HZ PHE 148 127.561 -22.525 5.101 Start of MODEL 19 1 H1 ALA 1 3H ALA 1 114.890 -22.400 10.128 2 H2 ALA 1 2H ALA 1 115.136 -21.288 8.866 3 H3 ALA 1 HT3 ALA 1 116.366 -21.571 10.005 4 HA ALA 1 HA ALA 1 116.701 -23.784 9.218 5 HB1 ALA 1 2HB ALA 1 114.393 -24.354 8.706 6 HB2 ALA 1 3HB ALA 1 115.363 -24.571 7.249 7 HB3 ALA 1 1HB ALA 1 114.341 -23.144 7.425 8 H THR 2 H THR 2 115.476 -21.610 6.662 9 HA THR 2 HA THR 2 118.258 -21.311 5.679 10 HB THR 2 HB THR 2 115.739 -21.394 3.999 11 HG1 THR 2 HG1 THR 2 116.119 -23.436 4.709 12 HG21 THR 2 3HG2 THR 2 117.516 -20.049 3.010 13 HG22 THR 2 1HG2 THR 2 117.399 -21.580 2.143 14 HG23 THR 2 2HG2 THR 2 118.692 -21.327 3.316 15 H SER 3 H SER 3 118.906 -19.278 5.090 16 HA SER 3 HA SER 3 116.944 -17.082 5.449 17 HB2 SER 3 1HB SER 3 119.859 -17.096 6.269 18 HB3 SER 3 2HB SER 3 118.751 -15.737 6.417 19 HG SER 3 HG SER 3 119.152 -17.489 8.216 20 H THR 4 H THR 4 117.116 -15.346 4.051 21 HA THR 4 HA THR 4 119.143 -15.545 1.903 22 HB THR 4 HB THR 4 117.478 -14.922 0.250 23 HG1 THR 4 HG1 THR 4 116.077 -13.715 1.448 24 HG21 THR 4 3HG2 THR 4 116.161 -16.966 0.213 25 HG22 THR 4 1HG2 THR 4 116.433 -17.211 1.939 26 HG23 THR 4 2HG2 THR 4 117.780 -17.337 0.807 27 H VAL 5 H VAL 5 120.128 -13.664 1.397 28 HA VAL 5 HA VAL 5 119.070 -11.184 2.641 29 HB VAL 5 HB VAL 5 121.075 -11.994 3.828 30 HG11 VAL 5 1HG1 VAL 5 122.560 -11.610 1.220 31 HG12 VAL 5 2HG1 VAL 5 122.019 -13.187 1.795 32 HG13 VAL 5 3HG1 VAL 5 123.190 -12.260 2.733 33 HG21 VAL 5 3HG2 VAL 5 120.666 -9.553 3.547 34 HG22 VAL 5 1HG2 VAL 5 121.658 -9.578 2.090 35 HG23 VAL 5 2HG2 VAL 5 122.384 -9.936 3.657 36 H THR 6 H THR 6 118.854 -9.475 1.293 37 HA THR 6 HA THR 6 120.063 -9.654 -1.396 38 HB THR 6 HB THR 6 118.022 -9.150 -2.508 39 HG1 THR 6 HG1 THR 6 117.115 -7.735 -1.080 40 HG21 THR 6 3HG2 THR 6 118.350 -11.556 -1.257 41 HG22 THR 6 1HG2 THR 6 117.027 -11.190 -2.363 42 HG23 THR 6 2HG2 THR 6 116.783 -11.058 -0.623 43 H GLY 7 H GLY 7 119.970 -7.630 -2.576 44 HA2 GLY 7 1HA GLY 7 119.183 -5.229 -1.116 45 HA3 GLY 7 2HA GLY 7 120.887 -5.333 -1.564 46 H GLY 8 H GLY 8 118.799 -3.461 -2.545 47 HA2 GLY 8 1HA GLY 8 119.399 -3.777 -5.376 48 HA3 GLY 8 2HA GLY 8 117.694 -3.893 -4.960 49 H TYR 9 H TYR 9 118.374 -1.986 -6.658 50 HA TYR 9 HA TYR 9 118.190 0.509 -5.084 51 HB2 TYR 9 1HB TYR 9 119.581 1.657 -6.663 52 HB3 TYR 9 2HB TYR 9 120.448 0.251 -6.081 53 HD1 TYR 9 HD1 TYR 9 120.760 -1.728 -7.560 54 HD2 TYR 9 HD2 TYR 9 118.949 1.906 -8.964 55 HE1 TYR 9 HE1 TYR 9 121.120 -2.454 -9.905 56 HE2 TYR 9 HE2 TYR 9 119.310 1.180 -11.308 57 HH TYR 9 HH TYR 9 121.325 -1.450 -12.127 58 H ALA 10 H ALA 10 116.752 2.026 -5.847 59 HA ALA 10 HA ALA 10 115.340 1.448 -8.366 60 HB1 ALA 10 1HB ALA 10 113.251 1.337 -7.428 61 HB2 ALA 10 2HB ALA 10 113.698 2.326 -6.037 62 HB3 ALA 10 3HB ALA 10 114.189 0.634 -6.111 63 H GLN 11 H GLN 11 114.557 3.217 -9.435 64 HA GLN 11 HA GLN 11 115.087 5.876 -8.242 65 HB2 GLN 11 1HB GLN 11 116.424 5.303 -10.292 66 HB3 GLN 11 2HB GLN 11 114.908 5.168 -11.182 67 HG2 GLN 11 1HG GLN 11 114.360 7.496 -10.654 68 HG3 GLN 11 2HG GLN 11 115.831 7.644 -9.698 69 HE21 GLN 11 1HE2 GLN 11 115.605 9.458 -11.730 70 HE22 GLN 11 2HE2 GLN 11 116.620 9.055 -13.029 71 H SER 12 H SER 12 113.401 7.407 -8.315 72 HA SER 12 HA SER 12 110.761 6.258 -9.053 73 HB2 SER 12 1HB SER 12 111.394 8.072 -6.715 74 HB3 SER 12 2HB SER 12 109.822 7.392 -7.119 75 HG SER 12 HG SER 12 112.132 5.812 -6.669 76 H ASP 13 H ASP 13 109.371 7.508 -10.131 77 HA ASP 13 HA ASP 13 110.251 10.197 -10.942 78 HB2 ASP 13 1HB ASP 13 109.636 8.569 -12.730 79 HB3 ASP 13 2HB ASP 13 108.012 8.479 -12.050 80 H ALA 14 H ALA 14 109.264 11.941 -10.090 81 HA ALA 14 HA ALA 14 106.915 11.472 -8.363 82 HB1 ALA 14 1HB ALA 14 107.674 13.205 -6.965 83 HB2 ALA 14 2HB ALA 14 108.763 13.843 -8.197 84 HB3 ALA 14 3HB ALA 14 109.143 12.324 -7.385 85 H GLN 15 H GLN 15 105.189 11.928 -9.519 86 HA GLN 15 HA GLN 15 105.064 14.201 -11.323 87 HB2 GLN 15 1HB GLN 15 102.953 12.235 -10.395 88 HB3 GLN 15 2HB GLN 15 102.680 13.504 -11.590 89 HG2 GLN 15 1HG GLN 15 104.396 12.550 -13.045 90 HG3 GLN 15 2HG GLN 15 104.770 11.324 -11.838 91 HE21 GLN 15 1HE2 GLN 15 103.915 10.617 -14.482 92 HE22 GLN 15 2HE2 GLN 15 102.387 9.886 -14.368 93 H GLY 16 H GLY 16 104.559 16.176 -10.723 94 HA2 GLY 16 1HA GLY 16 103.348 17.839 -9.524 95 HA3 GLY 16 2HA GLY 16 103.040 16.664 -8.255 96 H GLN 17 H GLN 17 106.101 15.976 -8.582 97 HA GLN 17 HA GLN 17 107.134 18.281 -7.041 98 HB2 GLN 17 1HB GLN 17 108.032 15.394 -6.908 99 HB3 GLN 17 2HB GLN 17 108.668 16.726 -5.948 100 HG2 GLN 17 1HG GLN 17 105.812 15.716 -5.896 101 HG3 GLN 17 2HG GLN 17 107.027 15.418 -4.658 102 HE21 GLN 17 1HE2 GLN 17 104.360 17.202 -5.012 103 HE22 GLN 17 2HE2 GLN 17 104.809 18.626 -4.206 104 H MET 18 H MET 18 109.659 18.297 -7.193 105 HA MET 18 HA MET 18 110.262 18.410 -10.058 106 HB2 MET 18 1HB MET 18 111.721 19.534 -7.658 107 HB3 MET 18 2HB MET 18 112.226 19.747 -9.335 108 HG2 MET 18 1HG MET 18 109.973 20.762 -9.810 109 HG3 MET 18 2HG MET 18 109.641 20.703 -8.079 110 HE1 MET 18 3HE MET 18 113.067 21.645 -10.092 111 HE2 MET 18 1HE MET 18 112.547 23.303 -10.415 112 HE3 MET 18 2HE MET 18 111.560 21.947 -10.954 113 H ASN 19 H ASN 19 112.152 17.591 -10.936 114 HA ASN 19 HA ASN 19 113.615 15.921 -11.418 115 HB2 ASN 19 1HB ASN 19 115.475 15.716 -9.822 116 HB3 ASN 19 2HB ASN 19 115.030 17.389 -10.123 117 HD21 ASN 19 1HD2 ASN 19 114.181 14.749 -7.801 118 HD22 ASN 19 2HD2 ASN 19 114.096 15.780 -6.456 119 H LYS 20 H LYS 20 114.853 13.930 -10.253 120 HA LYS 20 HA LYS 20 112.658 12.139 -9.427 121 HB2 LYS 20 1HB LYS 20 115.262 11.556 -10.856 122 HB3 LYS 20 2HB LYS 20 114.096 10.331 -10.354 123 HG2 LYS 20 1HG LYS 20 112.356 11.470 -11.725 124 HG3 LYS 20 2HG LYS 20 113.581 12.608 -12.288 125 HD2 LYS 20 1HD LYS 20 114.906 10.684 -13.168 126 HD3 LYS 20 2HD LYS 20 113.590 9.604 -12.705 127 HE2 LYS 20 1HE LYS 20 112.978 11.990 -14.420 128 HE3 LYS 20 2HE LYS 20 113.706 10.564 -15.159 129 HZ1 LYS 20 3HZ LYS 20 111.598 9.866 -15.287 130 HZ2 LYS 20 1HZ LYS 20 111.048 10.933 -14.090 131 HZ3 LYS 20 2HZ LYS 20 111.790 9.470 -13.646 132 H MET 21 H MET 21 113.326 10.288 -8.022 133 HA MET 21 HA MET 21 115.306 11.200 -6.003 134 HB2 MET 21 1HB MET 21 112.688 9.735 -5.598 135 HB3 MET 21 2HB MET 21 113.874 10.040 -4.328 136 HG2 MET 21 1HG MET 21 113.682 12.497 -4.835 137 HG3 MET 21 2HG MET 21 112.356 12.114 -5.932 138 HE1 MET 21 3HE MET 21 110.884 9.571 -4.043 139 HE2 MET 21 1HE MET 21 110.531 10.660 -5.389 140 HE3 MET 21 2HE MET 21 109.581 10.750 -3.908 141 H GLY 22 H GLY 22 116.332 9.441 -4.769 142 HA2 GLY 22 1HA GLY 22 116.319 6.835 -6.168 143 HA3 GLY 22 2HA GLY 22 117.846 7.682 -5.943 144 H GLY 23 H GLY 23 116.659 5.080 -4.836 145 HA2 GLY 23 1HA GLY 23 117.682 5.486 -2.135 146 HA3 GLY 23 2HA GLY 23 116.001 4.985 -2.245 147 H PHE 24 H PHE 24 117.696 3.412 -0.897 148 HA PHE 24 HA PHE 24 118.034 1.062 -2.665 149 HB2 PHE 24 1HB PHE 24 119.859 1.916 -0.412 150 HB3 PHE 24 2HB PHE 24 119.984 0.409 -1.300 151 HD1 PHE 24 HD1 PHE 24 120.669 0.420 -3.694 152 HD2 PHE 24 HD2 PHE 24 120.650 3.995 -1.310 153 HE1 PHE 24 HE1 PHE 24 122.100 1.551 -5.375 154 HE2 PHE 24 HE2 PHE 24 122.081 5.124 -2.991 155 HZ PHE 24 HZ PHE 24 122.806 3.902 -5.024 156 H ASN 25 H ASN 25 117.737 -1.001 -1.571 157 HA ASN 25 HA ASN 25 116.505 -0.853 1.085 158 HB2 ASN 25 1HB ASN 25 114.501 -2.025 0.403 159 HB3 ASN 25 2HB ASN 25 114.667 -0.550 -0.544 160 HD21 ASN 25 1HD2 ASN 25 113.137 -2.874 -1.408 161 HD22 ASN 25 2HD2 ASN 25 113.890 -3.480 -2.804 162 H LEU 26 H LEU 26 116.470 -2.771 2.243 163 HA LEU 26 HA LEU 26 117.856 -5.084 1.015 164 HB2 LEU 26 1HB LEU 26 118.042 -4.183 3.902 165 HB3 LEU 26 2HB LEU 26 118.872 -5.560 3.181 166 HG LEU 26 HG LEU 26 119.253 -2.673 2.331 167 HD11 LEU 26 1HD1 LEU 26 121.512 -2.982 3.383 168 HD12 LEU 26 2HD1 LEU 26 120.953 -4.524 4.030 169 HD13 LEU 26 3HD1 LEU 26 120.189 -3.022 4.549 170 HD21 LEU 26 3HD2 LEU 26 121.348 -3.847 1.281 171 HD22 LEU 26 1HD2 LEU 26 119.796 -3.975 0.453 172 HD23 LEU 26 2HD2 LEU 26 120.384 -5.317 1.434 173 H LYS 27 H LYS 27 116.935 -7.102 1.425 174 HA LYS 27 HA LYS 27 114.375 -7.054 2.931 175 HB2 LYS 27 1HB LYS 27 115.045 -8.606 0.424 176 HB3 LYS 27 2HB LYS 27 113.542 -8.732 1.333 177 HG2 LYS 27 1HG LYS 27 113.160 -6.295 0.978 178 HG3 LYS 27 2HG LYS 27 114.605 -6.244 -0.033 179 HD2 LYS 27 1HD LYS 27 113.581 -7.987 -1.505 180 HD3 LYS 27 2HD LYS 27 112.107 -7.885 -0.543 181 HE2 LYS 27 1HE LYS 27 111.622 -6.390 -2.261 182 HE3 LYS 27 2HE LYS 27 112.305 -5.306 -1.050 183 HZ1 LYS 27 3HZ LYS 27 114.012 -6.603 -3.080 184 HZ2 LYS 27 1HZ LYS 27 114.327 -5.211 -2.163 185 HZ3 LYS 27 2HZ LYS 27 113.187 -5.157 -3.422 186 H TYR 28 H TYR 28 113.934 -8.676 4.291 187 HA TYR 28 HA TYR 28 115.868 -10.915 4.502 188 HB2 TYR 28 1HB TYR 28 114.300 -9.590 6.722 189 HB3 TYR 28 2HB TYR 28 115.378 -10.961 6.906 190 HD1 TYR 28 HD1 TYR 28 117.848 -10.654 6.485 191 HD2 TYR 28 HD2 TYR 28 115.103 -7.355 6.683 192 HE1 TYR 28 HE1 TYR 28 119.746 -9.096 6.838 193 HE2 TYR 28 HE2 TYR 28 117.001 -5.798 7.036 194 HH TYR 28 HH TYR 28 119.931 -6.665 8.017 195 H ARG 29 H ARG 29 115.013 -12.971 4.656 196 HA ARG 29 HA ARG 29 112.062 -13.199 4.615 197 HB2 ARG 29 1HB ARG 29 114.015 -14.644 2.815 198 HB3 ARG 29 2HB ARG 29 112.281 -14.953 2.891 199 HG2 ARG 29 1HG ARG 29 111.859 -12.578 2.270 200 HG3 ARG 29 2HG ARG 29 113.599 -12.341 2.097 201 HD2 ARG 29 1HD ARG 29 113.603 -14.228 0.422 202 HD3 ARG 29 2HD ARG 29 111.844 -14.218 0.496 203 HE ARG 29 HE ARG 29 112.334 -11.657 -0.084 204 HH11 ARG 29 1HH1 ARG 29 113.728 -14.553 -1.496 205 HH12 ARG 29 2HH1 ARG 29 113.995 -13.796 -3.031 206 HH21 ARG 29 1HH2 ARG 29 112.703 -10.737 -2.082 207 HH22 ARG 29 2HH2 ARG 29 113.421 -11.663 -3.357 208 H TYR 30 H TYR 30 111.181 -14.876 5.700 209 HA TYR 30 HA TYR 30 113.023 -16.828 6.962 210 HB2 TYR 30 1HB TYR 30 112.116 -15.184 8.578 211 HB3 TYR 30 2HB TYR 30 110.490 -15.656 8.120 212 HD1 TYR 30 HD1 TYR 30 113.605 -16.755 9.791 213 HD2 TYR 30 HD2 TYR 30 109.493 -17.681 8.960 214 HE1 TYR 30 HE1 TYR 30 113.665 -18.555 11.496 215 HE2 TYR 30 HE2 TYR 30 109.554 -19.481 10.665 216 HH TYR 30 HH TYR 30 112.448 -20.647 12.002 217 H GLU 31 H GLU 31 112.485 -18.946 6.761 218 HA GLU 31 HA GLU 31 109.873 -19.597 5.520 219 HB2 GLU 31 1HB GLU 31 111.775 -19.665 3.892 220 HB3 GLU 31 2HB GLU 31 112.514 -20.924 4.882 221 HG2 GLU 31 1HG GLU 31 110.461 -22.303 4.610 222 HG3 GLU 31 2HG GLU 31 109.794 -21.066 3.555 223 H GLU 32 H GLU 32 108.896 -21.502 6.157 224 HA GLU 32 HA GLU 32 109.981 -22.733 8.595 225 HB2 GLU 32 1HB GLU 32 107.627 -21.875 8.566 226 HB3 GLU 32 2HB GLU 32 107.248 -23.094 7.349 227 HG2 GLU 32 1HG GLU 32 108.020 -24.862 8.919 228 HG3 GLU 32 2HG GLU 32 108.300 -23.629 10.141 229 H ASP 33 H ASP 33 110.410 -24.914 8.760 230 HA ASP 33 HA ASP 33 111.397 -26.100 6.379 231 HB2 ASP 33 1HB ASP 33 112.069 -27.953 7.802 232 HB3 ASP 33 2HB ASP 33 112.448 -26.418 8.577 233 H ASN 34 H ASN 34 108.552 -26.894 8.402 234 HA ASN 34 HA ASN 34 107.919 -29.078 6.520 235 HB2 ASN 34 1HB ASN 34 106.821 -28.486 9.270 236 HB3 ASN 34 2HB ASN 34 106.401 -29.878 8.275 237 HD21 ASN 34 1HD2 ASN 34 107.978 -29.563 10.944 238 HD22 ASN 34 2HD2 ASN 34 109.390 -30.464 10.666 239 H SER 35 H SER 35 106.856 -25.896 7.286 240 HA SER 35 HA SER 35 104.661 -26.235 5.386 241 HB2 SER 35 1HB SER 35 103.618 -26.575 7.607 242 HB3 SER 35 2HB SER 35 104.246 -25.016 8.129 243 HG SER 35 HG SER 35 102.273 -25.627 6.212 244 HA PRO 36 HA PRO 36 107.545 -22.608 5.060 245 HB2 PRO 36 1HB PRO 36 107.022 -22.843 2.150 246 HB3 PRO 36 2HB PRO 36 108.564 -22.764 3.022 247 HG2 PRO 36 1HG PRO 36 107.685 -25.023 1.913 248 HG3 PRO 36 2HG PRO 36 108.609 -25.014 3.427 249 HD2 PRO 36 1HD PRO 36 105.664 -25.395 3.026 250 HD3 PRO 36 2HD PRO 36 106.752 -26.166 4.203 251 H LEU 37 H LEU 37 106.918 -20.594 5.261 252 HA LEU 37 HA LEU 37 104.649 -19.563 3.670 253 HB2 LEU 37 1HB LEU 37 105.439 -18.719 6.476 254 HB3 LEU 37 2HB LEU 37 104.100 -18.068 5.530 255 HG LEU 37 HG LEU 37 104.356 -20.973 6.363 256 HD11 LEU 37 1HD1 LEU 37 103.967 -19.624 8.335 257 HD12 LEU 37 2HD1 LEU 37 102.436 -20.373 7.886 258 HD13 LEU 37 3HD1 LEU 37 102.734 -18.678 7.501 259 HD21 LEU 37 3HD2 LEU 37 101.919 -20.973 5.678 260 HD22 LEU 37 1HD2 LEU 37 103.047 -20.743 4.342 261 HD23 LEU 37 2HD2 LEU 37 102.175 -19.362 5.005 262 H GLY 38 H GLY 38 105.098 -17.605 2.570 263 HA2 GLY 38 1HA GLY 38 107.949 -16.897 2.606 264 HA3 GLY 38 2HA GLY 38 106.784 -16.462 1.355 265 H VAL 39 H VAL 39 108.525 -15.266 3.918 266 HA VAL 39 HA VAL 39 106.654 -12.977 4.217 267 HB VAL 39 HB VAL 39 108.661 -13.989 6.251 268 HG11 VAL 39 1HG1 VAL 39 107.445 -12.369 7.733 269 HG12 VAL 39 2HG1 VAL 39 106.570 -11.794 6.314 270 HG13 VAL 39 3HG1 VAL 39 108.318 -11.588 6.414 271 HG21 VAL 39 3HG2 VAL 39 106.704 -14.708 7.542 272 HG22 VAL 39 1HG2 VAL 39 106.704 -15.506 5.969 273 HG23 VAL 39 2HG2 VAL 39 105.628 -14.139 6.263 274 H ILE 40 H ILE 40 107.438 -11.085 3.532 275 HA ILE 40 HA ILE 40 110.386 -10.778 3.329 276 HB ILE 40 HB ILE 40 108.307 -9.662 1.424 277 HG12 ILE 40 1HG1 ILE 40 110.386 -11.825 0.966 278 HG13 ILE 40 2HG1 ILE 40 108.676 -12.145 1.252 279 HG21 ILE 40 1HG2 ILE 40 110.387 -8.288 1.792 280 HG22 ILE 40 2HG2 ILE 40 110.208 -8.879 0.140 281 HG23 ILE 40 3HG2 ILE 40 111.334 -9.670 1.242 282 HD11 ILE 40 3HD1 ILE 40 108.940 -12.144 -1.120 283 HD12 ILE 40 1HD1 ILE 40 109.923 -10.680 -1.079 284 HD13 ILE 40 2HD1 ILE 40 108.199 -10.593 -0.722 285 H GLY 41 H GLY 41 111.150 -9.133 4.463 286 HA2 GLY 41 1HA GLY 41 109.398 -6.774 4.910 287 HA3 GLY 41 2HA GLY 41 110.511 -7.373 6.141 288 H SER 42 H SER 42 110.243 -4.880 4.202 289 HA SER 42 HA SER 42 113.102 -4.838 3.416 290 HB2 SER 42 1HB SER 42 111.465 -5.173 1.491 291 HB3 SER 42 2HB SER 42 110.875 -3.552 1.837 292 HG SER 42 HG SER 42 112.889 -2.742 1.381 293 H PHE 43 H PHE 43 114.216 -3.049 3.957 294 HA PHE 43 HA PHE 43 112.694 -0.692 4.931 295 HB2 PHE 43 1HB PHE 43 115.489 -1.612 5.631 296 HB3 PHE 43 2HB PHE 43 114.749 -0.124 6.189 297 HD1 PHE 43 HD2 PHE 43 112.989 -0.156 7.889 298 HD2 PHE 43 HD1 PHE 43 114.819 -3.786 6.503 299 HE1 PHE 43 HE2 PHE 43 112.025 -1.378 9.819 300 HE2 PHE 43 HE1 PHE 43 113.856 -5.008 8.434 301 HZ PHE 43 HZ PHE 43 112.459 -3.805 10.092 302 H THR 44 H THR 44 112.828 1.066 3.634 303 HA THR 44 HA THR 44 115.058 1.163 1.672 304 HB THR 44 HB THR 44 112.218 2.114 1.246 305 HG1 THR 44 HG1 THR 44 111.848 0.107 0.826 306 HG21 THR 44 3HG2 THR 44 114.096 3.242 -0.021 307 HG22 THR 44 1HG2 THR 44 112.900 2.440 -1.039 308 HG23 THR 44 2HG2 THR 44 114.461 1.675 -0.739 309 H TYR 45 H TYR 45 116.131 3.021 1.463 310 HA TYR 45 HA TYR 45 115.074 5.434 2.821 311 HB2 TYR 45 1HB TYR 45 117.958 4.561 2.580 312 HB3 TYR 45 2HB TYR 45 117.404 6.065 3.288 313 HD1 TYR 45 HD2 TYR 45 116.330 6.103 5.486 314 HD2 TYR 45 HD1 TYR 45 117.696 2.429 3.729 315 HE1 TYR 45 HE2 TYR 45 116.120 4.974 7.684 316 HE2 TYR 45 HE1 TYR 45 117.488 1.300 5.928 317 HH TYR 45 HH TYR 45 117.319 2.825 8.767 318 H THR 46 H THR 46 114.907 7.183 1.541 319 HA THR 46 HA THR 46 116.304 7.163 -1.069 320 HB THR 46 HB THR 46 114.308 8.141 -2.096 321 HG1 THR 46 HG1 THR 46 112.458 8.391 -0.917 322 HG21 THR 46 3HG2 THR 46 114.206 5.469 -0.774 323 HG22 THR 46 1HG2 THR 46 114.122 5.891 -2.484 324 HG23 THR 46 2HG2 THR 46 112.704 6.085 -1.457 325 H GLU 47 H GLU 47 116.766 9.205 -1.948 326 HA GLU 47 HA GLU 47 116.543 11.501 -0.101 327 HB2 GLU 47 1HB GLU 47 118.843 10.483 -0.060 328 HB3 GLU 47 2HB GLU 47 118.978 10.850 -1.780 329 HG2 GLU 47 1HG GLU 47 118.555 13.248 -1.271 330 HG3 GLU 47 2HG GLU 47 118.519 12.858 0.442 331 H LYS 48 H LYS 48 116.288 13.498 -1.089 332 HA LYS 48 HA LYS 48 115.863 13.478 -4.022 333 HB2 LYS 48 1HB LYS 48 113.727 13.548 -2.726 334 HB3 LYS 48 2HB LYS 48 114.276 15.046 -1.973 335 HG2 LYS 48 1HG LYS 48 114.491 16.069 -4.232 336 HG3 LYS 48 2HG LYS 48 113.844 14.588 -4.938 337 HD2 LYS 48 1HD LYS 48 111.792 14.877 -3.527 338 HD3 LYS 48 2HD LYS 48 112.426 16.437 -3.002 339 HE2 LYS 48 1HE LYS 48 112.652 16.902 -5.576 340 HE3 LYS 48 2HE LYS 48 111.462 15.610 -5.723 341 HZ1 LYS 48 3HZ LYS 48 109.969 16.800 -4.309 342 HZ2 LYS 48 1HZ LYS 48 110.473 17.850 -5.543 343 HZ3 LYS 48 2HZ LYS 48 111.135 17.994 -3.985 344 H SER 49 H SER 49 116.890 15.047 -5.126 345 HA SER 49 HA SER 49 118.280 17.149 -3.563 346 HB2 SER 49 1HB SER 49 119.777 15.496 -4.664 347 HB3 SER 49 2HB SER 49 119.083 15.940 -6.218 348 HG SER 49 HG SER 49 121.103 17.059 -5.165 349 H ARG 50 H ARG 50 118.063 19.235 -4.156 350 HA ARG 50 HA ARG 50 116.623 19.859 -6.657 351 HB2 ARG 50 1HB ARG 50 115.045 19.933 -4.722 352 HB3 ARG 50 2HB ARG 50 116.068 21.168 -3.984 353 HG2 ARG 50 1HG ARG 50 115.728 22.644 -5.904 354 HG3 ARG 50 2HG ARG 50 114.768 21.404 -6.713 355 HD2 ARG 50 1HD ARG 50 113.227 22.944 -5.685 356 HD3 ARG 50 2HD ARG 50 113.192 21.455 -4.747 357 HE ARG 50 HE ARG 50 115.121 23.148 -3.612 358 HH11 ARG 50 1HH1 ARG 50 111.635 23.069 -4.014 359 HH12 ARG 50 2HH1 ARG 50 111.349 24.003 -2.584 360 HH21 ARG 50 1HH2 ARG 50 114.692 24.346 -1.781 361 HH22 ARG 50 2HH2 ARG 50 113.059 24.717 -1.337 362 H THR 51 H THR 51 117.255 21.749 -7.665 363 HA THR 51 HA THR 51 119.595 23.134 -6.476 364 HB THR 51 HB THR 51 118.941 22.789 -9.411 365 HG1 THR 51 HG1 THR 51 120.512 21.224 -9.379 366 HG21 THR 51 3HG2 THR 51 120.265 24.796 -8.851 367 HG22 THR 51 1HG2 THR 51 121.241 23.611 -9.719 368 HG23 THR 51 2HG2 THR 51 121.415 23.788 -7.973 369 H ALA 52 H ALA 52 119.528 25.298 -6.291 370 HA ALA 52 HA ALA 52 117.293 26.761 -7.567 371 HB1 ALA 52 1HB ALA 52 116.530 26.659 -5.367 372 HB2 ALA 52 2HB ALA 52 117.420 28.182 -5.381 373 HB3 ALA 52 3HB ALA 52 118.157 26.736 -4.692 374 H SER 53 H SER 53 117.694 29.009 -7.935 375 HA SER 53 HA SER 53 120.223 29.611 -8.968 376 HB2 SER 53 1HB SER 53 118.123 31.572 -8.015 377 HB3 SER 53 2HB SER 53 119.427 31.905 -9.149 378 HG SER 53 HG SER 53 118.458 30.640 -10.638 379 H SER 54 H SER 54 118.842 30.263 -5.775 380 HA SER 54 HA SER 54 120.833 31.997 -4.813 381 HB2 SER 54 1HB SER 54 120.008 31.450 -2.605 382 HB3 SER 54 2HB SER 54 118.642 31.559 -3.709 383 HG SER 54 HG SER 54 118.246 29.632 -2.917 384 H GLY 55 H GLY 55 120.759 28.480 -5.056 385 HA2 GLY 55 1HA GLY 55 122.609 27.054 -5.081 386 HA3 GLY 55 2HA GLY 55 123.617 28.389 -4.546 387 H ASP 56 H ASP 56 120.720 27.761 -2.722 388 HA ASP 56 HA ASP 56 122.312 27.056 -0.406 389 HB2 ASP 56 1HB ASP 56 120.156 27.117 0.794 390 HB3 ASP 56 2HB ASP 56 120.442 28.586 -0.129 391 H TYR 57 H TYR 57 121.485 25.224 1.018 392 HA TYR 57 HA TYR 57 120.903 22.847 -0.660 393 HB2 TYR 57 1HB TYR 57 122.538 23.011 1.874 394 HB3 TYR 57 2HB TYR 57 122.196 21.551 0.967 395 HD1 TYR 57 HD1 TYR 57 123.137 21.295 -1.363 396 HD2 TYR 57 HD2 TYR 57 124.303 24.482 1.271 397 HE1 TYR 57 HE1 TYR 57 125.155 21.700 -2.746 398 HE2 TYR 57 HE2 TYR 57 126.321 24.887 -0.112 399 HH TYR 57 HH TYR 57 127.145 22.763 -2.823 400 H ASN 58 H ASN 58 119.173 21.672 -0.132 401 HA ASN 58 HA ASN 58 117.841 22.200 2.464 402 HB2 ASN 58 1HB ASN 58 116.627 21.292 -0.159 403 HB3 ASN 58 2HB ASN 58 115.748 21.560 1.346 404 HD21 ASN 58 1HD2 ASN 58 116.908 23.962 2.252 405 HD22 ASN 58 2HD2 ASN 58 116.583 25.197 1.134 406 H LYS 59 H LYS 59 117.610 20.524 3.825 407 HA LYS 59 HA LYS 59 118.607 17.914 2.979 408 HB2 LYS 59 1HB LYS 59 119.340 18.940 5.131 409 HB3 LYS 59 2HB LYS 59 117.679 18.818 5.714 410 HG2 LYS 59 1HG LYS 59 117.726 16.391 5.454 411 HG3 LYS 59 2HG LYS 59 119.346 16.471 4.762 412 HD2 LYS 59 1HD LYS 59 119.572 15.872 7.093 413 HD3 LYS 59 2HD LYS 59 120.128 17.536 6.907 414 HE2 LYS 59 1HE LYS 59 118.087 18.416 7.794 415 HE3 LYS 59 2HE LYS 59 117.294 16.843 7.705 416 HZ1 LYS 59 3HZ LYS 59 118.725 15.999 9.393 417 HZ2 LYS 59 1HZ LYS 59 118.066 17.456 9.960 418 HZ3 LYS 59 2HZ LYS 59 119.667 17.413 9.392 419 H ASN 60 H ASN 60 117.248 16.484 2.143 420 HA ASN 60 HA ASN 60 114.517 16.272 3.272 421 HB2 ASN 60 1HB ASN 60 115.337 15.939 0.376 422 HB3 ASN 60 2HB ASN 60 113.724 15.651 1.020 423 HD21 ASN 60 1HD2 ASN 60 114.223 17.622 -1.014 424 HD22 ASN 60 2HD2 ASN 60 113.920 19.153 -0.347 425 H GLN 61 H GLN 61 114.035 14.287 4.021 426 HA GLN 61 HA GLN 61 115.496 11.964 2.922 427 HB2 GLN 61 1HB GLN 61 116.631 12.714 5.015 428 HB3 GLN 61 2HB GLN 61 115.117 12.464 5.884 429 HG2 GLN 61 1HG GLN 61 115.131 10.080 5.096 430 HG3 GLN 61 2HG GLN 61 116.731 10.363 4.415 431 HE21 GLN 61 1HE2 GLN 61 118.331 9.612 5.799 432 HE22 GLN 61 2HE2 GLN 61 118.263 9.675 7.494 433 H TYR 62 H TYR 62 114.308 10.094 2.808 434 HA TYR 62 HA TYR 62 111.700 10.004 4.182 435 HB2 TYR 62 1HB TYR 62 111.350 10.852 1.887 436 HB3 TYR 62 2HB TYR 62 112.144 9.428 1.251 437 HD1 TYR 62 HD1 TYR 62 109.126 10.719 2.940 438 HD2 TYR 62 HD2 TYR 62 110.996 7.301 1.131 439 HE1 TYR 62 HE1 TYR 62 106.939 9.551 2.888 440 HE2 TYR 62 HE2 TYR 62 108.809 6.133 1.081 441 HH TYR 62 HH TYR 62 105.930 7.612 1.374 442 H TYR 63 H TYR 63 111.170 7.978 4.931 443 HA TYR 63 HA TYR 63 112.728 5.678 3.935 444 HB2 TYR 63 1HB TYR 63 113.169 4.886 6.152 445 HB3 TYR 63 2HB TYR 63 113.765 6.528 6.026 446 HD1 TYR 63 HD1 TYR 63 111.260 4.314 7.551 447 HD2 TYR 63 HD2 TYR 63 112.699 8.351 7.267 448 HE1 TYR 63 HE1 TYR 63 109.937 4.927 9.558 449 HE2 TYR 63 HE2 TYR 63 111.377 8.963 9.274 450 HH TYR 63 HH TYR 63 110.100 8.207 10.933 451 H GLY 64 H GLY 64 111.659 3.634 4.188 452 HA2 GLY 64 1HA GLY 64 108.830 3.745 4.984 453 HA3 GLY 64 2HA GLY 64 109.198 3.330 3.314 454 H ILE 65 H ILE 65 108.059 1.827 5.771 455 HA ILE 65 HA ILE 65 109.857 -0.528 5.572 456 HB ILE 65 HB ILE 65 109.005 -1.217 7.776 457 HG12 ILE 65 1HG1 ILE 65 107.706 1.520 7.910 458 HG13 ILE 65 2HG1 ILE 65 106.808 0.050 7.537 459 HG21 ILE 65 1HG2 ILE 65 110.274 0.383 9.065 460 HG22 ILE 65 2HG2 ILE 65 110.038 1.631 7.842 461 HG23 ILE 65 3HG2 ILE 65 111.052 0.232 7.489 462 HD11 ILE 65 3HD1 ILE 65 108.521 0.245 10.013 463 HD12 ILE 65 1HD1 ILE 65 107.214 -0.885 9.667 464 HD13 ILE 65 2HD1 ILE 65 106.852 0.807 9.999 465 H THR 66 H THR 66 108.943 -2.481 5.051 466 HA THR 66 HA THR 66 106.047 -2.493 4.452 467 HB THR 66 HB THR 66 106.505 -3.607 2.315 468 HG1 THR 66 HG1 THR 66 108.408 -4.368 1.973 469 HG21 THR 66 3HG2 THR 66 107.775 -1.617 1.225 470 HG22 THR 66 1HG2 THR 66 107.740 -0.909 2.840 471 HG23 THR 66 2HG2 THR 66 106.231 -1.297 2.013 472 H ALA 67 H ALA 67 105.127 -4.604 4.210 473 HA ALA 67 HA ALA 67 106.717 -6.948 4.826 474 HB1 ALA 67 1HB ALA 67 105.418 -7.631 6.757 475 HB2 ALA 67 2HB ALA 67 104.399 -6.199 6.623 476 HB3 ALA 67 3HB ALA 67 106.096 -6.034 7.073 477 H GLY 68 H GLY 68 105.738 -8.833 3.970 478 HA2 GLY 68 1HA GLY 68 102.908 -8.934 3.463 479 HA3 GLY 68 2HA GLY 68 103.818 -8.607 2.002 480 HA PRO 69 HA PRO 69 103.803 -13.261 3.009 481 HB2 PRO 69 1HB PRO 69 101.676 -14.179 1.600 482 HB3 PRO 69 2HB PRO 69 101.548 -13.649 3.291 483 HG2 PRO 69 1HG PRO 69 100.808 -12.207 0.799 484 HG3 PRO 69 2HG PRO 69 99.975 -12.264 2.363 485 HD2 PRO 69 1HD PRO 69 101.564 -10.166 1.572 486 HD3 PRO 69 2HD PRO 69 101.269 -10.596 3.270 487 H ALA 70 H ALA 70 104.242 -15.026 1.401 488 HA ALA 70 HA ALA 70 104.548 -14.161 -1.371 489 HB1 ALA 70 1HB ALA 70 106.812 -14.539 0.527 490 HB2 ALA 70 2HB ALA 70 106.669 -13.457 -0.854 491 HB3 ALA 70 3HB ALA 70 107.015 -15.166 -1.109 492 H TYR 71 H TYR 71 104.982 -15.952 -2.827 493 HA TYR 71 HA TYR 71 104.381 -18.598 -1.627 494 HB2 TYR 71 1HB TYR 71 103.611 -17.541 -4.353 495 HB3 TYR 71 2HB TYR 71 103.286 -19.156 -3.754 496 HD1 TYR 71 HD1 TYR 71 101.707 -19.457 -1.807 497 HD2 TYR 71 HD2 TYR 71 102.213 -15.696 -3.820 498 HE1 TYR 71 HE1 TYR 71 99.573 -18.650 -0.835 499 HE2 TYR 71 HE2 TYR 71 100.079 -14.889 -2.848 500 HH TYR 71 HH TYR 71 97.951 -17.033 -1.053 501 H ARG 72 H ARG 72 105.815 -20.159 -2.012 502 HA ARG 72 HA ARG 72 108.015 -19.596 -3.912 503 HB2 ARG 72 1HB ARG 72 108.031 -21.182 -1.333 504 HB3 ARG 72 2HB ARG 72 109.400 -21.029 -2.434 505 HG2 ARG 72 1HG ARG 72 109.353 -18.571 -2.143 506 HG3 ARG 72 2HG ARG 72 108.011 -18.741 -1.011 507 HD2 ARG 72 1HD ARG 72 110.028 -18.566 0.294 508 HD3 ARG 72 2HD ARG 72 109.484 -20.238 0.383 509 HE ARG 72 HE ARG 72 111.390 -20.872 -0.767 510 HH11 ARG 72 1HH1 ARG 72 111.012 -17.398 -1.105 511 HH12 ARG 72 2HH1 ARG 72 112.559 -17.203 -1.858 512 HH21 ARG 72 1HH2 ARG 72 113.371 -20.558 -1.741 513 HH22 ARG 72 2HH2 ARG 72 113.877 -18.971 -2.213 514 H ILE 73 H ILE 73 108.574 -21.111 -5.378 515 HA ILE 73 HA ILE 73 108.407 -22.949 -6.730 516 HB ILE 73 HB ILE 73 107.338 -24.371 -4.281 517 HG12 ILE 73 1HG1 ILE 73 109.472 -23.312 -3.724 518 HG13 ILE 73 2HG1 ILE 73 109.696 -25.047 -3.892 519 HG21 ILE 73 1HG2 ILE 73 108.681 -26.257 -5.573 520 HG22 ILE 73 2HG2 ILE 73 108.370 -25.215 -6.962 521 HG23 ILE 73 3HG2 ILE 73 107.025 -25.862 -6.025 522 HD11 ILE 73 3HD1 ILE 73 111.393 -24.554 -5.297 523 HD12 ILE 73 1HD1 ILE 73 110.905 -22.866 -5.410 524 HD13 ILE 73 2HD1 ILE 73 110.175 -24.067 -6.473 525 H ASN 74 H ASN 74 106.435 -21.155 -7.013 526 HA ASN 74 HA ASN 74 103.840 -22.451 -6.963 527 HB2 ASN 74 1HB ASN 74 104.382 -19.911 -6.737 528 HB3 ASN 74 2HB ASN 74 104.488 -19.946 -8.496 529 HD21 ASN 74 1HD2 ASN 74 102.536 -19.510 -9.516 530 HD22 ASN 74 2HD2 ASN 74 101.002 -19.808 -8.854 531 H ASP 75 H ASP 75 102.588 -22.222 -9.202 532 HA ASP 75 HA ASP 75 103.579 -24.100 -10.987 533 HB2 ASP 75 1HB ASP 75 101.217 -23.291 -10.865 534 HB3 ASP 75 2HB ASP 75 101.723 -21.818 -11.689 535 H TRP 76 H TRP 76 103.958 -20.580 -11.027 536 HA TRP 76 HA TRP 76 106.170 -20.928 -12.948 537 HB2 TRP 76 1HB TRP 76 104.159 -20.090 -14.139 538 HB3 TRP 76 2HB TRP 76 104.119 -18.714 -13.053 539 HD1 TRP 76 HD1 TRP 76 105.440 -16.659 -13.770 540 HE1 TRP 76 HE1 TRP 76 107.178 -16.146 -15.602 541 HE3 TRP 76 HE3 TRP 76 106.256 -21.373 -15.555 542 HZ2 TRP 76 HZ2 TRP 76 108.715 -17.550 -17.567 543 HZ3 TRP 76 HZ3 TRP 76 107.858 -21.757 -17.403 544 HH2 TRP 76 HH2 TRP 76 109.088 -19.857 -18.411 545 H ALA 77 H ALA 77 107.877 -20.491 -11.675 546 HA ALA 77 HA ALA 77 109.305 -19.369 -10.269 547 HB1 ALA 77 1HB ALA 77 109.399 -16.955 -10.579 548 HB2 ALA 77 2HB ALA 77 107.785 -16.959 -11.290 549 HB3 ALA 77 3HB ALA 77 109.122 -17.743 -12.132 550 H SER 78 H SER 78 109.189 -17.274 -8.610 551 HA SER 78 HA SER 78 106.972 -17.931 -6.760 552 HB2 SER 78 1HB SER 78 109.726 -16.820 -6.149 553 HB3 SER 78 2HB SER 78 108.473 -17.178 -4.964 554 HG SER 78 HG SER 78 110.135 -18.850 -5.392 555 H ILE 79 H ILE 79 106.039 -16.143 -5.548 556 HA ILE 79 HA ILE 79 106.441 -13.505 -6.803 557 HB ILE 79 HB ILE 79 104.653 -14.616 -8.084 558 HG12 ILE 79 1HG1 ILE 79 103.427 -12.514 -6.292 559 HG13 ILE 79 2HG1 ILE 79 104.651 -12.122 -7.501 560 HG21 ILE 79 1HG2 ILE 79 103.900 -16.074 -6.155 561 HG22 ILE 79 2HG2 ILE 79 102.595 -15.309 -7.061 562 HG23 ILE 79 3HG2 ILE 79 103.083 -14.655 -5.498 563 HD11 ILE 79 3HD1 ILE 79 103.260 -12.898 -9.291 564 HD12 ILE 79 1HD1 ILE 79 102.240 -11.876 -8.278 565 HD13 ILE 79 2HD1 ILE 79 102.115 -13.632 -8.168 566 H TYR 80 H TYR 80 105.771 -11.748 -5.516 567 HA TYR 80 HA TYR 80 104.619 -12.360 -2.894 568 HB2 TYR 80 1HB TYR 80 106.354 -11.267 -1.666 569 HB3 TYR 80 2HB TYR 80 107.089 -12.499 -2.671 570 HD1 TYR 80 HD1 TYR 80 106.708 -8.891 -2.083 571 HD2 TYR 80 HD2 TYR 80 108.531 -11.896 -4.552 572 HE1 TYR 80 HE1 TYR 80 108.246 -7.187 -3.021 573 HE2 TYR 80 HE2 TYR 80 110.069 -10.193 -5.491 574 HH TYR 80 HH TYR 80 110.537 -8.009 -5.613 575 H GLY 81 H GLY 81 103.710 -10.552 -1.828 576 HA2 GLY 81 1HA GLY 81 103.734 -7.992 -3.303 577 HA3 GLY 81 2HA GLY 81 102.183 -8.707 -2.855 578 H VAL 82 H VAL 82 103.453 -6.158 -1.919 579 HA VAL 82 HA VAL 82 103.424 -6.732 0.965 580 HB VAL 82 HB VAL 82 105.460 -5.381 1.305 581 HG11 VAL 82 1HG1 VAL 82 105.803 -7.710 -0.609 582 HG12 VAL 82 2HG1 VAL 82 105.618 -7.836 1.140 583 HG13 VAL 82 3HG1 VAL 82 107.053 -7.070 0.458 584 HG21 VAL 82 3HG2 VAL 82 105.369 -4.012 -0.722 585 HG22 VAL 82 1HG2 VAL 82 105.569 -5.446 -1.729 586 HG23 VAL 82 2HG2 VAL 82 106.889 -4.906 -0.689 587 H VAL 83 H VAL 83 103.048 -4.926 2.291 588 HA VAL 83 HA VAL 83 102.314 -2.407 0.925 589 HB VAL 83 HB VAL 83 100.868 -3.597 3.310 590 HG11 VAL 83 1HG1 VAL 83 100.727 -1.234 3.415 591 HG12 VAL 83 2HG1 VAL 83 99.226 -1.733 2.635 592 HG13 VAL 83 3HG1 VAL 83 100.551 -1.086 1.666 593 HG21 VAL 83 3HG2 VAL 83 100.349 -3.734 0.362 594 HG22 VAL 83 1HG2 VAL 83 98.963 -3.549 1.437 595 HG23 VAL 83 2HG2 VAL 83 100.036 -4.935 1.611 596 H GLY 84 H GLY 84 102.742 -0.498 2.248 597 HA2 GLY 84 1HA GLY 84 103.982 -0.843 4.842 598 HA3 GLY 84 2HA GLY 84 105.120 -0.430 3.568 599 H VAL 85 H VAL 85 105.222 1.330 5.362 600 HA VAL 85 HA VAL 85 103.648 3.621 4.395 601 HB VAL 85 HB VAL 85 103.315 4.405 6.724 602 HG11 VAL 85 1HG1 VAL 85 102.208 1.609 6.369 603 HG12 VAL 85 2HG1 VAL 85 101.614 2.998 5.457 604 HG13 VAL 85 3HG1 VAL 85 101.459 2.965 7.214 605 HG21 VAL 85 3HG2 VAL 85 103.712 2.876 8.590 606 HG22 VAL 85 1HG2 VAL 85 105.220 3.114 7.705 607 HG23 VAL 85 2HG2 VAL 85 104.291 1.631 7.482 608 H GLY 86 H GLY 86 104.794 5.558 4.430 609 HA2 GLY 86 1HA GLY 86 107.565 5.424 5.465 610 HA3 GLY 86 2HA GLY 86 107.245 5.974 3.825 611 H TYR 87 H TYR 87 108.540 7.421 5.923 612 HA TYR 87 HA TYR 87 106.702 9.723 6.177 613 HB2 TYR 87 1HB TYR 87 108.725 8.809 8.230 614 HB3 TYR 87 2HB TYR 87 107.715 10.238 8.344 615 HD1 TYR 87 HD1 TYR 87 105.246 9.998 8.653 616 HD2 TYR 87 HD2 TYR 87 107.907 6.628 8.767 617 HE1 TYR 87 HE1 TYR 87 103.483 8.643 9.750 618 HE2 TYR 87 HE2 TYR 87 106.143 5.273 9.865 619 HH TYR 87 HH TYR 87 103.807 5.210 10.183 620 H GLY 88 H GLY 88 107.665 11.741 5.837 621 HA2 GLY 88 1HA GLY 88 110.548 11.797 5.265 622 HA3 GLY 88 2HA GLY 88 109.432 12.314 4.009 623 H LYS 89 H LYS 89 111.475 13.871 5.236 624 HA LYS 89 HA LYS 89 109.802 16.115 6.113 625 HB2 LYS 89 1HB LYS 89 111.288 16.696 7.928 626 HB3 LYS 89 2HB LYS 89 110.745 15.037 8.151 627 HG2 LYS 89 1HG LYS 89 112.878 14.249 7.100 628 HG3 LYS 89 2HG LYS 89 113.423 15.926 7.038 629 HD2 LYS 89 1HD LYS 89 112.995 16.022 9.551 630 HD3 LYS 89 2HD LYS 89 112.816 14.268 9.494 631 HE2 LYS 89 1HE LYS 89 115.256 15.765 8.497 632 HE3 LYS 89 2HE LYS 89 115.139 14.996 10.080 633 HZ1 LYS 89 3HZ LYS 89 114.787 13.596 7.485 634 HZ2 LYS 89 1HZ LYS 89 114.785 12.881 9.024 635 HZ3 LYS 89 2HZ LYS 89 116.210 13.577 8.412 636 H PHE 90 H PHE 90 110.476 18.096 5.369 637 HA PHE 90 HA PHE 90 113.038 18.261 3.948 638 HB2 PHE 90 1HB PHE 90 111.989 19.164 1.950 639 HB3 PHE 90 2HB PHE 90 111.398 17.546 2.274 640 HD1 PHE 90 HD2 PHE 90 109.086 17.169 2.984 641 HD2 PHE 90 HD1 PHE 90 110.561 21.123 2.180 642 HE1 PHE 90 HE2 PHE 90 106.758 18.024 2.925 643 HE2 PHE 90 HE1 PHE 90 108.233 21.977 2.121 644 HZ PHE 90 HZ PHE 90 106.333 20.430 2.494 645 H GLN 91 H GLN 91 113.721 20.431 3.515 646 HA GLN 91 HA GLN 91 112.452 22.422 5.295 647 HB2 GLN 91 1HB GLN 91 115.241 22.400 4.115 648 HB3 GLN 91 2HB GLN 91 114.609 23.565 5.275 649 HG2 GLN 91 1HG GLN 91 114.948 20.589 5.753 650 HG3 GLN 91 2HG GLN 91 115.970 21.862 6.412 651 HE21 GLN 91 1HE2 GLN 91 113.735 19.813 7.494 652 HE22 GLN 91 2HE2 GLN 91 112.892 20.791 8.595 653 H THR 92 H THR 92 111.449 24.118 4.426 654 HA THR 92 HA THR 92 112.208 25.066 1.764 655 HB THR 92 HB THR 92 110.430 23.406 1.373 656 HG1 THR 92 HG1 THR 92 109.272 25.941 1.043 657 HG21 THR 92 3HG2 THR 92 108.812 25.200 3.203 658 HG22 THR 92 1HG2 THR 92 109.252 23.517 3.497 659 HG23 THR 92 2HG2 THR 92 108.129 23.920 2.199 660 H THR 93 H THR 93 110.960 27.125 1.220 661 HA THR 93 HA THR 93 110.786 28.781 3.649 662 HB THR 93 HB THR 93 110.845 29.640 0.744 663 HG1 THR 93 HG1 THR 93 112.989 29.892 1.020 664 HG21 THR 93 3HG2 THR 93 109.880 31.359 2.102 665 HG22 THR 93 1HG2 THR 93 111.565 31.816 1.850 666 HG23 THR 93 2HG2 THR 93 111.065 31.102 3.383 667 H GLU 94 H GLU 94 108.883 29.476 4.391 668 HA GLU 94 HA GLU 94 106.541 29.959 2.902 669 HB2 GLU 94 1HB GLU 94 106.732 27.474 2.527 670 HB3 GLU 94 2HB GLU 94 106.544 27.256 4.266 671 HG2 GLU 94 1HG GLU 94 104.370 28.456 4.156 672 HG3 GLU 94 2HG GLU 94 104.552 28.590 2.413 673 H TYR 95 H TYR 95 104.842 30.683 4.243 674 HA TYR 95 HA TYR 95 105.615 31.325 6.955 675 HB2 TYR 95 1HB TYR 95 103.436 32.477 7.048 676 HB3 TYR 95 2HB TYR 95 104.382 32.968 5.656 677 HD1 TYR 95 HD1 TYR 95 101.469 30.992 6.795 678 HD2 TYR 95 HD2 TYR 95 103.628 32.520 3.410 679 HE1 TYR 95 HE1 TYR 95 99.566 30.406 5.316 680 HE2 TYR 95 HE2 TYR 95 101.726 31.934 1.932 681 HH TYR 95 HH TYR 95 98.674 30.750 3.248 682 HA PRO 96 HA PRO 96 104.289 27.749 8.886 683 HB2 PRO 96 1HB PRO 96 102.701 29.197 10.938 684 HB3 PRO 96 2HB PRO 96 104.095 28.119 11.135 685 HG2 PRO 96 1HG PRO 96 104.280 30.765 11.453 686 HG3 PRO 96 2HG PRO 96 105.609 29.789 10.805 687 HD2 PRO 96 1HD PRO 96 103.755 31.630 9.363 688 HD3 PRO 96 2HD PRO 96 105.456 31.237 9.028 689 H THR 97 H THR 97 102.806 26.275 8.456 690 HA THR 97 HA THR 97 99.965 27.066 8.193 691 HB THR 97 HB THR 97 99.707 25.250 6.585 692 HG1 THR 97 HG1 THR 97 101.834 24.328 5.882 693 HG21 THR 97 3HG2 THR 97 102.097 26.997 5.932 694 HG22 THR 97 1HG2 THR 97 100.405 27.453 5.727 695 HG23 THR 97 2HG2 THR 97 101.092 26.149 4.755 696 H TYR 98 H TYR 98 98.403 25.467 8.929 697 HA TYR 98 HA TYR 98 99.469 23.787 11.097 698 HB2 TYR 98 1HB TYR 98 97.207 23.665 11.904 699 HB3 TYR 98 2HB TYR 98 97.603 25.340 11.581 700 HD1 TYR 98 HD1 TYR 98 96.629 26.496 9.601 701 HD2 TYR 98 HD2 TYR 98 95.484 22.505 10.702 702 HE1 TYR 98 HE1 TYR 98 94.619 26.675 8.160 703 HE2 TYR 98 HE2 TYR 98 93.474 22.684 9.262 704 HH TYR 98 HH TYR 98 92.062 25.068 8.366 705 H LYS 99 H LYS 99 99.792 21.705 10.772 706 HA LYS 99 HA LYS 99 98.370 20.352 8.553 707 HB2 LYS 99 1HB LYS 99 101.103 19.806 9.734 708 HB3 LYS 99 2HB LYS 99 100.323 18.817 8.499 709 HG2 LYS 99 1HG LYS 99 100.172 20.828 7.031 710 HG3 LYS 99 2HG LYS 99 101.067 21.745 8.245 711 HD2 LYS 99 1HD LYS 99 102.933 20.095 8.053 712 HD3 LYS 99 2HD LYS 99 102.054 19.301 6.747 713 HE2 LYS 99 1HE LYS 99 102.009 21.556 5.567 714 HE3 LYS 99 2HE LYS 99 103.157 22.118 6.782 715 HZ1 LYS 99 3HZ LYS 99 104.216 21.277 4.733 716 HZ2 LYS 99 1HZ LYS 99 103.579 19.738 5.059 717 HZ3 LYS 99 2HZ LYS 99 104.700 20.436 6.128 718 H HIS 100 H HIS 100 97.513 18.311 8.894 719 HA HIS 100 HA HIS 100 96.543 17.612 11.421 720 HB2 HIS 100 1HB HIS 100 97.078 15.825 9.045 721 HB3 HIS 100 2HB HIS 100 96.087 15.399 10.427 722 HD1 HIS 100 HD1 HIS 100 93.970 17.160 10.801 723 HD2 HIS 100 HD2 HIS 100 95.647 16.952 6.990 724 HE1 HIS 100 HE1 HIS 100 92.259 18.137 9.213 725 H ASP 101 H ASP 101 99.502 16.623 9.749 726 HA ASP 101 HA ASP 101 100.493 15.500 12.297 727 HB2 ASP 101 1HB ASP 101 99.838 13.677 10.727 728 HB3 ASP 101 2HB ASP 101 100.990 14.316 9.556 729 H THR 102 H THR 102 102.571 16.011 12.806 730 HA THR 102 HA THR 102 103.752 18.290 11.697 731 HB THR 102 HB THR 102 105.157 16.102 13.246 732 HG1 THR 102 HG1 THR 102 103.337 16.799 14.353 733 HG21 THR 102 3HG2 THR 102 106.517 18.079 14.031 734 HG22 THR 102 1HG2 THR 102 105.708 19.046 12.798 735 HG23 THR 102 2HG2 THR 102 106.724 17.685 12.325 736 H SER 103 H SER 103 104.355 14.861 11.058 737 HA SER 103 HA SER 103 106.326 15.604 8.989 738 HB2 SER 103 1HB SER 103 107.081 13.306 9.097 739 HB3 SER 103 2HB SER 103 107.010 13.953 10.732 740 HG SER 103 HG SER 103 105.409 12.053 9.458 741 H ASP 104 H ASP 104 106.235 14.413 6.931 742 HA ASP 104 HA ASP 104 103.438 14.158 6.056 743 HB2 ASP 104 1HB ASP 104 104.970 15.686 4.817 744 HB3 ASP 104 2HB ASP 104 105.971 14.295 4.403 745 H TYR 105 H TYR 105 102.576 12.196 5.573 746 HA TYR 105 HA TYR 105 104.433 9.908 5.270 747 HB2 TYR 105 1HB TYR 105 103.049 8.552 6.664 748 HB3 TYR 105 2HB TYR 105 103.461 10.007 7.546 749 HD1 TYR 105 HD1 TYR 105 100.775 8.104 5.914 750 HD2 TYR 105 HD2 TYR 105 101.756 11.683 8.078 751 HE1 TYR 105 HE1 TYR 105 98.365 8.512 6.330 752 HE2 TYR 105 HE2 TYR 105 99.346 12.091 8.494 753 HH TYR 105 HH TYR 105 97.138 11.419 7.314 754 H GLY 106 H GLY 106 103.633 8.113 4.107 755 HA2 GLY 106 1HA GLY 106 101.138 8.433 2.610 756 HA3 GLY 106 2HA GLY 106 102.624 8.388 1.667 757 H PHE 107 H PHE 107 100.840 6.482 1.114 758 HA PHE 107 HA PHE 107 101.718 4.053 2.579 759 HB2 PHE 107 1HB PHE 107 99.146 4.561 1.075 760 HB3 PHE 107 2HB PHE 107 99.603 3.034 1.805 761 HD1 PHE 107 HD1 PHE 107 99.734 2.822 4.284 762 HD2 PHE 107 HD2 PHE 107 98.295 6.390 2.373 763 HE1 PHE 107 HE1 PHE 107 98.724 3.562 6.424 764 HE2 PHE 107 HE2 PHE 107 97.285 7.129 4.513 765 HZ PHE 107 HZ PHE 107 97.500 5.716 6.539 766 H SER 108 H SER 108 102.305 2.209 1.354 767 HA SER 108 HA SER 108 102.546 2.634 -1.567 768 HB2 SER 108 1HB SER 108 104.690 3.114 -0.202 769 HB3 SER 108 2HB SER 108 104.753 1.373 0.041 770 HG SER 108 HG SER 108 105.420 2.826 -2.119 771 H TYR 109 H TYR 109 102.245 0.867 -2.814 772 HA TYR 109 HA TYR 109 102.035 -1.790 -1.536 773 HB2 TYR 109 1HB TYR 109 100.114 -0.745 -3.621 774 HB3 TYR 109 2HB TYR 109 100.026 -2.276 -2.773 775 HD1 TYR 109 HD1 TYR 109 99.222 -2.386 -0.463 776 HD2 TYR 109 HD2 TYR 109 99.461 1.349 -2.568 777 HE1 TYR 109 HE1 TYR 109 97.799 -1.322 1.267 778 HE2 TYR 109 HE2 TYR 109 98.035 2.413 -0.840 779 HH TYR 109 HH TYR 109 97.568 1.845 1.761 780 H GLY 110 H GLY 110 102.823 -3.494 -2.877 781 HA2 GLY 110 1HA GLY 110 103.131 -3.114 -5.712 782 HA3 GLY 110 2HA GLY 110 104.664 -2.967 -4.866 783 H ALA 111 H ALA 111 104.623 -4.865 -6.649 784 HA ALA 111 HA ALA 111 104.738 -7.314 -5.057 785 HB1 ALA 111 1HB ALA 111 102.594 -7.677 -5.956 786 HB2 ALA 111 2HB ALA 111 103.661 -8.522 -7.078 787 HB3 ALA 111 3HB ALA 111 103.018 -6.936 -7.499 788 H GLY 112 H GLY 112 106.043 -8.981 -6.111 789 HA2 GLY 112 1HA GLY 112 107.672 -8.088 -8.374 790 HA3 GLY 112 2HA GLY 112 108.510 -8.357 -6.850 791 H LEU 113 H LEU 113 109.196 -9.782 -9.085 792 HA LEU 113 HA LEU 113 108.217 -12.510 -8.466 793 HB2 LEU 113 1HB LEU 113 109.116 -11.402 -11.138 794 HB3 LEU 113 2HB LEU 113 108.715 -13.089 -10.821 795 HG LEU 113 HG LEU 113 106.458 -12.059 -9.905 796 HD11 LEU 113 1HD1 LEU 113 107.684 -9.876 -11.566 797 HD12 LEU 113 2HD1 LEU 113 106.776 -9.750 -10.060 798 HD13 LEU 113 3HD1 LEU 113 105.934 -10.092 -11.571 799 HD21 LEU 113 3HD2 LEU 113 107.080 -12.211 -12.873 800 HD22 LEU 113 1HD2 LEU 113 105.478 -12.337 -12.146 801 HD23 LEU 113 2HD2 LEU 113 106.684 -13.589 -11.847 802 H GLN 114 H GLN 114 109.762 -14.117 -8.288 803 HA GLN 114 HA GLN 114 112.579 -13.199 -8.236 804 HB2 GLN 114 1HB GLN 114 111.609 -13.804 -6.020 805 HB3 GLN 114 2HB GLN 114 111.308 -15.430 -6.633 806 HG2 GLN 114 1HG GLN 114 113.703 -15.737 -7.061 807 HG3 GLN 114 2HG GLN 114 114.026 -14.097 -6.510 808 HE21 GLN 114 1HE2 GLN 114 115.378 -16.065 -5.159 809 HE22 GLN 114 2HE2 GLN 114 114.704 -16.319 -3.622 810 H PHE 115 H PHE 115 113.974 -14.197 -9.552 811 HA PHE 115 HA PHE 115 113.173 -16.780 -10.775 812 HB2 PHE 115 1HB PHE 115 114.678 -14.489 -12.047 813 HB3 PHE 115 2HB PHE 115 114.405 -16.054 -12.790 814 HD1 PHE 115 HD1 PHE 115 112.096 -16.740 -13.442 815 HD2 PHE 115 HD2 PHE 115 112.981 -12.801 -11.976 816 HE1 PHE 115 HE1 PHE 115 109.932 -15.921 -14.336 817 HE2 PHE 115 HE2 PHE 115 110.819 -11.982 -12.871 818 HZ PHE 115 HZ PHE 115 109.294 -13.542 -14.051 819 H ASN 116 H ASN 116 114.875 -18.246 -11.231 820 HA ASN 116 HA ASN 116 117.355 -17.731 -9.688 821 HB2 ASN 116 1HB ASN 116 117.425 -20.193 -9.325 822 HB3 ASN 116 2HB ASN 116 116.021 -19.425 -8.587 823 HD21 ASN 116 1HD2 ASN 116 116.929 -22.036 -10.514 824 HD22 ASN 116 2HD2 ASN 116 115.426 -22.356 -11.235 825 HA PRO 117 HA PRO 117 118.519 -18.103 -14.178 826 HB2 PRO 117 1HB PRO 117 121.013 -16.947 -13.010 827 HB3 PRO 117 2HB PRO 117 120.154 -16.511 -14.499 828 HG2 PRO 117 1HG PRO 117 120.014 -14.989 -12.328 829 HG3 PRO 117 2HG PRO 117 118.619 -15.211 -13.399 830 HD2 PRO 117 1HD PRO 117 119.111 -16.373 -10.696 831 HD3 PRO 117 2HD PRO 117 117.577 -15.924 -11.472 832 H MET 118 H MET 118 121.091 -18.492 -11.710 833 HA MET 118 HA MET 118 121.920 -20.959 -13.058 834 HB2 MET 118 1HB MET 118 123.271 -19.308 -10.913 835 HB3 MET 118 2HB MET 118 123.948 -20.766 -11.638 836 HG2 MET 118 1HG MET 118 123.736 -19.660 -13.889 837 HG3 MET 118 2HG MET 118 123.268 -18.176 -13.057 838 HE1 MET 118 3HE MET 118 125.755 -20.782 -13.867 839 HE2 MET 118 1HE MET 118 126.044 -20.985 -12.134 840 HE3 MET 118 2HE MET 118 127.298 -20.303 -13.166 841 H GLU 119 H GLU 119 121.923 -20.061 -9.594 842 HA GLU 119 HA GLU 119 120.060 -22.035 -8.792 843 HB2 GLU 119 1HB GLU 119 121.906 -23.536 -9.579 844 HB3 GLU 119 2HB GLU 119 122.949 -22.819 -8.349 845 HG2 GLU 119 1HG GLU 119 121.306 -23.496 -6.607 846 HG3 GLU 119 2HG GLU 119 120.344 -24.284 -7.849 847 H ASN 120 H ASN 120 123.229 -20.886 -7.595 848 HA ASN 120 HA ASN 120 122.100 -20.427 -4.964 849 HB2 ASN 120 1HB ASN 120 124.880 -19.895 -6.018 850 HB3 ASN 120 2HB ASN 120 124.388 -19.848 -4.326 851 HD21 ASN 120 1HD2 ASN 120 122.750 -22.133 -4.158 852 HD22 ASN 120 2HD2 ASN 120 123.682 -23.515 -4.479 853 H VAL 121 H VAL 121 121.865 -18.560 -7.652 854 HA VAL 121 HA VAL 121 121.824 -16.093 -6.029 855 HB VAL 121 HB VAL 121 123.843 -16.076 -7.443 856 HG11 VAL 121 1HG1 VAL 121 121.886 -16.275 -9.751 857 HG12 VAL 121 2HG1 VAL 121 122.998 -17.546 -9.245 858 HG13 VAL 121 3HG1 VAL 121 123.626 -16.030 -9.890 859 HG21 VAL 121 3HG2 VAL 121 122.733 -13.949 -6.971 860 HG22 VAL 121 1HG2 VAL 121 121.645 -14.187 -8.338 861 HG23 VAL 121 2HG2 VAL 121 123.367 -13.931 -8.616 862 H ALA 122 H ALA 122 120.082 -14.768 -6.371 863 HA ALA 122 HA ALA 122 118.177 -15.544 -8.504 864 HB1 ALA 122 1HB ALA 122 117.290 -16.517 -6.501 865 HB2 ALA 122 2HB ALA 122 116.346 -15.066 -6.836 866 HB3 ALA 122 3HB ALA 122 117.587 -15.041 -5.582 867 H LEU 123 H LEU 123 116.793 -13.893 -9.222 868 HA LEU 123 HA LEU 123 117.728 -11.145 -8.611 869 HB2 LEU 123 1HB LEU 123 116.509 -12.164 -11.192 870 HB3 LEU 123 2HB LEU 123 117.125 -10.541 -10.892 871 HG LEU 123 HG LEU 123 118.796 -13.070 -10.786 872 HD11 LEU 123 1HD1 LEU 123 118.083 -12.562 -13.078 873 HD12 LEU 123 2HD1 LEU 123 119.795 -12.186 -12.883 874 HD13 LEU 123 3HD1 LEU 123 118.602 -10.887 -12.884 875 HD21 LEU 123 3HD2 LEU 123 120.664 -11.333 -10.847 876 HD22 LEU 123 1HD2 LEU 123 119.748 -11.405 -9.342 877 HD23 LEU 123 2HD2 LEU 123 119.429 -10.121 -10.508 878 H ASP 124 H ASP 124 116.148 -9.578 -8.221 879 HA ASP 124 HA ASP 124 113.337 -10.531 -8.212 880 HB2 ASP 124 1HB ASP 124 112.960 -9.371 -6.116 881 HB3 ASP 124 2HB ASP 124 114.265 -10.533 -5.919 882 H PHE 125 H PHE 125 112.004 -9.288 -9.315 883 HA PHE 125 HA PHE 125 112.706 -6.431 -9.722 884 HB2 PHE 125 1HB PHE 125 111.317 -8.308 -11.643 885 HB3 PHE 125 2HB PHE 125 111.539 -6.587 -11.894 886 HD1 PHE 125 HD1 PHE 125 113.816 -5.664 -12.290 887 HD2 PHE 125 HD2 PHE 125 113.090 -9.887 -11.994 888 HE1 PHE 125 HE1 PHE 125 116.022 -6.116 -13.329 889 HE2 PHE 125 HE2 PHE 125 115.296 -10.339 -13.033 890 HZ PHE 125 HZ PHE 125 116.762 -8.454 -13.701 891 H SER 126 H SER 126 111.148 -4.997 -9.135 892 HA SER 126 HA SER 126 108.397 -5.962 -8.769 893 HB2 SER 126 1HB SER 126 109.552 -6.264 -6.595 894 HB3 SER 126 2HB SER 126 109.957 -4.551 -6.593 895 HG SER 126 HG SER 126 107.768 -5.661 -5.707 896 H TYR 127 H TYR 127 106.827 -4.399 -8.923 897 HA TYR 127 HA TYR 127 107.732 -1.664 -9.616 898 HB2 TYR 127 1HB TYR 127 106.539 -2.878 -11.414 899 HB3 TYR 127 2HB TYR 127 105.164 -3.082 -10.345 900 HD1 TYR 127 HD1 TYR 127 103.705 -1.195 -9.795 901 HD2 TYR 127 HD2 TYR 127 107.081 -0.721 -12.408 902 HE1 TYR 127 HE1 TYR 127 102.818 0.996 -10.545 903 HE2 TYR 127 HE2 TYR 127 106.194 1.470 -13.159 904 HH TYR 127 HH TYR 127 103.391 2.440 -13.079 905 H GLU 128 H GLU 128 107.247 -0.112 -8.188 906 HA GLU 128 HA GLU 128 105.239 -0.719 -6.092 907 HB2 GLU 128 1HB GLU 128 107.649 -0.554 -5.375 908 HB3 GLU 128 2HB GLU 128 107.612 1.139 -5.870 909 HG2 GLU 128 1HG GLU 128 107.132 1.108 -3.523 910 HG3 GLU 128 2HG GLU 128 105.610 1.435 -4.346 911 H GLN 129 H GLN 129 103.620 0.686 -5.749 912 HA GLN 129 HA GLN 129 103.733 3.335 -7.073 913 HB2 GLN 129 1HB GLN 129 102.088 1.771 -8.131 914 HB3 GLN 129 2HB GLN 129 101.261 1.655 -6.577 915 HG2 GLN 129 1HG GLN 129 100.088 3.340 -7.776 916 HG3 GLN 129 2HG GLN 129 101.113 4.213 -6.638 917 HE21 GLN 129 1HE2 GLN 129 102.270 5.894 -7.576 918 HE22 GLN 129 2HE2 GLN 129 102.730 5.969 -9.209 919 H SER 130 H SER 130 103.451 5.045 -5.713 920 HA SER 130 HA SER 130 102.399 4.487 -2.998 921 HB2 SER 130 1HB SER 130 104.881 4.554 -2.963 922 HB3 SER 130 2HB SER 130 104.824 6.178 -3.640 923 HG SER 130 HG SER 130 104.796 5.626 -1.153 924 H ARG 131 H ARG 131 101.211 6.066 -2.065 925 HA ARG 131 HA ARG 131 100.734 8.534 -3.636 926 HB2 ARG 131 1HB ARG 131 98.829 6.996 -1.851 927 HB3 ARG 131 2HB ARG 131 98.473 8.550 -2.606 928 HG2 ARG 131 1HG ARG 131 98.842 7.542 -4.837 929 HG3 ARG 131 2HG ARG 131 99.151 5.982 -4.072 930 HD2 ARG 131 1HD ARG 131 96.847 5.986 -4.773 931 HD3 ARG 131 2HD ARG 131 96.864 6.144 -3.019 932 HE ARG 131 HE ARG 131 96.832 8.688 -4.363 933 HH11 ARG 131 1HH1 ARG 131 94.771 6.074 -3.246 934 HH12 ARG 131 2HH1 ARG 131 93.370 7.087 -3.149 935 HH21 ARG 131 1HH2 ARG 131 94.994 9.942 -4.217 936 HH22 ARG 131 2HH2 ARG 131 93.496 9.251 -3.691 937 H ILE 132 H ILE 132 101.375 10.333 -2.657 938 HA ILE 132 HA ILE 132 101.656 10.363 0.285 939 HB ILE 132 HB ILE 132 103.665 11.477 -1.702 940 HG12 ILE 132 1HG1 ILE 132 103.960 9.175 0.251 941 HG13 ILE 132 2HG1 ILE 132 103.673 8.972 -1.479 942 HG21 ILE 132 1HG2 ILE 132 103.767 11.304 1.323 943 HG22 ILE 132 2HG2 ILE 132 103.382 12.769 0.421 944 HG23 ILE 132 3HG2 ILE 132 104.978 12.035 0.272 945 HD11 ILE 132 3HD1 ILE 132 106.070 8.805 -1.021 946 HD12 ILE 132 1HD1 ILE 132 106.047 10.372 -0.214 947 HD13 ILE 132 2HD1 ILE 132 105.743 10.269 -1.948 948 H ARG 133 H ARG 133 99.945 11.678 0.661 949 HA ARG 133 HA ARG 133 98.130 12.952 -0.207 950 HB2 ARG 133 1HB ARG 133 100.256 14.777 0.904 951 HB3 ARG 133 2HB ARG 133 98.568 15.237 0.680 952 HG2 ARG 133 1HG ARG 133 97.902 13.296 2.116 953 HG3 ARG 133 2HG ARG 133 99.610 12.990 2.426 954 HD2 ARG 133 1HD ARG 133 98.090 15.519 3.120 955 HD3 ARG 133 2HD ARG 133 98.667 14.304 4.252 956 HE ARG 133 HE ARG 133 100.862 15.084 3.947 957 HH11 ARG 133 1HH1 ARG 133 98.670 16.817 1.812 958 HH12 ARG 133 2HH1 ARG 133 99.818 18.072 1.501 959 HH21 ARG 133 1HH2 ARG 133 102.290 16.730 3.499 960 HH22 ARG 133 2HH2 ARG 133 101.839 18.024 2.439 961 H SER 134 H SER 134 98.022 12.795 -2.470 962 HA SER 134 HA SER 134 97.434 13.928 -4.370 963 HB2 SER 134 1HB SER 134 97.416 16.236 -4.504 964 HB3 SER 134 2HB SER 134 97.352 15.968 -2.768 965 HG SER 134 HG SER 134 99.377 16.660 -2.584 966 H VAL 135 H VAL 135 100.650 13.405 -3.365 967 HA VAL 135 HA VAL 135 101.675 14.019 -6.059 968 HB VAL 135 HB VAL 135 103.177 13.229 -3.547 969 HG11 VAL 135 1HG1 VAL 135 105.165 13.886 -4.793 970 HG12 VAL 135 2HG1 VAL 135 104.179 14.367 -6.174 971 HG13 VAL 135 3HG1 VAL 135 104.289 12.667 -5.719 972 HG21 VAL 135 3HG2 VAL 135 102.739 15.927 -4.866 973 HG22 VAL 135 1HG2 VAL 135 103.877 15.629 -3.552 974 HG23 VAL 135 2HG2 VAL 135 102.147 15.429 -3.282 975 H ASP 136 H ASP 136 102.266 12.423 -7.435 976 HA ASP 136 HA ASP 136 101.695 9.651 -6.564 977 HB2 ASP 136 1HB ASP 136 101.753 10.873 -9.332 978 HB3 ASP 136 2HB ASP 136 101.444 9.175 -8.985 979 H VAL 137 H VAL 137 103.347 8.221 -6.419 980 HA VAL 137 HA VAL 137 105.902 8.922 -7.766 981 HB VAL 137 HB VAL 137 105.545 7.465 -5.134 982 HG11 VAL 137 1HG1 VAL 137 107.951 8.332 -6.749 983 HG12 VAL 137 2HG1 VAL 137 107.557 6.712 -6.174 984 HG13 VAL 137 3HG1 VAL 137 108.056 7.957 -5.029 985 HG21 VAL 137 3HG2 VAL 137 106.569 9.528 -4.166 986 HG22 VAL 137 1HG2 VAL 137 104.985 9.831 -4.882 987 HG23 VAL 137 2HG2 VAL 137 106.448 10.297 -5.749 988 H GLY 138 H GLY 138 106.664 7.463 -9.148 989 HA2 GLY 138 1HA GLY 138 105.655 4.673 -8.982 990 HA3 GLY 138 2HA GLY 138 105.963 5.496 -10.511 991 H THR 139 H THR 139 107.236 3.217 -8.573 992 HA THR 139 HA THR 139 110.043 4.026 -9.104 993 HB THR 139 HB THR 139 109.035 2.435 -6.738 994 HG1 THR 139 HG1 THR 139 108.589 4.308 -5.951 995 HG21 THR 139 3HG2 THR 139 111.424 3.267 -5.975 996 HG22 THR 139 1HG2 THR 139 111.715 3.360 -7.713 997 HG23 THR 139 2HG2 THR 139 111.260 1.824 -6.975 998 H TRP 140 H TRP 140 111.255 2.627 -10.184 999 HA TRP 140 HA TRP 140 110.352 -0.183 -10.421 1000 HB2 TRP 140 1HB TRP 140 112.175 1.464 -12.183 1001 HB3 TRP 140 2HB TRP 140 111.890 -0.253 -12.388 1002 HD1 TRP 140 HD1 TRP 140 109.230 -0.925 -12.875 1003 HE1 TRP 140 HE1 TRP 140 107.519 0.326 -14.337 1004 HE3 TRP 140 HE3 TRP 140 111.429 3.679 -13.060 1005 HZ2 TRP 140 HZ2 TRP 140 107.131 2.940 -15.444 1006 HZ3 TRP 140 HZ3 TRP 140 110.371 5.528 -14.322 1007 HH2 TRP 140 HH2 TRP 140 108.228 5.167 -15.512 1008 H ILE 141 H ILE 141 111.583 -1.714 -9.458 1009 HA ILE 141 HA ILE 141 114.265 -0.926 -8.482 1010 HB ILE 141 HB ILE 141 112.599 -0.676 -6.686 1011 HG12 ILE 141 1HG1 ILE 141 114.212 -3.144 -6.071 1012 HG13 ILE 141 2HG1 ILE 141 115.013 -1.602 -6.381 1013 HG21 ILE 141 1HG2 ILE 141 111.518 -2.737 -5.783 1014 HG22 ILE 141 2HG2 ILE 141 112.106 -3.623 -7.192 1015 HG23 ILE 141 3HG2 ILE 141 110.946 -2.310 -7.396 1016 HD11 ILE 141 3HD1 ILE 141 113.082 -2.298 -4.173 1017 HD12 ILE 141 1HD1 ILE 141 113.370 -0.623 -4.641 1018 HD13 ILE 141 2HD1 ILE 141 114.701 -1.610 -4.040 1019 H ALA 142 H ALA 142 115.818 -2.441 -8.539 1020 HA ALA 142 HA ALA 142 115.070 -5.256 -8.969 1021 HB1 ALA 142 1HB ALA 142 116.692 -5.515 -10.766 1022 HB2 ALA 142 2HB ALA 142 117.145 -3.815 -10.642 1023 HB3 ALA 142 3HB ALA 142 115.534 -4.259 -11.205 1024 H GLY 143 H GLY 143 116.531 -6.731 -8.076 1025 HA2 GLY 143 1HA GLY 143 119.079 -5.779 -7.028 1026 HA3 GLY 143 2HA GLY 143 117.882 -6.200 -5.810 1027 H VAL 144 H VAL 144 119.895 -7.646 -5.425 1028 HA VAL 144 HA VAL 144 119.443 -10.241 -6.771 1029 HB VAL 144 HB VAL 144 121.875 -10.676 -6.593 1030 HG11 VAL 144 1HG1 VAL 144 122.532 -8.749 -8.268 1031 HG12 VAL 144 2HG1 VAL 144 120.815 -8.356 -8.179 1032 HG13 VAL 144 3HG1 VAL 144 121.327 -9.948 -8.737 1033 HG21 VAL 144 3HG2 VAL 144 122.335 -9.134 -4.710 1034 HG22 VAL 144 1HG2 VAL 144 122.006 -7.758 -5.761 1035 HG23 VAL 144 2HG2 VAL 144 123.393 -8.798 -6.081 1036 H GLY 145 H GLY 145 119.853 -12.097 -5.439 1037 HA2 GLY 145 1HA GLY 145 120.206 -11.560 -2.560 1038 HA3 GLY 145 2HA GLY 145 118.789 -12.452 -3.105 1039 H TYR 146 H TYR 146 120.963 -13.303 -1.344 1040 HA TYR 146 HA TYR 146 121.782 -15.719 -2.842 1041 HB2 TYR 146 1HB TYR 146 123.407 -14.246 -0.760 1042 HB3 TYR 146 2HB TYR 146 123.861 -15.750 -1.538 1043 HD1 TYR 146 HD1 TYR 146 124.347 -15.761 -4.015 1044 HD2 TYR 146 HD2 TYR 146 123.789 -12.135 -1.781 1045 HE1 TYR 146 HE1 TYR 146 125.435 -14.474 -5.834 1046 HE2 TYR 146 HE2 TYR 146 124.877 -10.848 -3.600 1047 HH TYR 146 HH TYR 146 125.161 -11.633 -6.492 1048 H ARG 147 H ARG 147 121.614 -17.650 -1.697 1049 HA ARG 147 HA ARG 147 120.262 -17.448 0.935 1050 HB2 ARG 147 1HB ARG 147 119.013 -19.448 0.344 1051 HB3 ARG 147 2HB ARG 147 118.774 -18.208 -0.883 1052 HG2 ARG 147 1HG ARG 147 120.596 -19.309 -2.238 1053 HG3 ARG 147 2HG ARG 147 120.598 -20.622 -1.060 1054 HD2 ARG 147 1HD ARG 147 118.161 -20.958 -1.500 1055 HD3 ARG 147 2HD ARG 147 118.256 -19.735 -2.765 1056 HE ARG 147 HE ARG 147 120.171 -21.421 -3.556 1057 HH11 ARG 147 1HH1 ARG 147 116.918 -22.130 -2.441 1058 HH12 ARG 147 2HH1 ARG 147 116.799 -23.574 -3.390 1059 HH21 ARG 147 1HH2 ARG 147 119.959 -23.290 -4.756 1060 HH22 ARG 147 2HH2 ARG 147 118.501 -24.221 -4.685 1061 H PHE 148 H PHE 148 120.846 -18.832 2.557 1062 HA PHE 148 HA PHE 148 122.573 -21.074 2.194 1063 HB2 PHE 148 1HB PHE 148 124.572 -20.211 3.255 1064 HB3 PHE 148 2HB PHE 148 124.212 -19.286 1.810 1065 HD1 PHE 148 HD1 PHE 148 123.292 -16.978 2.000 1066 HD2 PHE 148 HD2 PHE 148 124.556 -19.222 5.437 1067 HE1 PHE 148 HE1 PHE 148 123.351 -14.891 3.340 1068 HE2 PHE 148 HE2 PHE 148 124.615 -17.136 6.777 1069 HZ PHE 148 HZ PHE 148 124.012 -14.971 5.729 Start of MODEL 20 1 H1 ALA 1 3H ALA 1 115.891 -22.244 10.520 2 H2 ALA 1 2H ALA 1 114.815 -22.139 9.209 3 H3 ALA 1 HT3 ALA 1 116.217 -21.181 9.238 4 HA ALA 1 HA ALA 1 117.238 -23.664 9.486 5 HB1 ALA 1 2HB ALA 1 115.075 -23.812 7.378 6 HB2 ALA 1 3HB ALA 1 114.850 -24.456 9.004 7 HB3 ALA 1 1HB ALA 1 116.112 -25.112 7.962 8 H THR 2 H THR 2 115.737 -21.664 6.938 9 HA THR 2 HA THR 2 118.409 -21.386 5.679 10 HB THR 2 HB THR 2 115.730 -21.398 4.269 11 HG1 THR 2 HG1 THR 2 116.021 -23.465 4.703 12 HG21 THR 2 3HG2 THR 2 118.566 -21.502 3.204 13 HG22 THR 2 1HG2 THR 2 117.549 -20.061 3.211 14 HG23 THR 2 2HG2 THR 2 117.088 -21.461 2.243 15 H SER 3 H SER 3 119.029 -19.358 5.058 16 HA SER 3 HA SER 3 117.147 -17.134 5.602 17 HB2 SER 3 1HB SER 3 118.836 -17.358 7.418 18 HB3 SER 3 2HB SER 3 120.112 -17.174 6.218 19 HG SER 3 HG SER 3 118.752 -15.286 7.471 20 H THR 4 H THR 4 117.187 -15.448 4.167 21 HA THR 4 HA THR 4 119.131 -15.588 1.940 22 HB THR 4 HB THR 4 116.182 -14.966 1.651 23 HG1 THR 4 HG1 THR 4 116.546 -17.160 2.091 24 HG21 THR 4 3HG2 THR 4 118.317 -15.488 -0.434 25 HG22 THR 4 1HG2 THR 4 117.775 -13.879 0.043 26 HG23 THR 4 2HG2 THR 4 116.648 -14.998 -0.726 27 H VAL 5 H VAL 5 120.045 -13.681 1.409 28 HA VAL 5 HA VAL 5 118.888 -11.214 2.594 29 HB VAL 5 HB VAL 5 121.207 -10.379 2.825 30 HG11 VAL 5 1HG1 VAL 5 120.119 -11.449 4.743 31 HG12 VAL 5 2HG1 VAL 5 121.837 -11.848 4.728 32 HG13 VAL 5 3HG1 VAL 5 120.650 -13.034 4.183 33 HG21 VAL 5 3HG2 VAL 5 122.361 -11.648 1.134 34 HG22 VAL 5 1HG2 VAL 5 121.875 -13.177 1.867 35 HG23 VAL 5 2HG2 VAL 5 123.038 -12.136 2.688 36 H THR 6 H THR 6 118.482 -9.630 1.182 37 HA THR 6 HA THR 6 119.731 -9.747 -1.496 38 HB THR 6 HB THR 6 116.807 -9.135 -1.037 39 HG1 THR 6 HG1 THR 6 116.406 -11.194 -1.137 40 HG21 THR 6 3HG2 THR 6 118.341 -8.586 -3.213 41 HG22 THR 6 1HG2 THR 6 116.630 -8.999 -3.311 42 HG23 THR 6 2HG2 THR 6 117.851 -10.238 -3.585 43 H GLY 7 H GLY 7 120.086 -7.749 -2.470 44 HA2 GLY 7 1HA GLY 7 119.153 -5.345 -1.015 45 HA3 GLY 7 2HA GLY 7 120.843 -5.489 -1.507 46 H GLY 8 H GLY 8 118.829 -3.506 -2.386 47 HA2 GLY 8 1HA GLY 8 119.242 -3.821 -5.252 48 HA3 GLY 8 2HA GLY 8 117.561 -3.879 -4.738 49 H TYR 9 H TYR 9 118.233 -2.001 -6.470 50 HA TYR 9 HA TYR 9 118.112 0.490 -4.893 51 HB2 TYR 9 1HB TYR 9 119.503 1.634 -6.476 52 HB3 TYR 9 2HB TYR 9 120.363 0.220 -5.904 53 HD1 TYR 9 HD1 TYR 9 120.643 -1.760 -7.392 54 HD2 TYR 9 HD2 TYR 9 118.867 1.900 -8.772 55 HE1 TYR 9 HE1 TYR 9 120.986 -2.479 -9.740 56 HE2 TYR 9 HE2 TYR 9 119.210 1.180 -11.121 57 HH TYR 9 HH TYR 9 119.746 -1.856 -12.051 58 H ALA 10 H ALA 10 116.687 2.026 -5.645 59 HA ALA 10 HA ALA 10 115.251 1.467 -8.153 60 HB1 ALA 10 1HB ALA 10 114.108 0.655 -5.889 61 HB2 ALA 10 2HB ALA 10 113.167 1.361 -7.203 62 HB3 ALA 10 3HB ALA 10 113.625 2.350 -5.816 63 H GLN 11 H GLN 11 114.396 3.256 -9.178 64 HA GLN 11 HA GLN 11 115.013 5.901 -7.990 65 HB2 GLN 11 1HB GLN 11 114.795 5.167 -10.924 66 HB3 GLN 11 2HB GLN 11 115.211 6.750 -10.273 67 HG2 GLN 11 1HG GLN 11 116.820 4.205 -9.905 68 HG3 GLN 11 2HG GLN 11 117.234 5.539 -10.979 69 HE21 GLN 11 1HE2 GLN 11 118.271 4.311 -8.180 70 HE22 GLN 11 2HE2 GLN 11 118.650 5.726 -7.322 71 H SER 12 H SER 12 113.361 7.461 -8.012 72 HA SER 12 HA SER 12 110.688 6.415 -8.786 73 HB2 SER 12 1HB SER 12 111.382 8.077 -6.352 74 HB3 SER 12 2HB SER 12 109.773 7.527 -6.811 75 HG SER 12 HG SER 12 112.027 5.888 -6.231 76 H ASP 13 H ASP 13 109.367 7.759 -9.845 77 HA ASP 13 HA ASP 13 110.266 10.547 -10.296 78 HB2 ASP 13 1HB ASP 13 110.301 9.094 -12.331 79 HB3 ASP 13 2HB ASP 13 108.572 8.819 -12.120 80 H ALA 14 H ALA 14 108.892 12.099 -9.624 81 HA ALA 14 HA ALA 14 106.261 11.221 -8.595 82 HB1 ALA 14 1HB ALA 14 108.216 13.306 -7.632 83 HB2 ALA 14 2HB ALA 14 107.578 11.916 -6.751 84 HB3 ALA 14 3HB ALA 14 106.529 13.288 -7.116 85 H GLN 15 H GLN 15 104.830 11.723 -10.088 86 HA GLN 15 HA GLN 15 104.920 14.032 -11.761 87 HB2 GLN 15 1HB GLN 15 103.643 11.948 -12.304 88 HB3 GLN 15 2HB GLN 15 102.508 12.357 -11.018 89 HG2 GLN 15 1HG GLN 15 101.524 13.212 -13.006 90 HG3 GLN 15 2HG GLN 15 102.218 14.614 -12.194 91 HE21 GLN 15 1HE2 GLN 15 103.453 15.919 -13.543 92 HE22 GLN 15 2HE2 GLN 15 104.253 15.391 -14.944 93 H GLY 16 H GLY 16 104.464 16.035 -11.259 94 HA2 GLY 16 1HA GLY 16 103.220 17.792 -10.242 95 HA3 GLY 16 2HA GLY 16 102.732 16.679 -8.972 96 H GLN 17 H GLN 17 105.762 15.828 -8.944 97 HA GLN 17 HA GLN 17 106.789 18.182 -7.471 98 HB2 GLN 17 1HB GLN 17 107.490 15.263 -7.082 99 HB3 GLN 17 2HB GLN 17 108.174 16.615 -6.185 100 HG2 GLN 17 1HG GLN 17 105.242 15.845 -6.230 101 HG3 GLN 17 2HG GLN 17 106.362 15.522 -4.910 102 HE21 GLN 17 1HE2 GLN 17 103.903 17.534 -5.544 103 HE22 GLN 17 2HE2 GLN 17 104.448 18.953 -4.790 104 H MET 18 H MET 18 109.159 18.454 -7.581 105 HA MET 18 HA MET 18 110.142 17.796 -10.282 106 HB2 MET 18 1HB MET 18 110.981 19.909 -8.289 107 HB3 MET 18 2HB MET 18 111.804 19.613 -9.820 108 HG2 MET 18 1HG MET 18 109.656 20.014 -11.017 109 HG3 MET 18 2HG MET 18 108.899 20.409 -9.473 110 HE1 MET 18 3HE MET 18 108.818 22.393 -11.901 111 HE2 MET 18 1HE MET 18 109.093 23.898 -11.014 112 HE3 MET 18 2HE MET 18 108.104 22.624 -10.306 113 H ASN 19 H ASN 19 112.424 17.291 -10.528 114 HA ASN 19 HA ASN 19 114.396 16.245 -10.049 115 HB2 ASN 19 1HB ASN 19 114.338 17.881 -8.071 116 HB3 ASN 19 2HB ASN 19 113.809 16.500 -7.110 117 HD21 ASN 19 1HD2 ASN 19 115.470 15.233 -6.259 118 HD22 ASN 19 2HD2 ASN 19 117.064 15.208 -6.842 119 H LYS 20 H LYS 20 114.913 14.182 -10.120 120 HA LYS 20 HA LYS 20 113.023 12.141 -9.329 121 HB2 LYS 20 1HB LYS 20 114.404 12.027 -11.416 122 HB3 LYS 20 2HB LYS 20 115.838 11.849 -10.406 123 HG2 LYS 20 1HG LYS 20 114.954 9.788 -9.444 124 HG3 LYS 20 2HG LYS 20 113.450 9.985 -10.344 125 HD2 LYS 20 1HD LYS 20 114.823 8.408 -11.550 126 HD3 LYS 20 2HD LYS 20 114.798 9.913 -12.468 127 HE2 LYS 20 1HE LYS 20 116.977 9.530 -10.449 128 HE3 LYS 20 2HE LYS 20 117.085 8.654 -11.974 129 HZ1 LYS 20 3HZ LYS 20 116.331 11.214 -12.643 130 HZ2 LYS 20 1HZ LYS 20 117.859 10.510 -12.864 131 HZ3 LYS 20 2HZ LYS 20 117.534 11.406 -11.458 132 H MET 21 H MET 21 113.553 10.366 -7.861 133 HA MET 21 HA MET 21 115.485 11.180 -5.753 134 HB2 MET 21 1HB MET 21 112.814 9.785 -5.465 135 HB3 MET 21 2HB MET 21 113.962 10.042 -4.151 136 HG2 MET 21 1HG MET 21 113.853 12.510 -4.631 137 HG3 MET 21 2HG MET 21 112.555 12.177 -5.775 138 HE1 MET 21 3HE MET 21 109.685 10.846 -3.839 139 HE2 MET 21 1HE MET 21 110.975 9.648 -3.996 140 HE3 MET 21 2HE MET 21 110.655 10.779 -5.309 141 H GLY 22 H GLY 22 116.544 9.432 -4.623 142 HA2 GLY 22 1HA GLY 22 116.460 6.830 -6.033 143 HA3 GLY 22 2HA GLY 22 118.000 7.657 -5.810 144 H GLY 23 H GLY 23 116.622 5.093 -4.688 145 HA2 GLY 23 1HA GLY 23 117.640 5.496 -1.965 146 HA3 GLY 23 2HA GLY 23 115.978 4.945 -2.141 147 H PHE 24 H PHE 24 117.790 3.458 -0.754 148 HA PHE 24 HA PHE 24 118.190 1.102 -2.503 149 HB2 PHE 24 1HB PHE 24 120.011 2.051 -0.283 150 HB3 PHE 24 2HB PHE 24 120.185 0.542 -1.159 151 HD1 PHE 24 HD1 PHE 24 120.552 4.196 -1.301 152 HD2 PHE 24 HD2 PHE 24 120.991 0.515 -3.472 153 HE1 PHE 24 HE1 PHE 24 121.916 5.366 -3.010 154 HE2 PHE 24 HE2 PHE 24 122.354 1.685 -5.180 155 HZ PHE 24 HZ PHE 24 122.818 4.111 -4.950 156 H ASN 25 H ASN 25 118.012 -0.962 -1.359 157 HA ASN 25 HA ASN 25 116.742 -0.795 1.290 158 HB2 ASN 25 1HB ASN 25 114.869 -2.180 0.594 159 HB3 ASN 25 2HB ASN 25 114.925 -0.710 -0.373 160 HD21 ASN 25 1HD2 ASN 25 113.621 -3.134 -1.270 161 HD22 ASN 25 2HD2 ASN 25 114.473 -3.706 -2.622 162 H LEU 26 H LEU 26 116.834 -2.631 2.532 163 HA LEU 26 HA LEU 26 118.406 -4.905 1.468 164 HB2 LEU 26 1HB LEU 26 118.417 -3.843 4.309 165 HB3 LEU 26 2HB LEU 26 119.361 -5.201 3.697 166 HG LEU 26 HG LEU 26 119.592 -2.351 2.687 167 HD11 LEU 26 1HD1 LEU 26 121.824 -2.453 3.845 168 HD12 LEU 26 2HD1 LEU 26 121.314 -3.971 4.585 169 HD13 LEU 26 3HD1 LEU 26 120.451 -2.478 4.951 170 HD21 LEU 26 3HD2 LEU 26 120.942 -4.963 2.022 171 HD22 LEU 26 1HD2 LEU 26 121.800 -3.438 1.797 172 HD23 LEU 26 2HD2 LEU 26 120.297 -3.742 0.925 173 H LYS 27 H LYS 27 117.674 -6.987 2.134 174 HA LYS 27 HA LYS 27 114.904 -6.966 3.186 175 HB2 LYS 27 1HB LYS 27 115.943 -8.468 0.773 176 HB3 LYS 27 2HB LYS 27 114.319 -8.612 1.449 177 HG2 LYS 27 1HG LYS 27 113.852 -6.280 0.987 178 HG3 LYS 27 2HG LYS 27 115.518 -6.004 0.479 179 HD2 LYS 27 1HD LYS 27 114.201 -6.260 -1.521 180 HD3 LYS 27 2HD LYS 27 115.159 -7.729 -1.333 181 HE2 LYS 27 1HE LYS 27 113.242 -8.884 -0.334 182 HE3 LYS 27 2HE LYS 27 112.280 -7.409 -0.439 183 HZ1 LYS 27 3HZ LYS 27 112.471 -7.459 -2.824 184 HZ2 LYS 27 1HZ LYS 27 111.853 -8.944 -2.282 185 HZ3 LYS 27 2HZ LYS 27 113.480 -8.824 -2.757 186 H TYR 28 H TYR 28 114.319 -8.601 4.470 187 HA TYR 28 HA TYR 28 116.220 -10.839 4.882 188 HB2 TYR 28 1HB TYR 28 114.385 -9.551 6.909 189 HB3 TYR 28 2HB TYR 28 115.430 -10.928 7.203 190 HD1 TYR 28 HD1 TYR 28 117.935 -10.619 7.093 191 HD2 TYR 28 HD2 TYR 28 115.187 -7.320 7.017 192 HE1 TYR 28 HE1 TYR 28 119.774 -9.074 7.708 193 HE2 TYR 28 HE2 TYR 28 117.025 -5.774 7.631 194 HH TYR 28 HH TYR 28 120.255 -6.985 8.428 195 H ARG 29 H ARG 29 115.374 -12.889 4.883 196 HA ARG 29 HA ARG 29 112.452 -13.169 4.553 197 HB2 ARG 29 1HB ARG 29 113.598 -13.228 2.339 198 HB3 ARG 29 2HB ARG 29 114.532 -14.613 2.900 199 HG2 ARG 29 1HG ARG 29 112.419 -15.851 3.310 200 HG3 ARG 29 2HG ARG 29 111.511 -14.478 2.675 201 HD2 ARG 29 1HD ARG 29 112.766 -14.699 0.526 202 HD3 ARG 29 2HD ARG 29 113.542 -16.145 1.165 203 HE ARG 29 HE ARG 29 110.867 -16.640 1.467 204 HH11 ARG 29 1HH1 ARG 29 112.857 -15.761 -1.289 205 HH12 ARG 29 2HH1 ARG 29 111.829 -16.581 -2.418 206 HH21 ARG 29 1HH2 ARG 29 109.583 -17.676 -0.034 207 HH22 ARG 29 2HH2 ARG 29 110.000 -17.650 -1.714 208 H TYR 30 H TYR 30 111.537 -14.949 5.498 209 HA TYR 30 HA TYR 30 113.367 -16.833 6.878 210 HB2 TYR 30 1HB TYR 30 112.265 -15.154 8.399 211 HB3 TYR 30 2HB TYR 30 110.721 -15.848 7.941 212 HD1 TYR 30 HD2 TYR 30 113.843 -16.356 9.807 213 HD2 TYR 30 HD1 TYR 30 110.066 -18.082 8.710 214 HE1 TYR 30 HE2 TYR 30 114.120 -18.078 11.570 215 HE2 TYR 30 HE1 TYR 30 110.343 -19.805 10.473 216 HH TYR 30 HH TYR 30 113.054 -20.647 11.809 217 H GLU 31 H GLU 31 112.770 -18.981 6.886 218 HA GLU 31 HA GLU 31 110.410 -19.686 5.229 219 HB2 GLU 31 1HB GLU 31 112.665 -19.977 4.118 220 HB3 GLU 31 2HB GLU 31 113.023 -21.200 5.338 221 HG2 GLU 31 1HG GLU 31 112.162 -22.368 3.431 222 HG3 GLU 31 2HG GLU 31 110.888 -22.373 4.647 223 H GLU 32 H GLU 32 109.189 -21.446 5.871 224 HA GLU 32 HA GLU 32 109.770 -22.513 8.557 225 HB2 GLU 32 1HB GLU 32 107.239 -22.625 6.899 226 HB3 GLU 32 2HB GLU 32 107.419 -23.267 8.531 227 HG2 GLU 32 1HG GLU 32 107.813 -20.367 7.746 228 HG3 GLU 32 2HG GLU 32 106.378 -21.015 8.527 229 H ASP 33 H ASP 33 109.928 -24.725 8.942 230 HA ASP 33 HA ASP 33 111.086 -26.176 6.761 231 HB2 ASP 33 1HB ASP 33 110.474 -27.004 9.600 232 HB3 ASP 33 2HB ASP 33 111.411 -27.959 8.455 233 H ASN 34 H ASN 34 108.067 -26.600 8.645 234 HA ASN 34 HA ASN 34 107.411 -28.906 6.918 235 HB2 ASN 34 1HB ASN 34 106.198 -28.057 9.549 236 HB3 ASN 34 2HB ASN 34 105.804 -29.520 8.649 237 HD21 ASN 34 1HD2 ASN 34 108.361 -30.390 7.851 238 HD22 ASN 34 2HD2 ASN 34 109.285 -30.757 9.228 239 H SER 35 H SER 35 106.492 -25.629 7.383 240 HA SER 35 HA SER 35 104.315 -26.006 5.466 241 HB2 SER 35 1HB SER 35 103.949 -24.657 8.153 242 HB3 SER 35 2HB SER 35 102.802 -24.552 6.822 243 HG SER 35 HG SER 35 102.146 -26.253 8.057 244 HA PRO 36 HA PRO 36 107.416 -22.667 4.811 245 HB2 PRO 36 1HB PRO 36 107.121 -22.469 2.062 246 HB3 PRO 36 2HB PRO 36 108.226 -23.583 2.885 247 HG2 PRO 36 1HG PRO 36 105.537 -24.100 1.732 248 HG3 PRO 36 2HG PRO 36 106.990 -25.118 1.723 249 HD2 PRO 36 1HD PRO 36 104.935 -25.595 3.419 250 HD3 PRO 36 2HD PRO 36 106.625 -25.909 3.878 251 H LEU 37 H LEU 37 107.039 -20.591 5.049 252 HA LEU 37 HA LEU 37 104.784 -19.312 3.628 253 HB2 LEU 37 1HB LEU 37 105.877 -18.568 6.358 254 HB3 LEU 37 2HB LEU 37 104.559 -17.758 5.510 255 HG LEU 37 HG LEU 37 104.526 -20.678 6.330 256 HD11 LEU 37 1HD1 LEU 37 104.392 -19.484 8.363 257 HD12 LEU 37 2HD1 LEU 37 102.703 -19.734 7.917 258 HD13 LEU 37 3HD1 LEU 37 103.469 -18.171 7.632 259 HD21 LEU 37 3HD2 LEU 37 102.056 -20.360 5.841 260 HD22 LEU 37 1HD2 LEU 37 103.100 -20.286 4.421 261 HD23 LEU 37 2HD2 LEU 37 102.469 -18.800 5.131 262 H GLY 38 H GLY 38 105.368 -17.482 2.429 263 HA2 GLY 38 1HA GLY 38 108.248 -16.861 2.427 264 HA3 GLY 38 2HA GLY 38 107.094 -16.428 1.166 265 H VAL 39 H VAL 39 108.864 -15.205 3.699 266 HA VAL 39 HA VAL 39 107.034 -12.878 3.940 267 HB VAL 39 HB VAL 39 107.928 -12.551 6.221 268 HG11 VAL 39 1HG1 VAL 39 105.831 -13.796 5.897 269 HG12 VAL 39 2HG1 VAL 39 106.734 -14.454 7.262 270 HG13 VAL 39 3HG1 VAL 39 106.741 -15.296 5.712 271 HG21 VAL 39 3HG2 VAL 39 109.139 -14.527 7.247 272 HG22 VAL 39 1HG2 VAL 39 110.081 -13.632 6.055 273 HG23 VAL 39 2HG2 VAL 39 109.334 -15.168 5.617 274 H ILE 40 H ILE 40 107.874 -11.024 3.303 275 HA ILE 40 HA ILE 40 110.826 -10.725 3.264 276 HB ILE 40 HB ILE 40 108.844 -9.596 1.265 277 HG12 ILE 40 1HG1 ILE 40 110.947 -11.752 0.887 278 HG13 ILE 40 2HG1 ILE 40 109.226 -12.080 1.100 279 HG21 ILE 40 1HG2 ILE 40 110.921 -8.235 1.752 280 HG22 ILE 40 2HG2 ILE 40 110.781 -8.785 0.083 281 HG23 ILE 40 3HG2 ILE 40 111.874 -9.611 1.195 282 HD11 ILE 40 3HD1 ILE 40 110.624 -10.756 -1.207 283 HD12 ILE 40 1HD1 ILE 40 108.933 -10.378 -0.876 284 HD13 ILE 40 2HD1 ILE 40 109.413 -12.039 -1.228 285 H GLY 41 H GLY 41 111.535 -9.075 4.444 286 HA2 GLY 41 1HA GLY 41 109.760 -6.719 4.804 287 HA3 GLY 41 2HA GLY 41 110.799 -7.324 6.095 288 H SER 42 H SER 42 110.640 -4.829 4.134 289 HA SER 42 HA SER 42 113.553 -4.757 3.607 290 HB2 SER 42 1HB SER 42 113.214 -3.740 1.496 291 HB3 SER 42 2HB SER 42 112.103 -5.104 1.541 292 HG SER 42 HG SER 42 111.617 -2.363 1.628 293 H PHE 43 H PHE 43 114.603 -2.975 4.243 294 HA PHE 43 HA PHE 43 113.004 -0.683 5.225 295 HB2 PHE 43 1HB PHE 43 115.879 -1.445 5.783 296 HB3 PHE 43 2HB PHE 43 115.047 -0.051 6.448 297 HD1 PHE 43 HD1 PHE 43 113.269 -0.343 8.143 298 HD2 PHE 43 HD2 PHE 43 115.515 -3.674 6.624 299 HE1 PHE 43 HE1 PHE 43 112.481 -1.737 10.037 300 HE2 PHE 43 HE2 PHE 43 114.728 -5.069 8.519 301 HZ PHE 43 HZ PHE 43 113.210 -4.100 10.224 302 H THR 44 H THR 44 113.044 1.149 4.002 303 HA THR 44 HA THR 44 115.068 1.260 1.825 304 HB THR 44 HB THR 44 112.239 2.326 1.762 305 HG1 THR 44 HG1 THR 44 111.676 0.473 0.911 306 HG21 THR 44 3HG2 THR 44 112.776 2.348 -0.725 307 HG22 THR 44 1HG2 THR 44 114.458 2.070 -0.276 308 HG23 THR 44 2HG2 THR 44 113.638 3.541 0.247 309 H TYR 45 H TYR 45 116.241 3.041 1.620 310 HA TYR 45 HA TYR 45 115.396 5.490 3.065 311 HB2 TYR 45 1HB TYR 45 118.207 4.512 2.527 312 HB3 TYR 45 2HB TYR 45 117.785 6.032 3.292 313 HD1 TYR 45 HD1 TYR 45 117.987 2.385 3.692 314 HD2 TYR 45 HD2 TYR 45 116.949 6.095 5.591 315 HE1 TYR 45 HE1 TYR 45 117.971 1.252 5.899 316 HE2 TYR 45 HE2 TYR 45 116.934 4.963 7.797 317 HH TYR 45 HH TYR 45 116.529 2.316 8.500 318 H THR 46 H THR 46 115.005 7.149 1.748 319 HA THR 46 HA THR 46 116.180 7.126 -0.975 320 HB THR 46 HB THR 46 113.452 8.172 -0.181 321 HG1 THR 46 HG1 THR 46 114.048 5.887 -1.728 322 HG21 THR 46 3HG2 THR 46 113.109 8.395 -2.574 323 HG22 THR 46 1HG2 THR 46 114.682 7.671 -2.904 324 HG23 THR 46 2HG2 THR 46 114.585 9.256 -2.136 325 H GLU 47 H GLU 47 116.919 9.052 -1.788 326 HA GLU 47 HA GLU 47 116.925 11.369 0.051 327 HB2 GLU 47 1HB GLU 47 119.067 10.072 0.157 328 HB3 GLU 47 2HB GLU 47 119.293 10.393 -1.563 329 HG2 GLU 47 1HG GLU 47 119.179 12.834 -1.092 330 HG3 GLU 47 2HG GLU 47 119.053 12.475 0.625 331 H LYS 48 H LYS 48 116.905 13.368 -0.904 332 HA LYS 48 HA LYS 48 116.269 13.429 -3.777 333 HB2 LYS 48 1HB LYS 48 114.650 14.427 -2.151 334 HB3 LYS 48 2HB LYS 48 115.890 15.597 -1.699 335 HG2 LYS 48 1HG LYS 48 116.021 16.335 -4.072 336 HG3 LYS 48 2HG LYS 48 114.709 15.223 -4.467 337 HD2 LYS 48 1HD LYS 48 113.279 16.396 -2.775 338 HD3 LYS 48 2HD LYS 48 114.573 17.576 -2.561 339 HE2 LYS 48 1HE LYS 48 113.152 16.975 -5.172 340 HE3 LYS 48 2HE LYS 48 112.893 18.401 -4.168 341 HZ1 LYS 48 3HZ LYS 48 115.462 18.620 -4.422 342 HZ2 LYS 48 1HZ LYS 48 114.428 19.180 -5.647 343 HZ3 LYS 48 2HZ LYS 48 115.210 17.680 -5.815 344 H SER 49 H SER 49 117.491 14.574 -5.219 345 HA SER 49 HA SER 49 120.131 15.403 -4.298 346 HB2 SER 49 1HB SER 49 119.869 14.010 -6.344 347 HB3 SER 49 2HB SER 49 118.991 15.333 -7.102 348 HG SER 49 HG SER 49 121.006 15.773 -7.696 349 H ARG 50 H ARG 50 120.897 17.452 -4.274 350 HA ARG 50 HA ARG 50 119.012 19.585 -4.111 351 HB2 ARG 50 1HB ARG 50 122.038 19.607 -4.154 352 HB3 ARG 50 2HB ARG 50 121.027 20.998 -3.767 353 HG2 ARG 50 1HG ARG 50 120.022 19.749 -1.888 354 HG3 ARG 50 2HG ARG 50 121.049 18.364 -2.265 355 HD2 ARG 50 1HD ARG 50 122.120 19.587 -0.487 356 HD3 ARG 50 2HD ARG 50 123.050 19.861 -1.957 357 HE ARG 50 HE ARG 50 120.995 21.841 -1.352 358 HH11 ARG 50 1HH1 ARG 50 124.400 21.008 -1.147 359 HH12 ARG 50 2HH1 ARG 50 124.890 22.654 -0.919 360 HH21 ARG 50 1HH2 ARG 50 121.688 23.940 -1.055 361 HH22 ARG 50 2HH2 ARG 50 123.374 24.291 -0.868 362 H THR 51 H THR 51 118.623 21.279 -5.477 363 HA THR 51 HA THR 51 119.973 21.258 -8.113 364 HB THR 51 HB THR 51 117.855 21.905 -9.150 365 HG1 THR 51 HG1 THR 51 115.967 21.803 -7.825 366 HG21 THR 51 3HG2 THR 51 118.449 19.479 -8.846 367 HG22 THR 51 1HG2 THR 51 116.716 19.780 -8.975 368 HG23 THR 51 2HG2 THR 51 117.442 19.469 -7.398 369 H ALA 52 H ALA 52 120.344 23.286 -9.050 370 HA ALA 52 HA ALA 52 120.256 25.523 -7.134 371 HB1 ALA 52 1HB ALA 52 122.401 24.682 -8.384 372 HB2 ALA 52 2HB ALA 52 122.112 26.412 -8.211 373 HB3 ALA 52 3HB ALA 52 121.744 25.605 -9.734 374 H SER 53 H SER 53 118.811 27.087 -7.392 375 HA SER 53 HA SER 53 118.218 28.365 -9.814 376 HB2 SER 53 1HB SER 53 115.786 27.602 -10.000 377 HB3 SER 53 2HB SER 53 117.008 26.466 -10.563 378 HG SER 53 HG SER 53 116.408 25.147 -9.040 379 H SER 54 H SER 54 116.057 27.342 -7.161 380 HA SER 54 HA SER 54 115.011 29.913 -6.691 381 HB2 SER 54 1HB SER 54 115.202 27.601 -4.748 382 HB3 SER 54 2HB SER 54 114.109 28.976 -4.630 383 HG SER 54 HG SER 54 113.990 26.722 -6.205 384 H GLY 55 H GLY 55 117.798 28.239 -5.308 385 HA2 GLY 55 1HA GLY 55 119.667 29.235 -4.313 386 HA3 GLY 55 2HA GLY 55 118.797 30.761 -4.252 387 H ASP 56 H ASP 56 117.168 27.954 -3.001 388 HA ASP 56 HA ASP 56 117.801 28.806 -0.233 389 HB2 ASP 56 1HB ASP 56 115.496 29.435 -0.951 390 HB3 ASP 56 2HB ASP 56 115.159 27.730 -1.244 391 H TYR 57 H TYR 57 118.368 27.224 1.172 392 HA TYR 57 HA TYR 57 119.013 24.636 0.116 393 HB2 TYR 57 1HB TYR 57 120.366 25.789 1.843 394 HB3 TYR 57 2HB TYR 57 119.039 25.610 2.975 395 HD1 TYR 57 HD1 TYR 57 121.632 23.817 1.042 396 HD2 TYR 57 HD2 TYR 57 118.598 23.506 4.065 397 HE1 TYR 57 HE1 TYR 57 122.499 21.584 1.681 398 HE2 TYR 57 HE2 TYR 57 119.465 21.272 4.704 399 HH TYR 57 HH TYR 57 121.034 19.380 3.092 400 H ASN 58 H ASN 58 117.751 22.907 0.018 401 HA ASN 58 HA ASN 58 115.611 22.556 2.008 402 HB2 ASN 58 1HB ASN 58 114.629 23.561 -0.056 403 HB3 ASN 58 2HB ASN 58 115.210 22.169 -0.968 404 HD21 ASN 58 1HD2 ASN 58 113.130 22.983 1.859 405 HD22 ASN 58 2HD2 ASN 58 112.094 21.654 1.660 406 H LYS 59 H LYS 59 115.874 20.628 2.934 407 HA LYS 59 HA LYS 59 116.935 18.392 1.304 408 HB2 LYS 59 1HB LYS 59 118.658 19.326 2.859 409 HB3 LYS 59 2HB LYS 59 117.589 18.943 4.209 410 HG2 LYS 59 1HG LYS 59 119.067 17.092 4.060 411 HG3 LYS 59 2HG LYS 59 117.575 16.538 3.300 412 HD2 LYS 59 1HD LYS 59 118.486 17.001 1.082 413 HD3 LYS 59 2HD LYS 59 119.951 17.674 1.797 414 HE2 LYS 59 1HE LYS 59 120.090 15.326 2.990 415 HE3 LYS 59 2HE LYS 59 119.052 14.816 1.659 416 HZ1 LYS 59 3HZ LYS 59 121.005 16.351 0.498 417 HZ2 LYS 59 1HZ LYS 59 120.889 14.659 0.454 418 HZ3 LYS 59 2HZ LYS 59 121.833 15.414 1.648 419 H ASN 60 H ASN 60 115.569 16.748 1.227 420 HA ASN 60 HA ASN 60 113.779 16.246 3.532 421 HB2 ASN 60 1HB ASN 60 112.632 17.272 1.506 422 HB3 ASN 60 2HB ASN 60 113.017 15.784 0.647 423 HD21 ASN 60 1HD2 ASN 60 110.308 16.555 1.111 424 HD22 ASN 60 2HD2 ASN 60 109.614 15.454 2.200 425 H GLN 61 H GLN 61 113.808 14.212 4.281 426 HA GLN 61 HA GLN 61 115.078 12.114 2.607 427 HB2 GLN 61 1HB GLN 61 115.294 12.529 5.600 428 HB3 GLN 61 2HB GLN 61 115.917 11.127 4.728 429 HG2 GLN 61 1HG GLN 61 117.388 12.562 3.404 430 HG3 GLN 61 2HG GLN 61 116.725 13.997 4.180 431 HE21 GLN 61 1HE2 GLN 61 119.522 13.369 4.306 432 HE22 GLN 61 2HE2 GLN 61 119.909 13.001 5.918 433 H TYR 62 H TYR 62 114.118 10.096 2.628 434 HA TYR 62 HA TYR 62 111.558 9.873 4.114 435 HB2 TYR 62 1HB TYR 62 112.178 8.893 1.326 436 HB3 TYR 62 2HB TYR 62 110.683 8.608 2.196 437 HD1 TYR 62 HD2 TYR 62 109.056 10.406 2.525 438 HD2 TYR 62 HD1 TYR 62 112.728 11.077 0.400 439 HE1 TYR 62 HE2 TYR 62 108.154 12.540 1.639 440 HE2 TYR 62 HE1 TYR 62 111.826 13.212 -0.485 441 HH TYR 62 HH TYR 62 108.608 14.008 -0.429 442 H TYR 63 H TYR 63 111.199 8.038 5.196 443 HA TYR 63 HA TYR 63 112.993 5.724 4.732 444 HB2 TYR 63 1HB TYR 63 113.554 6.953 6.822 445 HB3 TYR 63 2HB TYR 63 111.915 6.695 7.385 446 HD1 TYR 63 HD1 TYR 63 114.222 4.336 5.619 447 HD2 TYR 63 HD2 TYR 63 112.138 5.296 9.250 448 HE1 TYR 63 HE1 TYR 63 114.927 2.168 6.598 449 HE2 TYR 63 HE2 TYR 63 112.840 3.128 10.228 450 HH TYR 63 HH TYR 63 113.614 0.989 9.589 451 H GLY 64 H GLY 64 111.947 3.758 4.542 452 HA2 GLY 64 1HA GLY 64 109.008 3.775 4.976 453 HA3 GLY 64 2HA GLY 64 109.713 3.202 3.471 454 H ILE 65 H ILE 65 108.136 1.984 5.830 455 HA ILE 65 HA ILE 65 109.874 -0.394 6.189 456 HB ILE 65 HB ILE 65 107.573 0.493 7.947 457 HG12 ILE 65 1HG1 ILE 65 109.448 2.061 8.176 458 HG13 ILE 65 2HG1 ILE 65 109.300 1.064 9.620 459 HG21 ILE 65 1HG2 ILE 65 109.584 -1.755 8.084 460 HG22 ILE 65 2HG2 ILE 65 107.824 -1.866 8.082 461 HG23 ILE 65 3HG2 ILE 65 108.665 -1.224 9.493 462 HD11 ILE 65 3HD1 ILE 65 111.276 0.642 7.354 463 HD12 ILE 65 1HD1 ILE 65 111.112 -0.412 8.758 464 HD13 ILE 65 2HD1 ILE 65 111.653 1.251 8.964 465 H THR 66 H THR 66 109.116 -2.252 5.287 466 HA THR 66 HA THR 66 106.290 -2.320 4.416 467 HB THR 66 HB THR 66 106.903 -3.080 2.223 468 HG1 THR 66 HG1 THR 66 108.713 -4.122 2.179 469 HG21 THR 66 3HG2 THR 66 106.825 -0.691 2.318 470 HG22 THR 66 1HG2 THR 66 108.257 -1.111 1.382 471 HG23 THR 66 2HG2 THR 66 108.421 -0.603 3.061 472 H ALA 67 H ALA 67 105.509 -4.449 3.875 473 HA ALA 67 HA ALA 67 107.168 -6.759 4.477 474 HB1 ALA 67 1HB ALA 67 106.472 -6.561 6.688 475 HB2 ALA 67 2HB ALA 67 105.195 -7.576 6.018 476 HB3 ALA 67 3HB ALA 67 104.921 -5.849 6.243 477 H GLY 68 H GLY 68 106.332 -8.668 3.523 478 HA2 GLY 68 1HA GLY 68 103.710 -8.502 2.241 479 HA3 GLY 68 2HA GLY 68 105.098 -8.633 1.186 480 HA PRO 69 HA PRO 69 104.268 -13.022 2.865 481 HB2 PRO 69 1HB PRO 69 101.865 -13.871 1.921 482 HB3 PRO 69 2HB PRO 69 102.067 -13.188 3.548 483 HG2 PRO 69 1HG PRO 69 101.014 -11.909 1.081 484 HG3 PRO 69 2HG PRO 69 100.467 -11.751 2.761 485 HD2 PRO 69 1HD PRO 69 102.039 -9.882 1.503 486 HD3 PRO 69 2HD PRO 69 102.024 -10.134 3.261 487 H ALA 70 H ALA 70 104.365 -14.940 1.371 488 HA ALA 70 HA ALA 70 104.315 -14.203 -1.493 489 HB1 ALA 70 1HB ALA 70 106.441 -16.109 -0.799 490 HB2 ALA 70 2HB ALA 70 106.666 -14.513 -0.085 491 HB3 ALA 70 3HB ALA 70 106.487 -14.679 -1.828 492 H TYR 71 H TYR 71 104.076 -16.042 -2.941 493 HA TYR 71 HA TYR 71 102.711 -18.323 -1.631 494 HB2 TYR 71 1HB TYR 71 101.958 -16.925 -4.202 495 HB3 TYR 71 2HB TYR 71 101.185 -18.362 -3.561 496 HD1 TYR 71 HD1 TYR 71 101.604 -14.727 -3.213 497 HD2 TYR 71 HD2 TYR 71 99.696 -18.232 -1.623 498 HE1 TYR 71 HE1 TYR 71 100.056 -13.293 -1.910 499 HE2 TYR 71 HE2 TYR 71 98.148 -16.798 -0.320 500 HH TYR 71 HH TYR 71 97.489 -13.795 -0.912 501 H ARG 72 H ARG 72 103.441 -20.266 -2.201 502 HA ARG 72 HA ARG 72 105.333 -20.446 -4.466 503 HB2 ARG 72 1HB ARG 72 104.997 -22.214 -2.029 504 HB3 ARG 72 2HB ARG 72 106.151 -22.494 -3.335 505 HG2 ARG 72 1HG ARG 72 107.205 -20.311 -2.881 506 HG3 ARG 72 2HG ARG 72 106.056 -20.025 -1.575 507 HD2 ARG 72 1HD ARG 72 108.073 -20.851 -0.567 508 HD3 ARG 72 2HD ARG 72 106.890 -22.149 -0.494 509 HE ARG 72 HE ARG 72 109.284 -22.046 -2.175 510 HH11 ARG 72 1HH1 ARG 72 106.318 -23.764 -1.398 511 HH12 ARG 72 2HH1 ARG 72 106.878 -25.240 -2.106 512 HH21 ARG 72 1HH2 ARG 72 109.940 -23.975 -3.072 513 HH22 ARG 72 2HH2 ARG 72 108.898 -25.358 -3.043 514 H ILE 73 H ILE 73 104.859 -21.670 -6.159 515 HA ILE 73 HA ILE 73 102.538 -23.505 -6.009 516 HB ILE 73 HB ILE 73 103.355 -21.753 -8.348 517 HG12 ILE 73 1HG1 ILE 73 100.868 -21.573 -6.626 518 HG13 ILE 73 2HG1 ILE 73 102.297 -20.579 -6.348 519 HG21 ILE 73 1HG2 ILE 73 102.348 -23.770 -9.172 520 HG22 ILE 73 2HG2 ILE 73 101.088 -22.537 -9.210 521 HG23 ILE 73 3HG2 ILE 73 101.108 -23.737 -7.919 522 HD11 ILE 73 3HD1 ILE 73 100.457 -20.585 -8.737 523 HD12 ILE 73 1HD1 ILE 73 102.088 -19.922 -8.839 524 HD13 ILE 73 2HD1 ILE 73 100.922 -19.227 -7.712 525 H ASN 74 H ASN 74 102.657 -25.301 -7.579 526 HA ASN 74 HA ASN 74 104.962 -26.787 -7.498 527 HB2 ASN 74 1HB ASN 74 102.869 -26.782 -9.680 528 HB3 ASN 74 2HB ASN 74 104.048 -28.065 -9.409 529 HD21 ASN 74 1HD2 ASN 74 104.019 -28.264 -6.600 530 HD22 ASN 74 2HD2 ASN 74 102.474 -28.744 -6.087 531 H ASP 75 H ASP 75 104.121 -24.316 -9.874 532 HA ASP 75 HA ASP 75 106.392 -24.737 -11.559 533 HB2 ASP 75 1HB ASP 75 104.337 -23.480 -12.243 534 HB3 ASP 75 2HB ASP 75 104.808 -22.191 -11.138 535 H TRP 76 H TRP 76 108.412 -23.858 -11.451 536 HA TRP 76 HA TRP 76 109.573 -23.374 -8.993 537 HB2 TRP 76 1HB TRP 76 111.491 -22.485 -10.250 538 HB3 TRP 76 2HB TRP 76 110.873 -23.979 -10.928 539 HD1 TRP 76 HD1 TRP 76 109.258 -23.666 -13.155 540 HE1 TRP 76 HE1 TRP 76 109.493 -21.973 -15.082 541 HE3 TRP 76 HE3 TRP 76 112.246 -20.187 -10.910 542 HZ2 TRP 76 HZ2 TRP 76 110.782 -19.469 -15.606 543 HZ3 TRP 76 HZ3 TRP 76 112.963 -18.163 -12.142 544 HH2 TRP 76 HH2 TRP 76 112.236 -17.798 -14.484 545 H ALA 77 H ALA 77 108.035 -21.054 -11.146 546 HA ALA 77 HA ALA 77 109.149 -18.702 -10.042 547 HB1 ALA 77 1HB ALA 77 107.589 -17.536 -11.328 548 HB2 ALA 77 2HB ALA 77 106.370 -18.802 -11.174 549 HB3 ALA 77 3HB ALA 77 107.769 -19.047 -12.219 550 H SER 78 H SER 78 108.558 -17.406 -8.380 551 HA SER 78 HA SER 78 106.231 -18.214 -6.734 552 HB2 SER 78 1HB SER 78 108.403 -18.759 -5.635 553 HB3 SER 78 2HB SER 78 108.851 -17.060 -5.744 554 HG SER 78 HG SER 78 106.998 -16.589 -4.482 555 H ILE 79 H ILE 79 105.117 -16.443 -5.659 556 HA ILE 79 HA ILE 79 105.648 -13.807 -6.937 557 HB ILE 79 HB ILE 79 102.921 -15.021 -6.397 558 HG12 ILE 79 1HG1 ILE 79 104.264 -14.508 -9.066 559 HG13 ILE 79 2HG1 ILE 79 104.209 -16.091 -8.294 560 HG21 ILE 79 1HG2 ILE 79 102.947 -12.581 -6.235 561 HG22 ILE 79 2HG2 ILE 79 102.145 -13.060 -7.728 562 HG23 ILE 79 3HG2 ILE 79 103.804 -12.465 -7.772 563 HD11 ILE 79 3HD1 ILE 79 101.940 -14.456 -9.406 564 HD12 ILE 79 1HD1 ILE 79 101.637 -15.665 -8.158 565 HD13 ILE 79 2HD1 ILE 79 102.335 -16.149 -9.703 566 H TYR 80 H TYR 80 105.192 -11.974 -5.607 567 HA TYR 80 HA TYR 80 104.027 -12.510 -2.976 568 HB2 TYR 80 1HB TYR 80 105.804 -11.542 -1.731 569 HB3 TYR 80 2HB TYR 80 106.485 -12.793 -2.748 570 HD1 TYR 80 HD1 TYR 80 107.803 -12.151 -4.790 571 HD2 TYR 80 HD2 TYR 80 106.463 -9.263 -1.907 572 HE1 TYR 80 HE1 TYR 80 109.450 -10.515 -5.662 573 HE2 TYR 80 HE2 TYR 80 108.109 -7.626 -2.781 574 HH TYR 80 HH TYR 80 109.784 -7.282 -4.194 575 H GLY 81 H GLY 81 103.399 -10.594 -1.828 576 HA2 GLY 81 1HA GLY 81 103.226 -8.150 -3.496 577 HA3 GLY 81 2HA GLY 81 101.793 -8.784 -2.685 578 H VAL 82 H VAL 82 103.191 -6.194 -2.276 579 HA VAL 82 HA VAL 82 103.956 -6.495 0.558 580 HB VAL 82 HB VAL 82 105.585 -4.940 -1.467 581 HG11 VAL 82 1HG1 VAL 82 107.187 -4.776 0.403 582 HG12 VAL 82 2HG1 VAL 82 106.059 -5.649 1.442 583 HG13 VAL 82 3HG1 VAL 82 105.637 -4.051 0.827 584 HG21 VAL 82 3HG2 VAL 82 107.253 -6.667 -1.318 585 HG22 VAL 82 1HG2 VAL 82 105.733 -7.469 -1.707 586 HG23 VAL 82 2HG2 VAL 82 106.357 -7.510 -0.057 587 H VAL 83 H VAL 83 103.519 -4.750 1.840 588 HA VAL 83 HA VAL 83 102.697 -2.222 0.592 589 HB VAL 83 HB VAL 83 100.764 -2.047 2.139 590 HG11 VAL 83 1HG1 VAL 83 99.300 -3.503 0.890 591 HG12 VAL 83 2HG1 VAL 83 100.635 -4.579 0.478 592 HG13 VAL 83 3HG1 VAL 83 100.565 -2.957 -0.211 593 HG21 VAL 83 3HG2 VAL 83 101.497 -3.556 3.902 594 HG22 VAL 83 1HG2 VAL 83 101.521 -4.916 2.780 595 HG23 VAL 83 2HG2 VAL 83 99.987 -4.173 3.232 596 H GLY 84 H GLY 84 102.974 -0.384 2.044 597 HA2 GLY 84 1HA GLY 84 103.879 -0.756 4.735 598 HA3 GLY 84 2HA GLY 84 105.227 -0.444 3.653 599 H VAL 85 H VAL 85 105.352 1.430 5.215 600 HA VAL 85 HA VAL 85 103.772 3.698 4.181 601 HB VAL 85 HB VAL 85 102.727 2.955 6.286 602 HG11 VAL 85 1HG1 VAL 85 104.773 1.948 7.288 603 HG12 VAL 85 2HG1 VAL 85 103.959 3.059 8.390 604 HG13 VAL 85 3HG1 VAL 85 105.418 3.571 7.541 605 HG21 VAL 85 3HG2 VAL 85 102.845 5.123 7.463 606 HG22 VAL 85 1HG2 VAL 85 102.746 5.356 5.718 607 HG23 VAL 85 2HG2 VAL 85 104.291 5.542 6.547 608 H GLY 86 H GLY 86 104.873 5.612 4.052 609 HA2 GLY 86 1HA GLY 86 107.728 5.573 4.867 610 HA3 GLY 86 2HA GLY 86 107.194 6.216 3.316 611 H TYR 87 H TYR 87 108.508 7.390 5.811 612 HA TYR 87 HA TYR 87 106.649 9.676 6.150 613 HB2 TYR 87 1HB TYR 87 108.719 8.623 8.084 614 HB3 TYR 87 2HB TYR 87 107.731 10.051 8.328 615 HD1 TYR 87 HD1 TYR 87 105.227 9.793 8.558 616 HD2 TYR 87 HD2 TYR 87 107.915 6.443 8.570 617 HE1 TYR 87 HE1 TYR 87 103.462 8.381 9.579 618 HE2 TYR 87 HE2 TYR 87 106.152 5.031 9.591 619 HH TYR 87 HH TYR 87 104.134 5.058 10.604 620 H GLY 88 H GLY 88 107.417 11.657 5.708 621 HA2 GLY 88 1HA GLY 88 110.247 11.897 4.873 622 HA3 GLY 88 2HA GLY 88 108.920 12.769 4.115 623 H LYS 89 H LYS 89 111.456 13.454 5.722 624 HA LYS 89 HA LYS 89 110.198 15.486 7.469 625 HB2 LYS 89 1HB LYS 89 112.796 14.019 7.994 626 HB3 LYS 89 2HB LYS 89 112.070 15.253 9.021 627 HG2 LYS 89 1HG LYS 89 110.757 12.609 8.331 628 HG3 LYS 89 2HG LYS 89 111.624 12.933 9.833 629 HD2 LYS 89 1HD LYS 89 110.054 14.868 10.227 630 HD3 LYS 89 2HD LYS 89 109.119 14.315 8.838 631 HE2 LYS 89 1HE LYS 89 108.339 12.437 9.931 632 HE3 LYS 89 2HE LYS 89 109.764 12.308 10.963 633 HZ1 LYS 89 3HZ LYS 89 107.651 13.074 12.064 634 HZ2 LYS 89 1HZ LYS 89 107.823 14.528 11.209 635 HZ3 LYS 89 2HZ LYS 89 109.018 14.049 12.317 636 H PHE 90 H PHE 90 111.045 17.541 7.300 637 HA PHE 90 HA PHE 90 113.427 17.908 5.581 638 HB2 PHE 90 1HB PHE 90 112.380 19.823 4.531 639 HB3 PHE 90 2HB PHE 90 111.395 18.394 4.284 640 HD1 PHE 90 HD1 PHE 90 109.265 18.110 5.547 641 HD2 PHE 90 HD2 PHE 90 111.593 21.713 5.779 642 HE1 PHE 90 HE1 PHE 90 107.313 19.310 6.496 643 HE2 PHE 90 HE2 PHE 90 109.641 22.912 6.728 644 HZ PHE 90 HZ PHE 90 107.501 21.711 7.087 645 H GLN 91 H GLN 91 114.601 19.883 5.978 646 HA GLN 91 HA GLN 91 114.266 20.833 8.761 647 HB2 GLN 91 1HB GLN 91 116.715 20.926 6.985 648 HB3 GLN 91 2HB GLN 91 116.636 21.406 8.678 649 HG2 GLN 91 1HG GLN 91 116.135 18.616 7.602 650 HG3 GLN 91 2HG GLN 91 117.580 19.144 8.459 651 HE21 GLN 91 1HE2 GLN 91 115.005 17.291 9.041 652 HE22 GLN 91 2HE2 GLN 91 114.675 17.686 10.658 653 H THR 92 H THR 92 113.426 22.777 8.989 654 HA THR 92 HA THR 92 114.288 24.952 7.222 655 HB THR 92 HB THR 92 111.368 24.429 7.837 656 HG1 THR 92 HG1 THR 92 112.561 24.331 5.297 657 HG21 THR 92 3HG2 THR 92 111.695 26.764 7.582 658 HG22 THR 92 1HG2 THR 92 111.159 26.210 5.995 659 HG23 THR 92 2HG2 THR 92 112.868 26.539 6.284 660 H THR 93 H THR 93 113.919 27.083 8.182 661 HA THR 93 HA THR 93 113.728 26.965 11.122 662 HB THR 93 HB THR 93 114.534 29.282 9.344 663 HG1 THR 93 HG1 THR 93 116.456 28.457 9.361 664 HG21 THR 93 3HG2 THR 93 114.760 28.783 12.325 665 HG22 THR 93 1HG2 THR 93 113.739 29.987 11.538 666 HG23 THR 93 2HG2 THR 93 115.495 30.144 11.479 667 H GLU 94 H GLU 94 111.974 27.663 12.152 668 HA GLU 94 HA GLU 94 110.079 29.563 11.402 669 HB2 GLU 94 1HB GLU 94 109.758 28.002 9.423 670 HB3 GLU 94 2HB GLU 94 109.212 26.782 10.569 671 HG2 GLU 94 1HG GLU 94 107.433 28.329 11.338 672 HG3 GLU 94 2HG GLU 94 107.960 29.509 10.147 673 H TYR 95 H TYR 95 108.394 29.665 12.955 674 HA TYR 95 HA TYR 95 108.721 27.991 15.284 675 HB2 TYR 95 1HB TYR 95 108.043 30.439 15.296 676 HB3 TYR 95 2HB TYR 95 106.474 29.920 14.711 677 HD1 TYR 95 HD1 TYR 95 108.907 29.388 17.501 678 HD2 TYR 95 HD2 TYR 95 104.805 29.281 16.232 679 HE1 TYR 95 HE1 TYR 95 108.197 28.956 19.837 680 HE2 TYR 95 HE2 TYR 95 104.094 28.850 18.568 681 HH TYR 95 HH TYR 95 105.533 27.695 20.743 682 HA PRO 96 HA PRO 96 106.331 25.090 12.982 683 HB2 PRO 96 1HB PRO 96 106.182 22.981 14.670 684 HB3 PRO 96 2HB PRO 96 107.700 23.482 13.898 685 HG2 PRO 96 1HG PRO 96 106.744 23.959 16.669 686 HG3 PRO 96 2HG PRO 96 108.376 23.592 16.081 687 HD2 PRO 96 1HD PRO 96 107.502 26.133 16.741 688 HD3 PRO 96 2HD PRO 96 108.853 25.789 15.640 689 H THR 97 H THR 97 104.264 24.908 12.489 690 HA THR 97 HA THR 97 102.267 24.600 14.655 691 HB THR 97 HB THR 97 100.601 25.487 13.102 692 HG1 THR 97 HG1 THR 97 102.676 26.092 11.304 693 HG21 THR 97 3HG2 THR 97 101.219 27.744 13.229 694 HG22 THR 97 1HG2 THR 97 102.919 27.396 12.914 695 HG23 THR 97 2HG2 THR 97 102.214 27.001 14.482 696 H TYR 98 H TYR 98 100.561 23.011 14.190 697 HA TYR 98 HA TYR 98 101.276 21.057 12.101 698 HB2 TYR 98 1HB TYR 98 101.174 19.216 13.623 699 HB3 TYR 98 2HB TYR 98 102.344 20.375 14.221 700 HD1 TYR 98 HD1 TYR 98 101.801 21.788 16.204 701 HD2 TYR 98 HD2 TYR 98 99.186 18.664 14.839 702 HE1 TYR 98 HE1 TYR 98 100.617 21.824 18.383 703 HE2 TYR 98 HE2 TYR 98 98.003 18.701 17.017 704 HH TYR 98 HH TYR 98 99.132 20.748 19.685 705 H LYS 99 H LYS 99 99.599 20.476 10.951 706 HA LYS 99 HA LYS 99 96.908 20.492 12.189 707 HB2 LYS 99 1HB LYS 99 97.209 22.022 10.232 708 HB3 LYS 99 2HB LYS 99 97.620 20.620 9.246 709 HG2 LYS 99 1HG LYS 99 95.304 20.972 8.863 710 HG3 LYS 99 2HG LYS 99 95.373 19.631 10.005 711 HD2 LYS 99 1HD LYS 99 94.943 21.149 11.871 712 HD3 LYS 99 2HD LYS 99 94.971 22.535 10.781 713 HE2 LYS 99 1HE LYS 99 92.961 21.895 9.724 714 HE3 LYS 99 2HE LYS 99 93.064 20.243 10.331 715 HZ1 LYS 99 3HZ LYS 99 91.639 21.013 11.864 716 HZ2 LYS 99 1HZ LYS 99 92.074 22.636 11.631 717 HZ3 LYS 99 2HZ LYS 99 93.035 21.632 12.607 718 H HIS 100 H HIS 100 96.081 18.538 12.573 719 HA HIS 100 HA HIS 100 95.800 16.279 12.612 720 HB2 HIS 100 1HB HIS 100 95.013 16.662 10.323 721 HB3 HIS 100 2HB HIS 100 96.647 16.482 9.720 722 HD1 HIS 100 HD1 HIS 100 94.187 14.414 11.787 723 HD2 HIS 100 HD2 HIS 100 97.126 13.908 8.873 724 HE1 HIS 100 HE1 HIS 100 94.212 11.948 11.216 725 H ASP 101 H ASP 101 98.468 16.066 10.255 726 HA ASP 101 HA ASP 101 100.227 15.107 12.432 727 HB2 ASP 101 1HB ASP 101 99.305 13.206 11.104 728 HB3 ASP 101 2HB ASP 101 100.029 13.909 9.659 729 H THR 102 H THR 102 102.054 16.232 12.532 730 HA THR 102 HA THR 102 102.693 18.314 10.750 731 HB THR 102 HB THR 102 104.577 16.896 12.647 732 HG1 THR 102 HG1 THR 102 103.222 17.616 14.069 733 HG21 THR 102 3HG2 THR 102 105.719 18.416 11.134 734 HG22 THR 102 1HG2 THR 102 105.628 19.167 12.727 735 HG23 THR 102 2HG2 THR 102 104.527 19.679 11.447 736 H SER 103 H SER 103 103.939 15.003 11.012 737 HA SER 103 HA SER 103 105.944 15.377 8.986 738 HB2 SER 103 1HB SER 103 106.440 13.071 9.298 739 HB3 SER 103 2HB SER 103 106.002 13.685 10.889 740 HG SER 103 HG SER 103 104.317 12.422 10.871 741 H ASP 104 H ASP 104 106.002 14.242 6.929 742 HA ASP 104 HA ASP 104 103.338 14.110 5.685 743 HB2 ASP 104 1HB ASP 104 105.135 15.459 4.601 744 HB3 ASP 104 2HB ASP 104 106.071 13.980 4.388 745 H TYR 105 H TYR 105 102.380 12.174 5.342 746 HA TYR 105 HA TYR 105 104.099 9.754 5.347 747 HB2 TYR 105 1HB TYR 105 102.393 8.570 6.530 748 HB3 TYR 105 2HB TYR 105 102.775 10.029 7.421 749 HD1 TYR 105 HD1 TYR 105 100.246 8.262 5.424 750 HD2 TYR 105 HD2 TYR 105 101.148 11.852 7.603 751 HE1 TYR 105 HE1 TYR 105 97.842 8.870 5.418 752 HE2 TYR 105 HE2 TYR 105 98.744 12.460 7.596 753 HH TYR 105 HH TYR 105 96.665 11.714 5.831 754 H GLY 106 H GLY 106 103.658 8.153 3.913 755 HA2 GLY 106 1HA GLY 106 101.360 8.482 2.090 756 HA3 GLY 106 2HA GLY 106 102.981 8.298 1.428 757 H PHE 107 H PHE 107 100.899 6.532 0.838 758 HA PHE 107 HA PHE 107 101.674 4.070 2.308 759 HB2 PHE 107 1HB PHE 107 99.278 4.710 2.480 760 HB3 PHE 107 2HB PHE 107 99.153 4.613 0.734 761 HD1 PHE 107 HD1 PHE 107 99.665 2.676 3.846 762 HD2 PHE 107 HD2 PHE 107 98.980 2.491 -0.391 763 HE1 PHE 107 HE1 PHE 107 99.161 0.254 4.032 764 HE2 PHE 107 HE2 PHE 107 98.478 0.070 -0.204 765 HZ PHE 107 HZ PHE 107 98.568 -1.048 2.007 766 H SER 108 H SER 108 102.457 2.331 1.133 767 HA SER 108 HA SER 108 102.595 2.669 -1.810 768 HB2 SER 108 1HB SER 108 104.853 1.763 -0.008 769 HB3 SER 108 2HB SER 108 104.903 1.863 -1.765 770 HG SER 108 HG SER 108 105.599 3.730 -0.199 771 H TYR 109 H TYR 109 102.440 0.822 -3.010 772 HA TYR 109 HA TYR 109 102.574 -1.780 -1.708 773 HB2 TYR 109 1HB TYR 109 100.381 -2.494 -2.348 774 HB3 TYR 109 2HB TYR 109 100.230 -1.023 -1.408 775 HD1 TYR 109 HD1 TYR 109 99.635 1.120 -2.531 776 HD2 TYR 109 HD2 TYR 109 99.703 -2.618 -4.644 777 HE1 TYR 109 HE1 TYR 109 98.308 2.133 -4.365 778 HE2 TYR 109 HE2 TYR 109 98.376 -1.606 -6.479 779 HH TYR 109 HH TYR 109 97.245 1.769 -6.280 780 H GLY 110 H GLY 110 102.609 -3.569 -3.248 781 HA2 GLY 110 1HA GLY 110 102.417 -3.267 -6.041 782 HA3 GLY 110 2HA GLY 110 104.103 -3.052 -5.585 783 H ALA 111 H ALA 111 104.044 -5.051 -7.108 784 HA ALA 111 HA ALA 111 104.106 -7.431 -5.374 785 HB1 ALA 111 1HB ALA 111 101.988 -7.288 -6.849 786 HB2 ALA 111 2HB ALA 111 102.923 -8.782 -6.897 787 HB3 ALA 111 3HB ALA 111 103.077 -7.603 -8.200 788 H GLY 112 H GLY 112 105.485 -9.176 -6.280 789 HA2 GLY 112 1HA GLY 112 107.382 -8.297 -8.333 790 HA3 GLY 112 2HA GLY 112 108.030 -8.578 -6.722 791 H LEU 113 H LEU 113 108.962 -9.981 -8.870 792 HA LEU 113 HA LEU 113 107.947 -12.716 -8.385 793 HB2 LEU 113 1HB LEU 113 108.995 -11.643 -11.018 794 HB3 LEU 113 2HB LEU 113 108.400 -13.273 -10.714 795 HG LEU 113 HG LEU 113 106.740 -10.751 -10.433 796 HD11 LEU 113 1HD1 LEU 113 107.228 -11.127 -12.773 797 HD12 LEU 113 2HD1 LEU 113 105.580 -11.677 -12.472 798 HD13 LEU 113 3HD1 LEU 113 106.889 -12.850 -12.614 799 HD21 LEU 113 3HD2 LEU 113 105.744 -12.328 -9.014 800 HD22 LEU 113 1HD2 LEU 113 106.232 -13.688 -10.024 801 HD23 LEU 113 2HD2 LEU 113 104.913 -12.636 -10.537 802 H GLN 114 H GLN 114 109.522 -14.338 -8.292 803 HA GLN 114 HA GLN 114 112.315 -13.378 -8.085 804 HB2 GLN 114 1HB GLN 114 111.306 -14.333 -6.011 805 HB3 GLN 114 2HB GLN 114 111.078 -15.858 -6.866 806 HG2 GLN 114 1HG GLN 114 113.492 -16.023 -7.265 807 HG3 GLN 114 2HG GLN 114 113.745 -14.473 -6.468 808 HE21 GLN 114 1HE2 GLN 114 115.133 -16.575 -5.388 809 HE22 GLN 114 2HE2 GLN 114 114.435 -17.081 -3.926 810 H PHE 115 H PHE 115 113.805 -14.182 -9.454 811 HA PHE 115 HA PHE 115 113.029 -16.484 -11.161 812 HB2 PHE 115 1HB PHE 115 114.580 -14.011 -11.935 813 HB3 PHE 115 2HB PHE 115 114.323 -15.405 -12.967 814 HD1 PHE 115 HD1 PHE 115 112.035 -15.935 -13.804 815 HD2 PHE 115 HD2 PHE 115 112.884 -12.356 -11.587 816 HE1 PHE 115 HE1 PHE 115 109.899 -14.945 -14.585 817 HE2 PHE 115 HE2 PHE 115 110.749 -11.365 -12.368 818 HZ PHE 115 HZ PHE 115 109.256 -12.660 -13.867 819 H ASN 116 H ASN 116 114.771 -17.761 -11.965 820 HA ASN 116 HA ASN 116 116.713 -18.943 -11.806 821 HB2 ASN 116 1HB ASN 116 117.885 -16.494 -10.469 822 HB3 ASN 116 2HB ASN 116 118.764 -17.809 -11.238 823 HD21 ASN 116 1HD2 ASN 116 119.297 -17.491 -13.403 824 HD22 ASN 116 2HD2 ASN 116 118.562 -16.349 -14.422 825 HA PRO 117 HA PRO 117 116.011 -19.839 -7.342 826 HB2 PRO 117 1HB PRO 117 114.652 -22.168 -7.541 827 HB3 PRO 117 2HB PRO 117 113.846 -20.592 -7.676 828 HG2 PRO 117 1HG PRO 117 114.515 -22.550 -9.775 829 HG3 PRO 117 2HG PRO 117 113.188 -21.381 -9.693 830 HD2 PRO 117 1HD PRO 117 115.599 -21.089 -11.153 831 HD3 PRO 117 2HD PRO 117 114.375 -19.836 -10.862 832 H MET 118 H MET 118 116.524 -22.455 -9.740 833 HA MET 118 HA MET 118 118.125 -24.106 -8.138 834 HB2 MET 118 1HB MET 118 118.214 -23.708 -11.141 835 HB3 MET 118 2HB MET 118 118.930 -25.064 -10.276 836 HG2 MET 118 1HG MET 118 115.982 -24.351 -10.320 837 HG3 MET 118 2HG MET 118 116.731 -25.672 -11.211 838 HE1 MET 118 3HE MET 118 117.990 -27.502 -10.269 839 HE2 MET 118 1HE MET 118 117.869 -28.168 -8.636 840 HE3 MET 118 2HE MET 118 118.908 -26.780 -8.950 841 H GLU 119 H GLU 119 119.003 -21.395 -10.242 842 HA GLU 119 HA GLU 119 121.799 -21.559 -10.010 843 HB2 GLU 119 1HB GLU 119 120.469 -20.064 -11.558 844 HB3 GLU 119 2HB GLU 119 120.155 -19.022 -10.173 845 HG2 GLU 119 1HG GLU 119 122.606 -18.755 -9.850 846 HG3 GLU 119 2HG GLU 119 122.886 -19.745 -11.275 847 H ASN 120 H ASN 120 123.242 -20.356 -8.610 848 HA ASN 120 HA ASN 120 122.320 -20.368 -5.868 849 HB2 ASN 120 1HB ASN 120 125.009 -19.603 -7.014 850 HB3 ASN 120 2HB ASN 120 124.652 -19.889 -5.312 851 HD21 ASN 120 1HD2 ASN 120 123.036 -22.192 -5.462 852 HD22 ASN 120 2HD2 ASN 120 123.943 -23.472 -6.114 853 H VAL 121 H VAL 121 121.907 -18.044 -8.157 854 HA VAL 121 HA VAL 121 121.820 -15.962 -6.065 855 HB VAL 121 HB VAL 121 122.398 -14.277 -7.785 856 HG11 VAL 121 1HG1 VAL 121 124.543 -16.398 -7.781 857 HG12 VAL 121 2HG1 VAL 121 124.104 -15.545 -6.301 858 HG13 VAL 121 3HG1 VAL 121 124.728 -14.646 -7.684 859 HG21 VAL 121 3HG2 VAL 121 122.967 -16.714 -9.507 860 HG22 VAL 121 1HG2 VAL 121 123.321 -15.042 -9.943 861 HG23 VAL 121 2HG2 VAL 121 121.648 -15.571 -9.760 862 H ALA 122 H ALA 122 119.967 -14.721 -6.061 863 HA ALA 122 HA ALA 122 117.869 -15.526 -8.000 864 HB1 ALA 122 1HB ALA 122 116.334 -14.715 -6.070 865 HB2 ALA 122 2HB ALA 122 117.769 -14.894 -5.062 866 HB3 ALA 122 3HB ALA 122 117.114 -16.289 -5.919 867 H LEU 123 H LEU 123 116.615 -13.954 -8.935 868 HA LEU 123 HA LEU 123 117.506 -11.155 -8.520 869 HB2 LEU 123 1HB LEU 123 116.295 -12.419 -10.995 870 HB3 LEU 123 2HB LEU 123 116.709 -10.725 -10.823 871 HG LEU 123 HG LEU 123 118.469 -11.706 -12.066 872 HD11 LEU 123 1HD1 LEU 123 119.296 -10.229 -10.289 873 HD12 LEU 123 2HD1 LEU 123 120.452 -11.513 -10.643 874 HD13 LEU 123 3HD1 LEU 123 119.440 -11.610 -9.202 875 HD21 LEU 123 3HD2 LEU 123 119.416 -13.793 -11.746 876 HD22 LEU 123 1HD2 LEU 123 117.767 -14.081 -11.192 877 HD23 LEU 123 2HD2 LEU 123 119.056 -13.810 -10.020 878 H ASP 124 H ASP 124 115.967 -9.626 -8.051 879 HA ASP 124 HA ASP 124 113.158 -10.581 -7.896 880 HB2 ASP 124 1HB ASP 124 114.627 -8.704 -6.029 881 HB3 ASP 124 2HB ASP 124 112.911 -9.098 -5.934 882 H PHE 125 H PHE 125 111.772 -9.460 -9.077 883 HA PHE 125 HA PHE 125 112.407 -6.639 -9.750 884 HB2 PHE 125 1HB PHE 125 110.967 -8.689 -11.443 885 HB3 PHE 125 2HB PHE 125 111.166 -6.996 -11.853 886 HD1 PHE 125 HD1 PHE 125 113.419 -6.103 -12.421 887 HD2 PHE 125 HD2 PHE 125 112.736 -10.285 -11.724 888 HE1 PHE 125 HE1 PHE 125 115.585 -6.636 -13.503 889 HE2 PHE 125 HE2 PHE 125 114.903 -10.820 -12.806 890 HZ PHE 125 HZ PHE 125 116.327 -8.995 -13.695 891 H SER 126 H SER 126 110.832 -5.181 -9.244 892 HA SER 126 HA SER 126 108.134 -6.175 -8.636 893 HB2 SER 126 1HB SER 126 109.416 -6.241 -6.513 894 HB3 SER 126 2HB SER 126 109.764 -4.526 -6.692 895 HG SER 126 HG SER 126 107.743 -5.466 -5.484 896 H TYR 127 H TYR 127 106.512 -4.662 -8.810 897 HA TYR 127 HA TYR 127 107.293 -2.000 -9.851 898 HB2 TYR 127 1HB TYR 127 104.646 -3.432 -10.142 899 HB3 TYR 127 2HB TYR 127 105.121 -1.934 -10.920 900 HD1 TYR 127 HD1 TYR 127 106.851 -1.961 -12.727 901 HD2 TYR 127 HD2 TYR 127 105.282 -5.569 -11.001 902 HE1 TYR 127 HE1 TYR 127 107.721 -3.263 -14.651 903 HE2 TYR 127 HE2 TYR 127 106.152 -6.868 -12.925 904 HH TYR 127 HH TYR 127 106.976 -6.689 -15.040 905 H GLU 128 H GLU 128 107.022 -0.377 -8.438 906 HA GLU 128 HA GLU 128 105.068 -0.737 -6.233 907 HB2 GLU 128 1HB GLU 128 107.468 -0.847 -5.542 908 HB3 GLU 128 2HB GLU 128 107.667 0.803 -6.131 909 HG2 GLU 128 1HG GLU 128 105.848 1.537 -4.598 910 HG3 GLU 128 2HG GLU 128 105.750 -0.101 -3.967 911 H GLN 129 H GLN 129 103.597 0.793 -5.945 912 HA GLN 129 HA GLN 129 104.026 3.459 -7.165 913 HB2 GLN 129 1HB GLN 129 101.436 1.910 -6.879 914 HB3 GLN 129 2HB GLN 129 101.555 3.584 -7.426 915 HG2 GLN 129 1HG GLN 129 102.930 2.901 -9.328 916 HG3 GLN 129 2HG GLN 129 102.917 1.231 -8.766 917 HE21 GLN 129 1HE2 GLN 129 101.916 1.958 -11.353 918 HE22 GLN 129 2HE2 GLN 129 100.240 1.687 -11.368 919 H SER 130 H SER 130 103.568 5.214 -5.867 920 HA SER 130 HA SER 130 102.577 4.656 -3.134 921 HB2 SER 130 1HB SER 130 104.927 6.429 -3.847 922 HB3 SER 130 2HB SER 130 104.255 6.201 -2.237 923 HG SER 130 HG SER 130 105.886 4.574 -3.746 924 H ARG 131 H ARG 131 101.169 6.125 -2.343 925 HA ARG 131 HA ARG 131 100.618 8.525 -3.997 926 HB2 ARG 131 1HB ARG 131 98.840 6.786 -4.111 927 HB3 ARG 131 2HB ARG 131 98.647 6.907 -2.364 928 HG2 ARG 131 1HG ARG 131 96.961 8.315 -3.254 929 HG3 ARG 131 2HG ARG 131 98.236 9.422 -2.755 930 HD2 ARG 131 1HD ARG 131 99.093 9.448 -5.090 931 HD3 ARG 131 2HD ARG 131 97.765 8.394 -5.568 932 HE ARG 131 HE ARG 131 96.847 10.765 -4.235 933 HH11 ARG 131 1HH1 ARG 131 97.925 9.554 -7.350 934 HH12 ARG 131 2HH1 ARG 131 97.068 10.774 -8.232 935 HH21 ARG 131 1HH2 ARG 131 95.767 12.311 -5.425 936 HH22 ARG 131 2HH2 ARG 131 95.862 12.314 -7.155 937 H ILE 132 H ILE 132 100.885 10.421 -3.002 938 HA ILE 132 HA ILE 132 100.248 10.579 -0.111 939 HB ILE 132 HB ILE 132 102.362 12.185 -1.600 940 HG12 ILE 132 1HG1 ILE 132 102.754 10.231 0.672 941 HG13 ILE 132 2HG1 ILE 132 102.940 9.770 -1.022 942 HG21 ILE 132 1HG2 ILE 132 101.665 12.161 1.350 943 HG22 ILE 132 2HG2 ILE 132 101.084 13.381 0.216 944 HG23 ILE 132 3HG2 ILE 132 102.812 13.226 0.537 945 HD11 ILE 132 3HD1 ILE 132 104.542 11.816 -1.162 946 HD12 ILE 132 1HD1 ILE 132 105.132 10.349 -0.381 947 HD13 ILE 132 2HD1 ILE 132 104.583 11.709 0.597 948 H ARG 133 H ARG 133 98.288 11.714 -0.100 949 HA ARG 133 HA ARG 133 97.046 12.139 -2.483 950 HB2 ARG 133 1HB ARG 133 95.301 13.343 -1.237 951 HB3 ARG 133 2HB ARG 133 95.836 11.879 -0.423 952 HG2 ARG 133 1HG ARG 133 97.400 13.380 0.942 953 HG3 ARG 133 2HG ARG 133 96.492 14.746 0.296 954 HD2 ARG 133 1HD ARG 133 94.392 13.714 1.137 955 HD3 ARG 133 2HD ARG 133 95.353 12.441 1.885 956 HE ARG 133 HE ARG 133 96.366 14.913 2.746 957 HH11 ARG 133 1HH1 ARG 133 93.434 13.020 3.127 958 HH12 ARG 133 2HH1 ARG 133 93.082 13.696 4.682 959 HH21 ARG 133 1HH2 ARG 133 95.862 15.744 4.752 960 HH22 ARG 133 2HH2 ARG 133 94.441 15.218 5.590 961 H SER 134 H SER 134 98.038 13.180 -3.976 962 HA SER 134 HA SER 134 97.689 15.636 -4.888 963 HB2 SER 134 1HB SER 134 99.745 16.966 -4.279 964 HB3 SER 134 2HB SER 134 98.580 16.802 -2.969 965 HG SER 134 HG SER 134 100.942 16.328 -2.585 966 H VAL 135 H VAL 135 100.485 13.568 -4.066 967 HA VAL 135 HA VAL 135 101.540 14.006 -6.793 968 HB VAL 135 HB VAL 135 103.054 13.222 -4.289 969 HG11 VAL 135 1HG1 VAL 135 105.041 13.554 -5.632 970 HG12 VAL 135 2HG1 VAL 135 104.079 14.114 -6.999 971 HG13 VAL 135 3HG1 VAL 135 103.989 12.427 -6.490 972 HG21 VAL 135 3HG2 VAL 135 102.937 15.862 -5.782 973 HG22 VAL 135 1HG2 VAL 135 103.966 15.511 -4.394 974 HG23 VAL 135 2HG2 VAL 135 102.212 15.552 -4.205 975 H ASP 136 H ASP 136 101.866 12.324 -8.084 976 HA ASP 136 HA ASP 136 101.335 9.609 -7.031 977 HB2 ASP 136 1HB ASP 136 99.911 10.395 -8.922 978 HB3 ASP 136 2HB ASP 136 101.362 10.560 -9.907 979 H VAL 137 H VAL 137 103.101 8.326 -6.714 980 HA VAL 137 HA VAL 137 105.587 9.038 -8.173 981 HB VAL 137 HB VAL 137 105.326 7.709 -5.463 982 HG11 VAL 137 1HG1 VAL 137 107.765 8.193 -5.342 983 HG12 VAL 137 2HG1 VAL 137 107.710 8.780 -7.005 984 HG13 VAL 137 3HG1 VAL 137 107.371 7.085 -6.656 985 HG21 VAL 137 3HG2 VAL 137 106.189 9.874 -4.594 986 HG22 VAL 137 1HG2 VAL 137 104.608 10.055 -5.355 987 HG23 VAL 137 2HG2 VAL 137 106.065 10.557 -6.216 988 H GLY 138 H GLY 138 106.537 7.525 -9.383 989 HA2 GLY 138 1HA GLY 138 105.622 4.713 -9.122 990 HA3 GLY 138 2HA GLY 138 105.987 5.465 -10.676 991 H THR 139 H THR 139 107.224 3.234 -8.806 992 HA THR 139 HA THR 139 110.027 4.160 -9.092 993 HB THR 139 HB THR 139 108.923 2.509 -6.810 994 HG1 THR 139 HG1 THR 139 108.973 4.356 -5.654 995 HG21 THR 139 3HG2 THR 139 111.633 3.513 -7.611 996 HG22 THR 139 1HG2 THR 139 111.174 1.954 -6.924 997 HG23 THR 139 2HG2 THR 139 111.242 3.385 -5.896 998 H TRP 140 H TRP 140 111.374 2.794 -10.060 999 HA TRP 140 HA TRP 140 110.498 0.005 -10.525 1000 HB2 TRP 140 1HB TRP 140 112.571 1.680 -11.955 1001 HB3 TRP 140 2HB TRP 140 112.199 0.007 -12.322 1002 HD1 TRP 140 HD1 TRP 140 110.650 3.516 -12.459 1003 HE1 TRP 140 HE1 TRP 140 108.805 3.522 -14.257 1004 HE3 TRP 140 HE3 TRP 140 110.599 -1.440 -13.687 1005 HZ2 TRP 140 HZ2 TRP 140 107.480 1.668 -15.992 1006 HZ3 TRP 140 HZ3 TRP 140 109.042 -2.292 -15.411 1007 HH2 TRP 140 HH2 TRP 140 107.484 -0.749 -16.566 1008 H ILE 141 H ILE 141 111.525 -1.541 -9.385 1009 HA ILE 141 HA ILE 141 114.167 -0.898 -8.206 1010 HB ILE 141 HB ILE 141 112.391 -0.621 -6.525 1011 HG12 ILE 141 1HG1 ILE 141 113.872 -3.183 -5.924 1012 HG13 ILE 141 2HG1 ILE 141 114.708 -1.634 -6.025 1013 HG21 ILE 141 1HG2 ILE 141 110.958 -2.463 -7.723 1014 HG22 ILE 141 2HG2 ILE 141 110.851 -2.280 -5.973 1015 HG23 ILE 141 3HG2 ILE 141 111.835 -3.569 -6.666 1016 HD11 ILE 141 3HD1 ILE 141 112.664 -2.553 -4.031 1017 HD12 ILE 141 1HD1 ILE 141 112.803 -0.832 -4.390 1018 HD13 ILE 141 2HD1 ILE 141 114.192 -1.716 -3.757 1019 H ALA 142 H ALA 142 115.670 -2.432 -8.328 1020 HA ALA 142 HA ALA 142 114.852 -5.225 -8.793 1021 HB1 ALA 142 1HB ALA 142 115.410 -4.265 -11.003 1022 HB2 ALA 142 2HB ALA 142 116.572 -5.500 -10.519 1023 HB3 ALA 142 3HB ALA 142 116.994 -3.792 -10.389 1024 H GLY 143 H GLY 143 116.242 -6.755 -7.864 1025 HA2 GLY 143 1HA GLY 143 118.718 -5.804 -6.617 1026 HA3 GLY 143 2HA GLY 143 117.456 -6.363 -5.528 1027 H VAL 144 H VAL 144 119.742 -7.647 -5.324 1028 HA VAL 144 HA VAL 144 119.224 -10.271 -6.562 1029 HB VAL 144 HB VAL 144 121.975 -9.028 -6.272 1030 HG11 VAL 144 1HG1 VAL 144 121.083 -11.613 -7.585 1031 HG12 VAL 144 2HG1 VAL 144 121.850 -11.507 -6.001 1032 HG13 VAL 144 3HG1 VAL 144 122.741 -11.028 -7.446 1033 HG21 VAL 144 3HG2 VAL 144 121.804 -9.358 -8.882 1034 HG22 VAL 144 1HG2 VAL 144 121.097 -7.924 -8.137 1035 HG23 VAL 144 2HG2 VAL 144 120.067 -9.284 -8.581 1036 H GLY 145 H GLY 145 119.702 -12.029 -5.193 1037 HA2 GLY 145 1HA GLY 145 120.693 -11.371 -2.493 1038 HA3 GLY 145 2HA GLY 145 119.118 -12.134 -2.659 1039 H TYR 146 H TYR 146 121.175 -13.262 -1.194 1040 HA TYR 146 HA TYR 146 121.863 -15.653 -2.798 1041 HB2 TYR 146 1HB TYR 146 123.539 -14.378 -0.630 1042 HB3 TYR 146 2HB TYR 146 123.931 -15.846 -1.505 1043 HD1 TYR 146 HD2 TYR 146 124.706 -15.760 -3.826 1044 HD2 TYR 146 HD1 TYR 146 123.740 -12.180 -1.658 1045 HE1 TYR 146 HE2 TYR 146 125.861 -14.403 -5.551 1046 HE2 TYR 146 HE1 TYR 146 124.894 -10.823 -3.383 1047 HH TYR 146 HH TYR 146 125.553 -11.777 -6.332 1048 H ARG 147 H ARG 147 121.582 -17.620 -1.774 1049 HA ARG 147 HA ARG 147 120.229 -17.516 0.859 1050 HB2 ARG 147 1HB ARG 147 119.042 -19.532 0.189 1051 HB3 ARG 147 2HB ARG 147 118.799 -18.264 -1.010 1052 HG2 ARG 147 1HG ARG 147 120.678 -19.282 -2.352 1053 HG3 ARG 147 2HG ARG 147 120.687 -20.626 -1.210 1054 HD2 ARG 147 1HD ARG 147 118.270 -21.013 -1.715 1055 HD3 ARG 147 2HD ARG 147 118.360 -19.752 -2.941 1056 HE ARG 147 HE ARG 147 120.403 -21.566 -3.495 1057 HH11 ARG 147 1HH1 ARG 147 116.894 -21.626 -3.390 1058 HH12 ARG 147 2HH1 ARG 147 116.780 -22.875 -4.583 1059 HH21 ARG 147 1HH2 ARG 147 120.194 -23.173 -5.027 1060 HH22 ARG 147 2HH2 ARG 147 118.625 -23.740 -5.498 1061 H PHE 148 H PHE 148 120.898 -18.810 2.491 1062 HA PHE 148 HA PHE 148 122.948 -20.842 1.978 1063 HB2 PHE 148 1HB PHE 148 124.151 -18.730 2.455 1064 HB3 PHE 148 2HB PHE 148 123.301 -18.613 3.984 1065 HD1 PHE 148 HD1 PHE 148 123.858 -20.093 5.851 1066 HD2 PHE 148 HD2 PHE 148 125.922 -20.364 2.093 1067 HE1 PHE 148 HE1 PHE 148 125.622 -21.471 6.919 1068 HE2 PHE 148 HE2 PHE 148 127.685 -21.741 3.161 1069 HZ PHE 148 HZ PHE 148 127.536 -22.295 5.574
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