NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
596765 | 2n1k | 25564 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 5.821 -23.033 -9.592 2 H2 GLY 1 HT2 GLY 1 5.376 -22.252 -8.162 3 H3 GLY 1 HT3 GLY 1 4.190 -22.926 -9.158 4 HA2 GLY 1 HA1 GLY 1 5.072 -25.142 -8.739 5 HA3 GLY 1 HA2 GLY 1 6.273 -24.425 -7.674 6 H SER 2 H SER 2 5.611 -25.448 -5.824 7 HA SER 2 HA SER 2 4.429 -25.851 -3.944 8 HB2 SER 2 HB2 SER 2 2.953 -23.317 -4.717 9 HB3 SER 2 HB1 SER 2 2.905 -24.087 -3.131 10 HG SER 2 HG SER 2 5.384 -23.400 -4.267 11 H HIS 3 H HIS 3 3.725 -27.541 -5.732 12 HA HIS 3 HA HIS 3 1.078 -27.543 -6.676 13 HB2 HIS 3 HB2 HIS 3 2.792 -29.073 -7.542 14 HB3 HIS 3 HB1 HIS 3 2.864 -29.888 -5.987 15 HD1 HIS 3 HD1 HIS 3 1.370 -31.852 -5.704 16 HD2 HIS 3 HD2 HIS 3 0.169 -29.409 -8.846 17 HE1 HIS 3 HE1 HIS 3 -0.516 -33.076 -6.828 18 HE2 HIS 3 HE2 HIS 3 -1.129 -31.647 -8.811 19 H MET 4 H MET 4 2.492 -28.566 -3.631 20 HA MET 4 HA MET 4 -0.149 -29.375 -2.656 21 HB2 MET 4 HB2 MET 4 2.545 -29.636 -1.306 22 HB3 MET 4 HB1 MET 4 1.030 -30.324 -0.740 23 HG2 MET 4 HG2 MET 4 2.575 -31.079 -3.202 24 HG3 MET 4 HG1 MET 4 2.303 -32.055 -1.760 25 HE1 MET 4 HE1 MET 4 -1.548 -32.770 -2.009 26 HE2 MET 4 HE2 MET 4 -0.768 -31.434 -1.164 27 HE3 MET 4 HE3 MET 4 -0.076 -33.054 -1.082 28 H GLY 5 H GLY 5 0.254 -26.647 -3.176 29 HA2 GLY 5 HA2 GLY 5 0.510 -25.484 -0.480 30 HA3 GLY 5 HA1 GLY 5 0.741 -24.602 -1.983 31 H THR 6 H THR 6 -1.896 -26.828 -1.648 32 HA THR 6 HA THR 6 -3.794 -24.815 -2.310 33 HB THR 6 HB THR 6 -5.443 -26.724 -1.817 34 HG1 THR 6 HG1 THR 6 -4.340 -28.798 -1.758 35 HG21 THR 6 HG21 THR 6 -3.254 -27.123 -3.861 36 HG22 THR 6 HG22 THR 6 -4.710 -26.151 -4.076 37 HG23 THR 6 HG23 THR 6 -4.836 -27.900 -3.888 38 H THR 7 H THR 7 -2.978 -26.564 0.648 39 HA THR 7 HA THR 7 -4.993 -25.130 2.177 40 HB THR 7 HB THR 7 -2.877 -27.013 3.239 41 HG1 THR 7 HG1 THR 7 -5.105 -27.519 1.682 42 HG21 THR 7 HG21 THR 7 -4.091 -25.712 4.926 43 HG22 THR 7 HG22 THR 7 -4.518 -27.420 5.014 44 HG23 THR 7 HG23 THR 7 -5.624 -26.273 4.259 45 H THR 8 H THR 8 -1.979 -24.492 1.027 46 HA THR 8 HA THR 8 -0.853 -23.169 3.318 47 HB THR 8 HB THR 8 -0.011 -22.971 0.420 48 HG1 THR 8 HG1 THR 8 0.195 -25.002 2.257 49 HG21 THR 8 HG21 THR 8 2.176 -22.372 1.360 50 HG22 THR 8 HG22 THR 8 1.500 -22.455 2.986 51 HG23 THR 8 HG23 THR 8 0.931 -21.226 1.858 52 H ALA 9 H ALA 9 -1.273 -21.166 3.947 53 HA ALA 9 HA ALA 9 -2.745 -19.373 2.161 54 HB1 ALA 9 HB1 ALA 9 -3.218 -18.059 4.162 55 HB2 ALA 9 HB2 ALA 9 -2.190 -19.126 5.119 56 HB3 ALA 9 HB3 ALA 9 -3.677 -19.745 4.403 57 HA PRO 10 HA PRO 10 1.107 -17.361 1.284 58 HB2 PRO 10 HB2 PRO 10 0.059 -15.109 0.124 59 HB3 PRO 10 HB1 PRO 10 0.250 -16.657 -0.707 60 HG2 PRO 10 HG2 PRO 10 -2.185 -15.445 0.528 61 HG3 PRO 10 HG1 PRO 10 -2.033 -16.386 -0.968 62 HD2 PRO 10 HD2 PRO 10 -2.967 -17.452 1.333 63 HD3 PRO 10 HD1 PRO 10 -2.096 -18.389 0.157 64 H ASP 11 H ASP 11 2.393 -15.776 2.150 65 HA ASP 11 HA ASP 11 1.278 -14.410 4.476 66 HB2 ASP 11 HB2 ASP 11 3.632 -14.119 5.169 67 HB3 ASP 11 HB1 ASP 11 3.231 -15.809 4.895 68 H ALA 12 H ALA 12 2.177 -12.224 4.948 69 HA ALA 12 HA ALA 12 1.963 -10.570 2.534 70 HB1 ALA 12 HB1 ALA 12 1.785 -9.831 5.457 71 HB2 ALA 12 HB2 ALA 12 0.418 -10.120 4.382 72 HB3 ALA 12 HB3 ALA 12 1.489 -8.749 4.097 73 HA PRO 13 HA PRO 13 6.206 -9.151 2.916 74 HB2 PRO 13 HB2 PRO 13 5.348 -6.403 2.337 75 HB3 PRO 13 HB1 PRO 13 6.352 -7.484 1.366 76 HG2 PRO 13 HG2 PRO 13 3.868 -6.832 0.608 77 HG3 PRO 13 HG1 PRO 13 4.527 -8.455 0.325 78 HD2 PRO 13 HD2 PRO 13 2.714 -7.504 2.515 79 HD3 PRO 13 HD1 PRO 13 2.561 -8.956 1.496 80 HA PRO 14 HA PRO 14 6.416 -7.649 7.181 81 HB2 PRO 14 HB2 PRO 14 9.172 -7.103 6.162 82 HB3 PRO 14 HB1 PRO 14 8.669 -7.848 7.683 83 HG2 PRO 14 HG2 PRO 14 9.585 -9.346 5.685 84 HG3 PRO 14 HG1 PRO 14 8.229 -9.898 6.688 85 HD2 PRO 14 HD2 PRO 14 8.222 -8.847 3.903 86 HD3 PRO 14 HD1 PRO 14 7.159 -10.049 4.662 87 H ASP 15 H ASP 15 6.533 -5.679 8.158 88 HA ASP 15 HA ASP 15 5.214 -3.683 6.985 89 HB2 ASP 15 HB2 ASP 15 5.953 -2.171 8.755 90 HB3 ASP 15 HB1 ASP 15 5.594 -3.771 9.384 91 HA PRO 16 HA PRO 16 8.094 -2.145 3.909 92 HB2 PRO 16 HB2 PRO 16 5.677 -0.614 3.150 93 HB3 PRO 16 HB1 PRO 16 6.675 -1.698 2.150 94 HG2 PRO 16 HG2 PRO 16 4.268 -2.467 2.952 95 HG3 PRO 16 HG1 PRO 16 5.622 -3.609 2.987 96 HD2 PRO 16 HD2 PRO 16 4.451 -2.017 5.253 97 HD3 PRO 16 HD1 PRO 16 4.817 -3.763 5.196 98 H THR 17 H THR 17 9.065 -0.207 3.478 99 HA THR 17 HA THR 17 8.647 1.877 5.528 100 HB THR 17 HB THR 17 11.131 1.482 3.856 101 HG1 THR 17 HG1 THR 17 10.720 0.476 6.494 102 HG21 THR 17 HG21 THR 17 10.900 3.647 4.973 103 HG22 THR 17 HG22 THR 17 12.207 2.705 5.692 104 HG23 THR 17 HG23 THR 17 10.654 2.833 6.518 105 H VAL 18 H VAL 18 7.998 3.746 4.982 106 HA VAL 18 HA VAL 18 7.689 4.547 2.224 107 HB VAL 18 HB VAL 18 7.235 6.081 4.790 108 HG11 VAL 18 HG11 VAL 18 7.808 7.650 3.024 109 HG12 VAL 18 HG12 VAL 18 6.089 7.760 3.391 110 HG13 VAL 18 HG13 VAL 18 6.630 6.909 1.935 111 HG21 VAL 18 HG21 VAL 18 5.251 4.964 2.818 112 HG22 VAL 18 HG22 VAL 18 4.896 5.756 4.351 113 HG23 VAL 18 HG23 VAL 18 5.698 4.186 4.335 114 H ASP 19 H ASP 19 9.141 5.509 1.018 115 HA ASP 19 HA ASP 19 11.716 6.202 2.166 116 HB2 ASP 19 HB2 ASP 19 11.395 4.812 0.065 117 HB3 ASP 19 HB1 ASP 19 10.905 6.298 -0.739 118 H GLN 20 H GLN 20 9.088 7.759 0.406 119 HA GLN 20 HA GLN 20 10.238 10.386 1.055 120 HB2 GLN 20 HB2 GLN 20 9.217 9.467 -1.637 121 HB3 GLN 20 HB1 GLN 20 9.429 11.159 -1.218 122 HG2 GLN 20 HG2 GLN 20 11.631 9.111 -1.192 123 HG3 GLN 20 HG1 GLN 20 11.286 10.197 -2.539 124 HE21 GLN 20 HE21 GLN 20 12.560 9.930 0.670 125 HE22 GLN 20 HE22 GLN 20 13.264 11.489 0.740 126 H VAL 21 H VAL 21 8.811 11.898 1.640 127 HA VAL 21 HA VAL 21 5.950 11.290 1.356 128 HB VAL 21 HB VAL 21 7.236 12.428 3.842 129 HG11 VAL 21 HG11 VAL 21 5.004 13.330 3.396 130 HG12 VAL 21 HG12 VAL 21 5.024 12.306 4.832 131 HG13 VAL 21 HG13 VAL 21 4.365 11.688 3.318 132 HG21 VAL 21 HG21 VAL 21 5.998 9.720 3.369 133 HG22 VAL 21 HG22 VAL 21 6.522 10.345 4.933 134 HG23 VAL 21 HG23 VAL 21 7.704 10.059 3.657 135 H ASP 22 H ASP 22 4.889 12.879 0.381 136 HA ASP 22 HA ASP 22 5.827 15.645 0.697 137 HB2 ASP 22 HB2 ASP 22 5.154 14.238 -1.894 138 HB3 ASP 22 HB1 ASP 22 5.202 15.991 -1.750 139 H ASP 23 H ASP 23 3.834 16.706 -1.076 140 HA ASP 23 HA ASP 23 1.630 16.758 0.758 141 HB2 ASP 23 HB2 ASP 23 0.649 18.399 -0.812 142 HB3 ASP 23 HB1 ASP 23 2.293 18.809 -0.379 143 H THR 24 H THR 24 1.943 15.877 -2.651 144 HA THR 24 HA THR 24 -0.610 14.401 -2.440 145 HB THR 24 HB THR 24 -0.866 14.987 -4.879 146 HG1 THR 24 HG1 THR 24 0.947 17.098 -4.525 147 HG21 THR 24 HG21 THR 24 -1.592 17.287 -4.441 148 HG22 THR 24 HG22 THR 24 -0.633 17.313 -2.955 149 HG23 THR 24 HG23 THR 24 -2.025 16.231 -3.093 150 H SER 25 H SER 25 1.944 13.279 -1.910 151 HA SER 25 HA SER 25 2.137 11.102 -3.694 152 HB2 SER 25 HB2 SER 25 4.344 13.175 -3.893 153 HB3 SER 25 HB1 SER 25 4.418 11.552 -4.578 154 HG SER 25 HG SER 25 2.158 12.888 -5.328 155 H ILE 26 H ILE 26 2.952 9.447 -2.578 156 HA ILE 26 HA ILE 26 5.091 9.889 -0.612 157 HB ILE 26 HB ILE 26 2.415 8.662 0.088 158 HG12 ILE 26 HG12 ILE 26 4.146 10.697 1.498 159 HG13 ILE 26 HG11 ILE 26 2.684 11.041 0.582 160 HG21 ILE 26 HG21 ILE 26 4.136 7.051 0.731 161 HG22 ILE 26 HG22 ILE 26 3.379 7.788 2.145 162 HG23 ILE 26 HG23 ILE 26 4.982 8.314 1.628 163 HD11 ILE 26 HD11 ILE 26 1.395 9.701 2.195 164 HD12 ILE 26 HD12 ILE 26 2.205 11.077 2.942 165 HD13 ILE 26 HD13 ILE 26 2.867 9.447 3.136 166 H VAL 27 H VAL 27 6.453 7.991 -0.406 167 HA VAL 27 HA VAL 27 5.733 5.950 -2.420 168 HB VAL 27 HB VAL 27 8.525 6.807 -1.673 169 HG11 VAL 27 HG11 VAL 27 7.788 5.248 -4.112 170 HG12 VAL 27 HG12 VAL 27 7.874 4.422 -2.555 171 HG13 VAL 27 HG13 VAL 27 9.299 5.253 -3.197 172 HG21 VAL 27 HG21 VAL 27 7.396 8.603 -2.864 173 HG22 VAL 27 HG22 VAL 27 6.914 7.478 -4.135 174 HG23 VAL 27 HG23 VAL 27 8.620 7.855 -3.890 175 H VAL 28 H VAL 28 5.797 3.845 -1.764 176 HA VAL 28 HA VAL 28 7.023 3.345 0.847 177 HB VAL 28 HB VAL 28 5.211 2.389 1.754 178 HG11 VAL 28 HG11 VAL 28 3.705 3.881 -0.338 179 HG12 VAL 28 HG12 VAL 28 4.495 4.620 1.053 180 HG13 VAL 28 HG13 VAL 28 3.183 3.475 1.296 181 HG21 VAL 28 HG21 VAL 28 3.543 1.057 0.641 182 HG22 VAL 28 HG22 VAL 28 5.176 0.541 0.186 183 HG23 VAL 28 HG23 VAL 28 4.215 1.525 -0.922 184 H ARG 29 H ARG 29 7.858 1.270 1.166 185 HA ARG 29 HA ARG 29 8.231 -0.338 -1.281 186 HB2 ARG 29 HB2 ARG 29 10.475 0.372 0.621 187 HB3 ARG 29 HB1 ARG 29 10.606 -0.415 -0.946 188 HG2 ARG 29 HG2 ARG 29 10.040 1.608 -2.088 189 HG3 ARG 29 HG1 ARG 29 9.644 2.412 -0.570 190 HD2 ARG 29 HD2 ARG 29 11.801 3.163 -1.295 191 HD3 ARG 29 HD1 ARG 29 12.011 2.145 0.126 192 HE ARG 29 HE ARG 29 12.417 0.360 -1.773 193 HH11 ARG 29 HH11 ARG 29 13.564 3.663 -1.578 194 HH12 ARG 29 HH12 ARG 29 15.031 3.336 -2.441 195 HH21 ARG 29 HH21 ARG 29 14.332 -0.067 -2.937 196 HH22 ARG 29 HH22 ARG 29 15.471 1.213 -3.219 197 H TRP 30 H TRP 30 7.829 -2.376 -0.933 198 HA TRP 30 HA TRP 30 7.756 -3.332 1.862 199 HB2 TRP 30 HB2 TRP 30 5.934 -4.899 1.119 200 HB3 TRP 30 HB1 TRP 30 5.500 -3.196 1.014 201 HD1 TRP 30 HD1 TRP 30 6.317 -6.177 -1.187 202 HE1 TRP 30 HE1 TRP 30 5.452 -5.729 -3.562 203 HE3 TRP 30 HE3 TRP 30 4.812 -1.379 -0.545 204 HZ2 TRP 30 HZ2 TRP 30 4.214 -3.617 -4.952 205 HZ3 TRP 30 HZ3 TRP 30 3.760 -0.225 -2.438 206 HH2 TRP 30 HH2 TRP 30 3.463 -1.305 -4.576 207 H SER 31 H SER 31 8.381 -5.442 2.322 208 HA SER 31 HA SER 31 10.219 -6.601 0.366 209 HB2 SER 31 HB2 SER 31 9.881 -7.238 3.308 210 HB3 SER 31 HB1 SER 31 11.174 -7.814 2.256 211 HG SER 31 HG SER 31 11.827 -5.636 1.989 212 H ARG 32 H ARG 32 9.069 -7.822 -0.973 213 HA ARG 32 HA ARG 32 6.652 -8.985 -0.690 214 HB2 ARG 32 HB2 ARG 32 8.862 -10.199 -2.329 215 HB3 ARG 32 HB1 ARG 32 7.137 -10.272 -2.640 216 HG2 ARG 32 HG2 ARG 32 7.777 -8.651 -4.128 217 HG3 ARG 32 HG1 ARG 32 7.334 -7.680 -2.721 218 HD2 ARG 32 HD2 ARG 32 9.395 -6.907 -2.444 219 HD3 ARG 32 HD1 ARG 32 10.110 -8.514 -2.659 220 HE ARG 32 HE ARG 32 9.196 -7.098 -5.045 221 HH11 ARG 32 HH11 ARG 32 11.857 -8.148 -3.024 222 HH12 ARG 32 HH12 ARG 32 13.050 -7.937 -4.265 223 HH21 ARG 32 HH21 ARG 32 10.757 -6.818 -6.683 224 HH22 ARG 32 HH22 ARG 32 12.425 -7.173 -6.348 225 HA PRO 33 HA PRO 33 6.696 -12.465 1.872 226 HB2 PRO 33 HB2 PRO 33 4.778 -13.867 0.196 227 HB3 PRO 33 HB1 PRO 33 4.493 -12.991 1.704 228 HG2 PRO 33 HG2 PRO 33 3.564 -12.134 -0.690 229 HG3 PRO 33 HG1 PRO 33 4.032 -11.017 0.612 230 HD2 PRO 33 HD2 PRO 33 5.610 -11.892 -1.782 231 HD3 PRO 33 HD1 PRO 33 5.370 -10.258 -1.145 232 H GLN 34 H GLN 34 6.793 -14.792 2.080 233 HA GLN 34 HA GLN 34 8.684 -16.042 0.318 234 HB2 GLN 34 HB2 GLN 34 8.706 -16.451 2.716 235 HB3 GLN 34 HB1 GLN 34 7.085 -17.119 2.644 236 HG2 GLN 34 HG2 GLN 34 7.920 -18.954 1.252 237 HG3 GLN 34 HG1 GLN 34 9.548 -18.282 1.362 238 HE21 GLN 34 HE21 GLN 34 10.351 -20.119 2.357 239 HE22 GLN 34 HE22 GLN 34 9.994 -20.509 4.004 240 H ALA 35 H ALA 35 5.283 -15.822 0.645 241 HA ALA 35 HA ALA 35 4.500 -18.107 -0.845 242 HB1 ALA 35 HB1 ALA 35 2.342 -17.167 -0.864 243 HB2 ALA 35 HB2 ALA 35 2.969 -15.521 -0.742 244 HB3 ALA 35 HB3 ALA 35 3.057 -16.609 0.652 245 HA PRO 36 HA PRO 36 5.229 -16.398 -4.964 246 HB2 PRO 36 HB2 PRO 36 3.569 -18.575 -5.955 247 HB3 PRO 36 HB1 PRO 36 5.289 -18.292 -6.221 248 HG2 PRO 36 HG2 PRO 36 4.331 -20.349 -4.715 249 HG3 PRO 36 HG1 PRO 36 5.912 -19.596 -4.443 250 HD2 PRO 36 HD2 PRO 36 3.341 -19.197 -2.967 251 HD3 PRO 36 HD1 PRO 36 5.003 -19.277 -2.343 252 H ILE 37 H ILE 37 4.013 -14.682 -5.421 253 HA ILE 37 HA ILE 37 1.089 -14.874 -5.091 254 HB ILE 37 HB ILE 37 1.114 -12.448 -4.687 255 HG12 ILE 37 HG12 ILE 37 3.770 -12.715 -5.737 256 HG13 ILE 37 HG11 ILE 37 2.828 -11.262 -5.477 257 HG21 ILE 37 HG21 ILE 37 1.292 -13.993 -2.761 258 HG22 ILE 37 HG22 ILE 37 2.075 -12.439 -2.450 259 HG23 ILE 37 HG23 ILE 37 3.051 -13.867 -2.832 260 HD11 ILE 37 HD11 ILE 37 4.904 -11.078 -4.323 261 HD12 ILE 37 HD12 ILE 37 4.637 -12.619 -3.508 262 HD13 ILE 37 HD13 ILE 37 3.607 -11.236 -3.136 263 H THR 38 H THR 38 -0.187 -13.493 -6.594 264 HA THR 38 HA THR 38 0.949 -13.651 -9.267 265 HB THR 38 HB THR 38 -1.472 -13.024 -9.907 266 HG1 THR 38 HG1 THR 38 -2.861 -12.926 -8.316 267 HG21 THR 38 HG21 THR 38 -0.784 -15.650 -8.629 268 HG22 THR 38 HG22 THR 38 -0.500 -15.181 -10.304 269 HG23 THR 38 HG23 THR 38 -2.147 -15.361 -9.711 270 H GLY 39 H GLY 39 -0.222 -11.189 -7.029 271 HA2 GLY 39 HA2 GLY 39 1.149 -9.185 -8.509 272 HA3 GLY 39 HA1 GLY 39 -0.592 -9.050 -8.707 273 H TYR 40 H TYR 40 -0.126 -6.913 -7.663 274 HA TYR 40 HA TYR 40 -0.594 -7.238 -4.781 275 HB2 TYR 40 HB2 TYR 40 1.516 -5.563 -6.080 276 HB3 TYR 40 HB1 TYR 40 0.703 -4.942 -4.647 277 HD1 TYR 40 HD1 TYR 40 2.013 -8.298 -5.634 278 HD2 TYR 40 HD2 TYR 40 1.987 -5.168 -2.767 279 HE1 TYR 40 HE1 TYR 40 3.572 -9.565 -4.241 280 HE2 TYR 40 HE2 TYR 40 3.519 -6.450 -1.352 281 HH TYR 40 HH TYR 40 5.155 -9.219 -2.504 282 H ARG 41 H ARG 41 -2.295 -6.108 -4.082 283 HA ARG 41 HA ARG 41 -3.181 -3.793 -5.680 284 HB2 ARG 41 HB2 ARG 41 -4.602 -4.780 -3.248 285 HB3 ARG 41 HB1 ARG 41 -5.238 -3.949 -4.666 286 HG2 ARG 41 HG2 ARG 41 -5.069 -5.923 -5.988 287 HG3 ARG 41 HG1 ARG 41 -4.133 -6.742 -4.723 288 HD2 ARG 41 HD2 ARG 41 -6.549 -7.428 -4.860 289 HD3 ARG 41 HD1 ARG 41 -6.034 -6.832 -3.280 290 HE ARG 41 HE ARG 41 -7.156 -4.783 -4.959 291 HH11 ARG 41 HH11 ARG 41 -7.915 -7.333 -2.653 292 HH12 ARG 41 HH12 ARG 41 -9.426 -6.604 -2.181 293 HH21 ARG 41 HH21 ARG 41 -9.097 -3.820 -4.293 294 HH22 ARG 41 HH22 ARG 41 -10.094 -4.613 -3.107 295 H ILE 42 H ILE 42 -3.420 -1.763 -4.658 296 HA ILE 42 HA ILE 42 -2.241 -1.567 -1.958 297 HB ILE 42 HB ILE 42 -1.453 0.229 -4.235 298 HG12 ILE 42 HG12 ILE 42 0.258 -1.860 -2.935 299 HG13 ILE 42 HG11 ILE 42 -0.697 -2.187 -4.373 300 HG21 ILE 42 HG21 ILE 42 -0.220 -0.066 -1.503 301 HG22 ILE 42 HG22 ILE 42 -1.377 1.190 -1.933 302 HG23 ILE 42 HG23 ILE 42 0.190 1.127 -2.736 303 HD11 ILE 42 HD11 ILE 42 1.471 -0.144 -4.117 304 HD12 ILE 42 HD12 ILE 42 0.510 -0.445 -5.561 305 HD13 ILE 42 HD13 ILE 42 1.587 -1.695 -4.937 306 H VAL 43 H VAL 43 -3.858 -0.736 -0.756 307 HA VAL 43 HA VAL 43 -5.424 1.447 -1.965 308 HB VAL 43 HB VAL 43 -6.153 -0.340 0.359 309 HG11 VAL 43 HG11 VAL 43 -7.662 1.974 -0.815 310 HG12 VAL 43 HG12 VAL 43 -6.924 1.897 0.783 311 HG13 VAL 43 HG13 VAL 43 -8.278 0.844 0.390 312 HG21 VAL 43 HG21 VAL 43 -7.434 -0.013 -2.345 313 HG22 VAL 43 HG22 VAL 43 -7.939 -1.123 -1.071 314 HG23 VAL 43 HG23 VAL 43 -6.388 -1.353 -1.878 315 H TYR 44 H TYR 44 -4.625 3.328 -1.450 316 HA TYR 44 HA TYR 44 -3.857 3.797 1.327 317 HB2 TYR 44 HB2 TYR 44 -2.658 5.862 0.260 318 HB3 TYR 44 HB1 TYR 44 -1.890 4.282 0.218 319 HD1 TYR 44 HD1 TYR 44 -2.302 2.879 -1.934 320 HD2 TYR 44 HD2 TYR 44 -2.866 7.084 -1.704 321 HE1 TYR 44 HE1 TYR 44 -2.048 3.016 -4.361 322 HE2 TYR 44 HE2 TYR 44 -2.618 7.253 -4.141 323 HH TYR 44 HH TYR 44 -2.739 4.629 -6.202 324 H SER 45 H SER 45 -4.940 5.078 2.457 325 HA SER 45 HA SER 45 -6.868 6.896 1.190 326 HB2 SER 45 HB2 SER 45 -8.605 6.016 2.804 327 HB3 SER 45 HB1 SER 45 -8.133 4.896 1.527 328 HG SER 45 HG SER 45 -7.420 4.876 4.262 329 HA PRO 46 HA PRO 46 -5.725 9.564 4.620 330 HB2 PRO 46 HB2 PRO 46 -8.136 11.053 4.149 331 HB3 PRO 46 HB1 PRO 46 -6.476 11.523 3.826 332 HG2 PRO 46 HG2 PRO 46 -8.289 11.043 1.861 333 HG3 PRO 46 HG1 PRO 46 -6.544 10.798 1.665 334 HD2 PRO 46 HD2 PRO 46 -8.693 8.787 2.186 335 HD3 PRO 46 HD1 PRO 46 -7.272 8.678 1.127 336 H SER 47 H SER 47 -6.149 9.520 6.726 337 HA SER 47 HA SER 47 -8.154 7.853 7.795 338 HB2 SER 47 HB2 SER 47 -6.604 9.978 9.283 339 HB3 SER 47 HB1 SER 47 -7.284 8.486 9.936 340 HG SER 47 HG SER 47 -5.423 7.639 9.479 341 H VAL 48 H VAL 48 -8.050 11.271 7.124 342 HA VAL 48 HA VAL 48 -10.643 11.662 8.427 343 HB VAL 48 HB VAL 48 -10.340 14.052 7.830 344 HG11 VAL 48 HG11 VAL 48 -8.101 12.814 9.428 345 HG12 VAL 48 HG12 VAL 48 -9.701 13.241 10.034 346 HG13 VAL 48 HG13 VAL 48 -8.596 14.505 9.500 347 HG21 VAL 48 HG21 VAL 48 -7.608 13.152 6.938 348 HG22 VAL 48 HG22 VAL 48 -8.133 14.828 7.103 349 HG23 VAL 48 HG23 VAL 48 -8.887 13.782 5.899 350 H GLU 49 H GLU 49 -9.829 10.288 5.815 351 HA GLU 49 HA GLU 49 -10.729 9.819 3.809 352 HB2 GLU 49 HB2 GLU 49 -12.948 11.631 4.741 353 HB3 GLU 49 HB1 GLU 49 -12.989 10.723 3.236 354 HG2 GLU 49 HG2 GLU 49 -12.646 8.647 4.614 355 HG3 GLU 49 HG1 GLU 49 -12.928 9.648 6.037 356 H GLY 50 H GLY 50 -11.075 10.660 1.670 357 HA2 GLY 50 HA2 GLY 50 -10.970 13.151 0.676 358 HA3 GLY 50 HA1 GLY 50 -9.315 12.918 1.231 359 H SER 51 H SER 51 -8.046 12.416 -0.462 360 HA SER 51 HA SER 51 -9.150 10.906 -2.674 361 HB2 SER 51 HB2 SER 51 -6.324 11.945 -2.252 362 HB3 SER 51 HB1 SER 51 -7.004 11.327 -3.761 363 HG SER 51 HG SER 51 -8.103 13.131 -4.035 364 H SER 52 H SER 52 -9.229 8.768 -2.590 365 HA SER 52 HA SER 52 -6.989 7.314 -1.347 366 HB2 SER 52 HB2 SER 52 -8.729 5.436 -1.043 367 HB3 SER 52 HB1 SER 52 -8.855 6.827 0.036 368 HG SER 52 HG SER 52 -10.711 7.335 -0.829 369 H THR 53 H THR 53 -6.201 5.489 -2.455 370 HA THR 53 HA THR 53 -7.410 4.902 -5.049 371 HB THR 53 HB THR 53 -4.545 5.844 -4.830 372 HG1 THR 53 HG1 THR 53 -6.803 7.211 -5.105 373 HG21 THR 53 HG21 THR 53 -4.513 5.660 -7.273 374 HG22 THR 53 HG22 THR 53 -6.144 4.988 -7.247 375 HG23 THR 53 HG23 THR 53 -4.808 4.095 -6.516 376 H GLU 54 H GLU 54 -6.911 2.887 -5.881 377 HA GLU 54 HA GLU 54 -5.108 1.187 -4.316 378 HB2 GLU 54 HB2 GLU 54 -7.518 0.470 -4.368 379 HB3 GLU 54 HB1 GLU 54 -7.377 0.297 -6.112 380 HG2 GLU 54 HG2 GLU 54 -5.559 -1.363 -5.737 381 HG3 GLU 54 HG1 GLU 54 -5.889 -1.261 -4.011 382 H LEU 55 H LEU 55 -3.196 0.933 -5.340 383 HA LEU 55 HA LEU 55 -3.194 0.976 -8.270 384 HB2 LEU 55 HB2 LEU 55 -0.856 1.128 -6.324 385 HB3 LEU 55 HB1 LEU 55 -0.685 0.978 -8.071 386 HG LEU 55 HG LEU 55 -1.779 3.271 -6.500 387 HD11 LEU 55 HD11 LEU 55 0.546 3.414 -6.779 388 HD12 LEU 55 HD12 LEU 55 -0.157 4.511 -7.966 389 HD13 LEU 55 HD13 LEU 55 0.451 2.935 -8.473 390 HD21 LEU 55 HD21 LEU 55 -3.375 2.956 -8.269 391 HD22 LEU 55 HD22 LEU 55 -2.082 2.784 -9.455 392 HD23 LEU 55 HD23 LEU 55 -2.353 4.336 -8.664 393 H ASN 56 H ASN 56 -2.008 -0.638 -9.446 394 HA ASN 56 HA ASN 56 -2.008 -3.241 -8.070 395 HB2 ASN 56 HB2 ASN 56 -3.841 -3.029 -9.751 396 HB3 ASN 56 HB1 ASN 56 -2.630 -2.724 -10.991 397 HD21 ASN 56 HD21 ASN 56 -4.073 -5.083 -8.909 398 HD22 ASN 56 HD22 ASN 56 -3.374 -6.474 -9.664 399 H LEU 57 H LEU 57 -0.024 -4.028 -7.883 400 HA LEU 57 HA LEU 57 1.989 -3.165 -9.848 401 HB2 LEU 57 HB2 LEU 57 2.294 -3.746 -6.886 402 HB3 LEU 57 HB1 LEU 57 3.651 -3.650 -7.984 403 HG LEU 57 HG LEU 57 2.004 -1.510 -6.808 404 HD11 LEU 57 HD11 LEU 57 4.844 -1.639 -7.777 405 HD12 LEU 57 HD12 LEU 57 4.304 -1.975 -6.135 406 HD13 LEU 57 HD13 LEU 57 4.123 -0.355 -6.806 407 HD21 LEU 57 HD21 LEU 57 2.482 0.055 -8.581 408 HD22 LEU 57 HD22 LEU 57 1.427 -1.243 -9.139 409 HD23 LEU 57 HD23 LEU 57 3.136 -1.249 -9.572 410 HA PRO 58 HA PRO 58 2.616 -7.401 -10.817 411 HB2 PRO 58 HB2 PRO 58 5.380 -7.454 -10.989 412 HB3 PRO 58 HB1 PRO 58 4.293 -6.961 -12.287 413 HG2 PRO 58 HG2 PRO 58 5.903 -5.302 -10.431 414 HG3 PRO 58 HG1 PRO 58 5.444 -4.991 -12.112 415 HD2 PRO 58 HD2 PRO 58 4.266 -3.778 -9.968 416 HD3 PRO 58 HD1 PRO 58 3.440 -4.043 -11.512 417 H GLU 59 H GLU 59 3.128 -9.290 -9.877 418 HA GLU 59 HA GLU 59 3.194 -9.717 -7.200 419 HB2 GLU 59 HB2 GLU 59 4.121 -11.961 -7.715 420 HB3 GLU 59 HB1 GLU 59 2.798 -11.497 -8.776 421 HG2 GLU 59 HG2 GLU 59 4.358 -10.938 -10.537 422 HG3 GLU 59 HG1 GLU 59 5.719 -11.280 -9.475 423 H THR 60 H THR 60 5.915 -8.865 -9.155 424 HA THR 60 HA THR 60 7.768 -9.539 -6.988 425 HB THR 60 HB THR 60 8.293 -10.584 -9.124 426 HG1 THR 60 HG1 THR 60 10.436 -9.315 -9.426 427 HG21 THR 60 HG21 THR 60 7.260 -9.002 -10.638 428 HG22 THR 60 HG22 THR 60 8.957 -9.220 -11.066 429 HG23 THR 60 HG23 THR 60 8.445 -7.771 -10.201 430 H ALA 61 H ALA 61 5.986 -7.012 -7.625 431 HA ALA 61 HA ALA 61 7.934 -4.898 -7.792 432 HB1 ALA 61 HB1 ALA 61 5.027 -4.796 -6.993 433 HB2 ALA 61 HB2 ALA 61 5.662 -4.557 -8.620 434 HB3 ALA 61 HB3 ALA 61 6.047 -3.401 -7.346 435 H ASN 62 H ASN 62 8.197 -3.285 -6.045 436 HA ASN 62 HA ASN 62 7.747 -4.342 -3.373 437 HB2 ASN 62 HB2 ASN 62 10.084 -4.153 -2.724 438 HB3 ASN 62 HB1 ASN 62 9.908 -5.291 -4.055 439 HD21 ASN 62 HD21 ASN 62 11.220 -2.278 -3.025 440 HD22 ASN 62 HD22 ASN 62 12.144 -1.951 -4.451 441 H SER 63 H SER 63 7.095 -1.864 -5.144 442 HA SER 63 HA SER 63 7.094 -0.033 -2.975 443 HB2 SER 63 HB2 SER 63 8.599 1.687 -4.050 444 HB3 SER 63 HB1 SER 63 9.441 0.253 -3.457 445 HG SER 63 HG SER 63 8.791 -0.323 -5.909 446 H VAL 64 H VAL 64 5.518 1.433 -3.284 447 HA VAL 64 HA VAL 64 4.617 1.966 -6.044 448 HB VAL 64 HB VAL 64 2.790 0.803 -4.977 449 HG11 VAL 64 HG11 VAL 64 2.374 2.748 -2.841 450 HG12 VAL 64 HG12 VAL 64 3.773 1.695 -2.651 451 HG13 VAL 64 HG13 VAL 64 2.175 0.995 -2.855 452 HG21 VAL 64 HG21 VAL 64 1.052 2.403 -5.073 453 HG22 VAL 64 HG22 VAL 64 2.227 2.691 -6.352 454 HG23 VAL 64 HG23 VAL 64 2.210 3.724 -4.922 455 H THR 65 H THR 65 4.611 4.075 -6.666 456 HA THR 65 HA THR 65 5.006 6.140 -4.667 457 HB THR 65 HB THR 65 4.945 6.135 -7.672 458 HG1 THR 65 HG1 THR 65 7.262 6.826 -7.106 459 HG21 THR 65 HG21 THR 65 4.155 8.303 -6.868 460 HG22 THR 65 HG22 THR 65 5.782 8.466 -7.528 461 HG23 THR 65 HG23 THR 65 5.542 8.423 -5.783 462 H LEU 66 H LEU 66 3.114 6.467 -3.660 463 HA LEU 66 HA LEU 66 0.558 6.410 -4.945 464 HB2 LEU 66 HB2 LEU 66 0.793 7.849 -2.414 465 HB3 LEU 66 HB1 LEU 66 -0.312 6.575 -2.878 466 HG LEU 66 HG LEU 66 2.540 5.969 -2.204 467 HD11 LEU 66 HD11 LEU 66 0.332 5.773 -0.237 468 HD12 LEU 66 HD12 LEU 66 1.235 7.270 -0.433 469 HD13 LEU 66 HD13 LEU 66 2.077 5.791 0.012 470 HD21 LEU 66 HD21 LEU 66 -0.026 4.404 -2.220 471 HD22 LEU 66 HD22 LEU 66 1.530 3.779 -1.657 472 HD23 LEU 66 HD23 LEU 66 1.316 4.231 -3.351 473 H SER 67 H SER 67 -0.671 8.113 -5.602 474 HA SER 67 HA SER 67 0.614 10.745 -5.554 475 HB2 SER 67 HB2 SER 67 1.068 9.417 -7.703 476 HB3 SER 67 HB1 SER 67 -0.651 9.599 -8.047 477 HG SER 67 HG SER 67 1.393 11.463 -8.139 478 H ASP 68 H ASP 68 -0.936 12.449 -6.294 479 HA ASP 68 HA ASP 68 -2.807 13.639 -5.859 480 HB2 ASP 68 HB2 ASP 68 -3.688 12.139 -7.650 481 HB3 ASP 68 HB1 ASP 68 -4.269 11.047 -6.401 482 H LEU 69 H LEU 69 -1.536 12.892 -3.612 483 HA LEU 69 HA LEU 69 -3.565 12.017 -1.712 484 HB2 LEU 69 HB2 LEU 69 -0.925 13.190 -0.886 485 HB3 LEU 69 HB1 LEU 69 -1.936 12.025 -0.054 486 HG LEU 69 HG LEU 69 -0.271 11.418 -2.487 487 HD11 LEU 69 HD11 LEU 69 0.098 10.758 0.428 488 HD12 LEU 69 HD12 LEU 69 1.066 11.894 -0.513 489 HD13 LEU 69 HD13 LEU 69 1.100 10.172 -0.899 490 HD21 LEU 69 HD21 LEU 69 -2.082 9.917 -2.499 491 HD22 LEU 69 HD22 LEU 69 -2.147 9.874 -0.737 492 HD23 LEU 69 HD23 LEU 69 -0.836 9.048 -1.589 493 H GLN 70 H GLN 70 -3.417 13.566 0.409 494 HA GLN 70 HA GLN 70 -3.689 16.341 -0.531 495 HB2 GLN 70 HB2 GLN 70 -5.868 15.303 0.014 496 HB3 GLN 70 HB1 GLN 70 -5.293 14.972 1.641 497 HG2 GLN 70 HG2 GLN 70 -6.703 16.916 1.662 498 HG3 GLN 70 HG1 GLN 70 -5.042 17.393 2.015 499 HE21 GLN 70 HE21 GLN 70 -5.391 19.506 1.386 500 HE22 GLN 70 HE22 GLN 70 -5.573 19.961 -0.274 501 HA PRO 71 HA PRO 71 -0.300 16.969 2.299 502 HB2 PRO 71 HB2 PRO 71 -0.519 19.698 2.441 503 HB3 PRO 71 HB1 PRO 71 0.313 18.811 1.162 504 HG2 PRO 71 HG2 PRO 71 -2.434 19.986 1.177 505 HG3 PRO 71 HG1 PRO 71 -1.231 19.963 -0.126 506 HD2 PRO 71 HD2 PRO 71 -3.329 18.283 -0.096 507 HD3 PRO 71 HD1 PRO 71 -1.745 17.792 -0.732 508 H GLY 72 H GLY 72 -0.065 17.104 4.459 509 HA2 GLY 72 HA2 GLY 72 -0.510 17.611 6.665 510 HA3 GLY 72 HA1 GLY 72 -1.787 18.690 6.121 511 H VAL 73 H VAL 73 -1.595 15.326 5.191 512 HA VAL 73 HA VAL 73 -3.910 14.754 6.917 513 HB VAL 73 HB VAL 73 -3.690 14.017 3.989 514 HG11 VAL 73 HG11 VAL 73 -6.153 13.462 4.439 515 HG12 VAL 73 HG12 VAL 73 -5.643 13.317 6.125 516 HG13 VAL 73 HG13 VAL 73 -4.910 12.288 4.889 517 HG21 VAL 73 HG21 VAL 73 -5.873 15.364 3.962 518 HG22 VAL 73 HG22 VAL 73 -4.331 16.231 3.923 519 HG23 VAL 73 HG23 VAL 73 -5.246 16.113 5.432 520 H GLN 74 H GLN 74 -4.172 12.648 7.551 521 HA GLN 74 HA GLN 74 -1.766 11.066 7.663 522 HB2 GLN 74 HB2 GLN 74 -3.796 11.555 9.382 523 HB3 GLN 74 HB1 GLN 74 -4.335 10.030 8.697 524 HG2 GLN 74 HG2 GLN 74 -1.718 10.527 10.087 525 HG3 GLN 74 HG1 GLN 74 -3.095 9.641 10.730 526 HE21 GLN 74 HE21 GLN 74 -0.365 9.581 8.634 527 HE22 GLN 74 HE22 GLN 74 -0.436 7.898 8.250 528 H TYR 75 H TYR 75 -1.351 9.348 6.400 529 HA TYR 75 HA TYR 75 -3.541 8.368 4.698 530 HB2 TYR 75 HB2 TYR 75 -0.881 9.389 3.975 531 HB3 TYR 75 HB1 TYR 75 -1.342 7.883 3.178 532 HD1 TYR 75 HD2 TYR 75 -2.321 11.411 3.692 533 HD2 TYR 75 HD1 TYR 75 -3.016 7.826 1.512 534 HE1 TYR 75 HE2 TYR 75 -3.746 12.649 2.117 535 HE2 TYR 75 HE1 TYR 75 -4.443 9.052 -0.065 536 HH TYR 75 HH TYR 75 -5.661 11.011 -0.290 537 H ASN 76 H ASN 76 -4.046 6.396 5.188 538 HA ASN 76 HA ASN 76 -2.089 4.488 6.166 539 HB2 ASN 76 HB2 ASN 76 -5.044 4.263 5.552 540 HB3 ASN 76 HB1 ASN 76 -4.065 2.892 6.054 541 HD21 ASN 76 HD21 ASN 76 -3.635 6.129 7.308 542 HD22 ASN 76 HD22 ASN 76 -4.205 5.789 8.904 543 H ILE 77 H ILE 77 -0.735 3.642 4.690 544 HA ILE 77 HA ILE 77 -1.764 2.926 2.043 545 HB ILE 77 HB ILE 77 1.057 2.703 3.111 546 HG12 ILE 77 HG12 ILE 77 1.358 4.423 1.194 547 HG13 ILE 77 HG11 ILE 77 -0.326 4.782 1.471 548 HG21 ILE 77 HG21 ILE 77 -0.178 1.917 0.524 549 HG22 ILE 77 HG22 ILE 77 1.082 1.099 1.462 550 HG23 ILE 77 HG23 ILE 77 1.459 2.564 0.537 551 HD11 ILE 77 HD11 ILE 77 1.100 6.319 2.676 552 HD12 ILE 77 HD12 ILE 77 1.877 4.973 3.509 553 HD13 ILE 77 HD13 ILE 77 0.174 5.324 3.801 554 H THR 78 H THR 78 -2.654 1.059 1.820 555 HA THR 78 HA THR 78 -1.886 -1.121 3.607 556 HB THR 78 HB THR 78 -4.364 -0.792 1.931 557 HG1 THR 78 HG1 THR 78 -4.385 0.819 3.470 558 HG21 THR 78 HG21 THR 78 -3.744 -2.624 4.259 559 HG22 THR 78 HG22 THR 78 -3.863 -3.113 2.568 560 HG23 THR 78 HG23 THR 78 -5.290 -2.521 3.417 561 H ILE 79 H ILE 79 -0.505 -2.548 2.645 562 HA ILE 79 HA ILE 79 -0.607 -2.829 -0.291 563 HB ILE 79 HB ILE 79 1.416 -4.231 1.465 564 HG12 ILE 79 HG12 ILE 79 1.948 -1.958 1.915 565 HG13 ILE 79 HG11 ILE 79 3.049 -2.509 0.655 566 HG21 ILE 79 HG21 ILE 79 2.745 -4.068 -0.656 567 HG22 ILE 79 HG22 ILE 79 1.241 -3.582 -1.444 568 HG23 ILE 79 HG23 ILE 79 1.361 -5.167 -0.672 569 HD11 ILE 79 HD11 ILE 79 1.953 -0.184 0.508 570 HD12 ILE 79 HD12 ILE 79 0.561 -1.079 -0.104 571 HD13 ILE 79 HD13 ILE 79 2.118 -1.188 -0.941 572 H TYR 80 H TYR 80 -1.180 -4.682 -1.291 573 HA TYR 80 HA TYR 80 -2.073 -6.939 0.386 574 HB2 TYR 80 HB2 TYR 80 -3.317 -5.922 -2.183 575 HB3 TYR 80 HB1 TYR 80 -3.866 -7.307 -1.256 576 HD1 TYR 80 HD1 TYR 80 -3.787 -3.616 -1.431 577 HD2 TYR 80 HD2 TYR 80 -5.151 -7.023 0.757 578 HE1 TYR 80 HE1 TYR 80 -5.390 -2.208 -0.215 579 HE2 TYR 80 HE2 TYR 80 -6.748 -5.607 1.972 580 HH TYR 80 HH TYR 80 -7.061 -3.272 2.563 581 H ALA 81 H ALA 81 -0.576 -8.520 -0.007 582 HA ALA 81 HA ALA 81 0.486 -8.972 -2.663 583 HB1 ALA 81 HB1 ALA 81 0.708 -10.584 -0.106 584 HB2 ALA 81 HB2 ALA 81 1.936 -9.539 -0.822 585 HB3 ALA 81 HB3 ALA 81 1.476 -11.044 -1.635 586 H VAL 82 H VAL 82 -0.765 -9.851 -4.188 587 HA VAL 82 HA VAL 82 -2.985 -11.561 -3.232 588 HB VAL 82 HB VAL 82 -3.831 -9.629 -4.436 589 HG11 VAL 82 HG11 VAL 82 -1.933 -9.146 -5.861 590 HG12 VAL 82 HG12 VAL 82 -3.423 -9.275 -6.795 591 HG13 VAL 82 HG13 VAL 82 -2.263 -10.604 -6.797 592 HG21 VAL 82 HG21 VAL 82 -5.018 -11.780 -4.636 593 HG22 VAL 82 HG22 VAL 82 -4.120 -12.102 -6.124 594 HG23 VAL 82 HG23 VAL 82 -5.244 -10.741 -6.044 595 H GLU 83 H GLU 83 -3.270 -13.565 -3.939 596 HA GLU 83 HA GLU 83 -1.307 -14.657 -5.831 597 HB2 GLU 83 HB2 GLU 83 -1.037 -15.190 -3.400 598 HB3 GLU 83 HB1 GLU 83 -2.548 -16.067 -3.460 599 HG2 GLU 83 HG2 GLU 83 -0.119 -16.695 -5.091 600 HG3 GLU 83 HG1 GLU 83 -0.463 -17.426 -3.534 601 H GLU 84 H GLU 84 -2.278 -16.689 -6.938 602 HA GLU 84 HA GLU 84 -4.575 -16.099 -8.323 603 HB2 GLU 84 HB2 GLU 84 -3.560 -18.859 -7.621 604 HB3 GLU 84 HB1 GLU 84 -4.710 -18.498 -8.896 605 HG2 GLU 84 HG2 GLU 84 -3.020 -17.216 -10.080 606 HG3 GLU 84 HG1 GLU 84 -1.871 -17.526 -8.781 607 H ASN 85 H ASN 85 -4.295 -17.994 -5.341 608 HA ASN 85 HA ASN 85 -7.124 -18.643 -5.454 609 HB2 ASN 85 HB2 ASN 85 -4.998 -19.499 -3.486 610 HB3 ASN 85 HB1 ASN 85 -6.642 -20.122 -3.548 611 HD21 ASN 85 HD21 ASN 85 -3.532 -20.062 -5.088 612 HD22 ASN 85 HD22 ASN 85 -3.803 -21.424 -6.130 613 H GLN 86 H GLN 86 -5.001 -16.542 -3.589 614 HA GLN 86 HA GLN 86 -7.269 -15.633 -2.016 615 HB2 GLN 86 HB2 GLN 86 -4.919 -17.054 -0.765 616 HB3 GLN 86 HB1 GLN 86 -6.021 -16.026 0.141 617 HG2 GLN 86 HG2 GLN 86 -7.852 -17.492 -0.289 618 HG3 GLN 86 HG1 GLN 86 -6.890 -18.448 -1.416 619 HE21 GLN 86 HE21 GLN 86 -7.228 -20.330 -0.263 620 HE22 GLN 86 HE22 GLN 86 -6.453 -20.641 1.242 621 H GLU 87 H GLU 87 -6.556 -13.945 -0.410 622 HA GLU 87 HA GLU 87 -4.279 -12.404 -1.468 623 HB2 GLU 87 HB2 GLU 87 -6.811 -11.447 -0.111 624 HB3 GLU 87 HB1 GLU 87 -5.449 -10.410 -0.508 625 HG2 GLU 87 HG2 GLU 87 -5.769 -10.847 -2.871 626 HG3 GLU 87 HG1 GLU 87 -7.086 -11.959 -2.504 627 H SER 88 H SER 88 -2.634 -12.050 -0.112 628 HA SER 88 HA SER 88 -2.534 -13.278 2.432 629 HB2 SER 88 HB2 SER 88 -0.704 -11.139 1.326 630 HB3 SER 88 HB1 SER 88 -0.329 -12.290 2.608 631 HG SER 88 HG SER 88 0.533 -13.175 0.825 632 H THR 89 H THR 89 -1.834 -12.036 4.432 633 HA THR 89 HA THR 89 -3.791 -10.240 5.262 634 HB THR 89 HB THR 89 -2.003 -9.682 7.080 635 HG1 THR 89 HG1 THR 89 -0.115 -10.486 6.553 636 HG21 THR 89 HG21 THR 89 -3.090 -12.472 6.693 637 HG22 THR 89 HG22 THR 89 -3.917 -11.125 7.474 638 HG23 THR 89 HG23 THR 89 -2.476 -11.822 8.214 639 HA PRO 90 HA PRO 90 -2.435 -6.476 3.544 640 HB2 PRO 90 HB2 PRO 90 -3.769 -4.698 5.038 641 HB3 PRO 90 HB1 PRO 90 -4.604 -5.849 3.988 642 HG2 PRO 90 HG2 PRO 90 -4.236 -5.902 6.946 643 HG3 PRO 90 HG1 PRO 90 -5.629 -6.410 5.978 644 HD2 PRO 90 HD2 PRO 90 -3.680 -8.083 7.045 645 HD3 PRO 90 HD1 PRO 90 -4.814 -8.507 5.751 646 H VAL 91 H VAL 91 -0.802 -5.120 3.604 647 HA VAL 91 HA VAL 91 0.778 -4.548 5.962 648 HB VAL 91 HB VAL 91 0.788 -3.549 3.122 649 HG11 VAL 91 HG11 VAL 91 1.288 -1.691 4.641 650 HG12 VAL 91 HG12 VAL 91 2.684 -2.147 3.677 651 HG13 VAL 91 HG13 VAL 91 2.584 -2.641 5.365 652 HG21 VAL 91 HG21 VAL 91 2.977 -4.553 3.006 653 HG22 VAL 91 HG22 VAL 91 1.790 -5.754 3.523 654 HG23 VAL 91 HG23 VAL 91 2.883 -5.026 4.703 655 H VAL 92 H VAL 92 0.046 -2.977 7.392 656 HA VAL 92 HA VAL 92 -1.264 -0.667 6.128 657 HB VAL 92 HB VAL 92 -1.560 -1.352 9.045 658 HG11 VAL 92 HG11 VAL 92 -2.035 0.936 8.463 659 HG12 VAL 92 HG12 VAL 92 -3.554 0.105 8.808 660 HG13 VAL 92 HG13 VAL 92 -3.077 0.418 7.135 661 HG21 VAL 92 HG21 VAL 92 -2.450 -3.237 7.785 662 HG22 VAL 92 HG22 VAL 92 -3.394 -2.140 6.777 663 HG23 VAL 92 HG23 VAL 92 -3.766 -2.301 8.494 664 H ILE 93 H ILE 93 0.290 0.749 5.811 665 HA ILE 93 HA ILE 93 1.938 1.518 8.129 666 HB ILE 93 HB ILE 93 3.614 2.375 6.385 667 HG12 ILE 93 HG12 ILE 93 2.363 0.324 4.596 668 HG13 ILE 93 HG11 ILE 93 1.896 2.003 4.518 669 HG21 ILE 93 HG21 ILE 93 3.200 -0.599 6.663 670 HG22 ILE 93 HG22 ILE 93 4.041 0.445 7.809 671 HG23 ILE 93 HG23 ILE 93 4.703 0.198 6.193 672 HD11 ILE 93 HD11 ILE 93 4.280 2.584 4.163 673 HD12 ILE 93 HD12 ILE 93 3.532 1.639 2.862 674 HD13 ILE 93 HD13 ILE 93 4.607 0.853 4.023 675 H GLN 94 H GLN 94 1.372 3.455 8.845 676 HA GLN 94 HA GLN 94 -0.093 5.191 6.998 677 HB2 GLN 94 HB2 GLN 94 -1.096 6.214 8.976 678 HB3 GLN 94 HB1 GLN 94 -1.347 4.474 8.961 679 HG2 GLN 94 HG2 GLN 94 0.583 4.248 10.524 680 HG3 GLN 94 HG1 GLN 94 0.628 6.002 10.639 681 HE21 GLN 94 HE21 GLN 94 -2.272 6.276 10.517 682 HE22 GLN 94 HE22 GLN 94 -2.865 5.754 12.057 683 H GLN 95 H GLN 95 0.752 6.997 6.321 684 HA GLN 95 HA GLN 95 2.847 8.319 7.910 685 HB2 GLN 95 HB2 GLN 95 3.020 7.268 5.224 686 HB3 GLN 95 HB1 GLN 95 3.239 9.008 5.211 687 HG2 GLN 95 HG2 GLN 95 4.805 7.075 6.904 688 HG3 GLN 95 HG1 GLN 95 5.361 7.816 5.403 689 HE21 GLN 95 HE21 GLN 95 3.991 10.353 6.089 690 HE22 GLN 95 HE22 GLN 95 5.009 11.110 7.266 691 H GLU 96 H GLU 96 2.498 10.459 8.255 692 HA GLU 96 HA GLU 96 0.166 11.690 7.036 693 HB2 GLU 96 HB2 GLU 96 2.157 12.791 9.027 694 HB3 GLU 96 HB1 GLU 96 0.704 13.619 8.482 695 HG2 GLU 96 HG2 GLU 96 -0.687 11.951 9.479 696 HG3 GLU 96 HG1 GLU 96 0.720 10.982 9.924 697 H THR 97 H THR 97 0.201 13.146 5.438 698 HA THR 97 HA THR 97 2.598 13.437 3.923 699 HB THR 97 HB THR 97 1.196 14.941 2.495 700 HG1 THR 97 HG1 THR 97 -1.150 14.767 3.106 701 HG21 THR 97 HG21 THR 97 1.324 12.476 2.159 702 HG22 THR 97 HG22 THR 97 -0.214 13.168 1.641 703 HG23 THR 97 HG23 THR 97 -0.108 12.301 3.174 704 H THR 98 H THR 98 4.171 14.782 4.434 705 HA THR 98 HA THR 98 3.886 16.881 6.324 706 HB THR 98 HB THR 98 6.180 16.502 4.392 707 HG1 THR 98 HG1 THR 98 6.175 15.391 6.986 708 HG21 THR 98 HG21 THR 98 6.062 17.648 7.187 709 HG22 THR 98 HG22 THR 98 6.214 18.580 5.698 710 HG23 THR 98 HG23 THR 98 7.511 17.494 6.194 711 H GLY 99 H GLY 99 3.940 16.701 2.828 712 HA2 GLY 99 HA2 GLY 99 2.636 18.267 1.568 713 HA3 GLY 99 HA1 GLY 99 2.996 19.479 2.772 714 H THR 100 H THR 100 3.509 20.743 0.868 715 HA THR 100 HA THR 100 5.843 20.166 -0.675 716 HB THR 100 HB THR 100 4.372 22.780 -0.308 717 HG1 THR 100 HG1 THR 100 3.990 20.578 -2.056 718 HG21 THR 100 HG21 THR 100 6.221 21.861 -2.492 719 HG22 THR 100 HG22 THR 100 6.567 23.085 -1.270 720 HG23 THR 100 HG23 THR 100 5.311 23.371 -2.469 721 HA PRO 101 HA PRO 101 8.981 21.250 2.306 722 HB2 PRO 101 HB2 PRO 101 10.326 22.128 -0.215 723 HB3 PRO 101 HB1 PRO 101 10.955 21.139 1.109 724 HG2 PRO 101 HG2 PRO 101 10.188 20.004 -1.164 725 HG3 PRO 101 HG1 PRO 101 9.836 19.234 0.394 726 HD2 PRO 101 HD2 PRO 101 8.014 20.691 -1.456 727 HD3 PRO 101 HD1 PRO 101 7.676 19.321 -0.379 728 H ARG 102 H ARG 102 8.209 22.992 3.402 729 HA ARG 102 HA ARG 102 8.469 25.640 2.170 730 HB2 ARG 102 HB2 ARG 102 6.309 25.221 3.192 731 HB3 ARG 102 HB1 ARG 102 7.076 24.734 4.696 732 HG2 ARG 102 HG2 ARG 102 7.909 27.010 5.012 733 HG3 ARG 102 HG1 ARG 102 7.146 27.499 3.497 734 HD2 ARG 102 HD2 ARG 102 5.684 26.372 5.881 735 HD3 ARG 102 HD1 ARG 102 5.817 28.089 5.504 736 HE ARG 102 HE ARG 102 4.679 27.446 3.331 737 HH11 ARG 102 HH11 ARG 102 4.145 25.697 6.325 738 HH12 ARG 102 HH12 ARG 102 2.540 25.201 5.887 739 HH21 ARG 102 HH21 ARG 102 2.565 26.797 2.766 740 HH22 ARG 102 HH22 ARG 102 1.646 25.816 3.866 741 H SER 103 H SER 103 10.382 26.543 2.447 742 HA SER 103 HA SER 103 12.323 27.273 3.366 743 HB2 SER 103 HB2 SER 103 10.901 26.894 6.013 744 HB3 SER 103 HB1 SER 103 12.281 27.946 5.698 745 HG SER 103 HG SER 103 10.460 28.632 3.953 746 H ASP 104 H ASP 104 12.285 24.619 2.688 747 HA ASP 104 HA ASP 104 13.115 22.888 4.785 748 HB2 ASP 104 HB2 ASP 104 12.095 22.072 2.686 749 HB3 ASP 104 HB1 ASP 104 13.518 22.606 1.798 750 H GLY 105 H GLY 105 14.900 23.379 5.896 751 HA2 GLY 105 HA2 GLY 105 17.300 23.015 5.933 752 HA3 GLY 105 HA1 GLY 105 17.380 23.774 4.348 753 H THR 106 H THR 106 18.031 24.241 7.508 754 HA THR 106 HA THR 106 17.237 26.950 7.876 755 HB THR 106 HB THR 106 19.506 25.540 9.288 756 HG1 THR 106 HG1 THR 106 16.692 25.337 9.629 757 HG21 THR 106 HG21 THR 106 17.606 27.716 10.174 758 HG22 THR 106 HG22 THR 106 19.290 27.950 9.711 759 HG23 THR 106 HG23 THR 106 18.894 27.008 11.148 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 3.347 -35.499 -1.302 2 H2 GLY 1 HT2 GLY 1 1.685 -35.782 -1.408 3 H3 GLY 1 HT3 GLY 1 2.771 -37.071 -1.535 4 HA2 GLY 1 HA1 GLY 1 3.465 -36.773 0.745 5 HA3 GLY 1 HA2 GLY 1 2.368 -35.405 0.884 6 H SER 2 H SER 2 2.198 -37.555 2.612 7 HA SER 2 HA SER 2 0.322 -39.513 1.823 8 HB2 SER 2 HB2 SER 2 0.898 -38.446 4.599 9 HB3 SER 2 HB1 SER 2 0.092 -39.967 4.219 10 HG SER 2 HG SER 2 1.952 -40.845 3.644 11 H HIS 3 H HIS 3 -0.022 -36.408 3.489 12 HA HIS 3 HA HIS 3 -2.909 -36.619 3.520 13 HB2 HIS 3 HB2 HIS 3 -1.730 -35.533 5.396 14 HB3 HIS 3 HB1 HIS 3 -1.090 -34.321 4.293 15 HD1 HIS 3 HD1 HIS 3 -4.204 -35.320 6.104 16 HD2 HIS 3 HD2 HIS 3 -2.912 -32.309 3.548 17 HE1 HIS 3 HE1 HIS 3 -5.986 -33.550 6.189 18 HE2 HIS 3 HE2 HIS 3 -5.100 -31.671 4.769 19 H MET 4 H MET 4 -3.860 -36.430 1.578 20 HA MET 4 HA MET 4 -2.814 -34.711 -0.466 21 HB2 MET 4 HB2 MET 4 -5.361 -36.317 -0.262 22 HB3 MET 4 HB1 MET 4 -4.965 -35.323 -1.658 23 HG2 MET 4 HG2 MET 4 -3.349 -37.642 -0.622 24 HG3 MET 4 HG1 MET 4 -4.395 -37.653 -2.041 25 HE1 MET 4 HE1 MET 4 -1.322 -38.555 -1.999 26 HE2 MET 4 HE2 MET 4 -0.718 -37.829 -3.488 27 HE3 MET 4 HE3 MET 4 -2.297 -38.614 -3.467 28 H GLY 5 H GLY 5 -3.762 -32.834 -1.292 29 HA2 GLY 5 HA2 GLY 5 -5.441 -31.095 -1.180 30 HA3 GLY 5 HA1 GLY 5 -5.673 -31.503 0.517 31 H THR 6 H THR 6 -4.789 -29.005 -1.055 32 HA THR 6 HA THR 6 -2.708 -28.269 0.841 33 HB THR 6 HB THR 6 -2.319 -27.967 -2.148 34 HG1 THR 6 HG1 THR 6 -1.694 -29.948 -0.423 35 HG21 THR 6 HG21 THR 6 -1.395 -26.069 -0.913 36 HG22 THR 6 HG22 THR 6 -0.101 -27.085 -1.548 37 HG23 THR 6 HG23 THR 6 -0.533 -27.171 0.159 38 H THR 7 H THR 7 -3.512 -26.511 1.776 39 HA THR 7 HA THR 7 -5.053 -24.612 0.167 40 HB THR 7 HB THR 7 -5.556 -23.575 2.452 41 HG1 THR 7 HG1 THR 7 -4.869 -24.578 4.207 42 HG21 THR 7 HG21 THR 7 -7.184 -24.926 1.223 43 HG22 THR 7 HG22 THR 7 -7.298 -25.224 2.958 44 HG23 THR 7 HG23 THR 7 -6.494 -26.395 1.913 45 H THR 8 H THR 8 -2.722 -24.360 2.859 46 HA THR 8 HA THR 8 -0.841 -23.125 3.146 47 HB THR 8 HB THR 8 -0.992 -22.594 0.171 48 HG1 THR 8 HG1 THR 8 0.216 -24.432 -0.046 49 HG21 THR 8 HG21 THR 8 1.395 -22.142 0.341 50 HG22 THR 8 HG22 THR 8 1.345 -22.433 2.078 51 HG23 THR 8 HG23 THR 8 0.493 -21.051 1.393 52 H ALA 9 H ALA 9 -0.757 -21.228 4.136 53 HA ALA 9 HA ALA 9 -2.465 -19.049 3.132 54 HB1 ALA 9 HB1 ALA 9 -2.502 -18.195 5.421 55 HB2 ALA 9 HB2 ALA 9 -1.467 -19.523 5.941 56 HB3 ALA 9 HB3 ALA 9 -3.095 -19.853 5.353 57 HA PRO 10 HA PRO 10 1.494 -17.129 2.268 58 HB2 PRO 10 HB2 PRO 10 0.528 -15.019 0.918 59 HB3 PRO 10 HB1 PRO 10 0.524 -16.646 0.225 60 HG2 PRO 10 HG2 PRO 10 -1.711 -15.163 1.564 61 HG3 PRO 10 HG1 PRO 10 -1.738 -16.090 0.052 62 HD2 PRO 10 HD2 PRO 10 -2.591 -17.114 2.406 63 HD3 PRO 10 HD1 PRO 10 -1.884 -18.096 1.159 64 H ASP 11 H ASP 11 2.640 -15.319 2.990 65 HA ASP 11 HA ASP 11 1.326 -13.850 5.173 66 HB2 ASP 11 HB2 ASP 11 4.225 -14.476 4.622 67 HB3 ASP 11 HB1 ASP 11 3.733 -13.268 5.802 68 H ALA 12 H ALA 12 1.342 -11.658 5.249 69 HA ALA 12 HA ALA 12 1.742 -10.177 2.832 70 HB1 ALA 12 HB1 ALA 12 0.043 -9.552 4.494 71 HB2 ALA 12 HB2 ALA 12 1.181 -8.233 4.218 72 HB3 ALA 12 HB3 ALA 12 1.312 -9.223 5.672 73 HA PRO 13 HA PRO 13 6.032 -8.974 3.252 74 HB2 PRO 13 HB2 PRO 13 5.021 -6.244 2.629 75 HB3 PRO 13 HB1 PRO 13 6.312 -7.168 1.852 76 HG2 PRO 13 HG2 PRO 13 3.966 -6.876 0.654 77 HG3 PRO 13 HG1 PRO 13 4.823 -8.430 0.587 78 HD2 PRO 13 HD2 PRO 13 2.480 -7.621 2.262 79 HD3 PRO 13 HD1 PRO 13 2.805 -9.167 1.451 80 HA PRO 14 HA PRO 14 6.226 -7.397 7.511 81 HB2 PRO 14 HB2 PRO 14 8.975 -6.922 6.421 82 HB3 PRO 14 HB1 PRO 14 8.493 -7.577 7.990 83 HG2 PRO 14 HG2 PRO 14 9.349 -9.194 6.063 84 HG3 PRO 14 HG1 PRO 14 8.006 -9.672 7.117 85 HD2 PRO 14 HD2 PRO 14 7.965 -8.799 4.276 86 HD3 PRO 14 HD1 PRO 14 6.881 -9.909 5.134 87 H ASP 15 H ASP 15 6.382 -5.359 8.398 88 HA ASP 15 HA ASP 15 5.048 -3.405 7.164 89 HB2 ASP 15 HB2 ASP 15 7.206 -3.013 9.236 90 HB3 ASP 15 HB1 ASP 15 6.039 -1.778 8.779 91 HA PRO 16 HA PRO 16 7.906 -2.059 3.942 92 HB2 PRO 16 HB2 PRO 16 5.459 -0.563 3.177 93 HB3 PRO 16 HB1 PRO 16 6.463 -1.649 2.187 94 HG2 PRO 16 HG2 PRO 16 4.086 -2.448 3.028 95 HG3 PRO 16 HG1 PRO 16 5.462 -3.561 3.085 96 HD2 PRO 16 HD2 PRO 16 4.267 -1.938 5.315 97 HD3 PRO 16 HD1 PRO 16 4.686 -3.671 5.304 98 H THR 17 H THR 17 8.893 -0.143 3.469 99 HA THR 17 HA THR 17 8.446 1.986 5.468 100 HB THR 17 HB THR 17 10.969 1.457 3.885 101 HG1 THR 17 HG1 THR 17 11.664 0.227 5.553 102 HG21 THR 17 HG21 THR 17 12.029 2.847 5.602 103 HG22 THR 17 HG22 THR 17 10.463 3.085 6.379 104 HG23 THR 17 HG23 THR 17 10.752 3.732 4.766 105 H VAL 18 H VAL 18 7.848 3.847 4.893 106 HA VAL 18 HA VAL 18 7.594 4.584 2.102 107 HB VAL 18 HB VAL 18 6.908 6.119 4.614 108 HG11 VAL 18 HG11 VAL 18 7.453 7.670 2.813 109 HG12 VAL 18 HG12 VAL 18 5.721 7.686 3.133 110 HG13 VAL 18 HG13 VAL 18 6.352 6.827 1.719 111 HG21 VAL 18 HG21 VAL 18 4.602 5.643 4.020 112 HG22 VAL 18 HG22 VAL 18 5.508 4.142 4.213 113 HG23 VAL 18 HG23 VAL 18 5.136 4.747 2.600 114 H ASP 19 H ASP 19 9.059 5.615 0.985 115 HA ASP 19 HA ASP 19 11.556 6.365 2.227 116 HB2 ASP 19 HB2 ASP 19 11.445 5.123 0.076 117 HB3 ASP 19 HB1 ASP 19 10.708 6.534 -0.674 118 H GLN 20 H GLN 20 9.036 8.019 0.344 119 HA GLN 20 HA GLN 20 9.934 10.574 1.477 120 HB2 GLN 20 HB2 GLN 20 9.378 10.045 -1.446 121 HB3 GLN 20 HB1 GLN 20 9.507 11.653 -0.751 122 HG2 GLN 20 HG2 GLN 20 11.819 11.135 -0.070 123 HG3 GLN 20 HG1 GLN 20 11.672 9.569 -0.863 124 HE21 GLN 20 HE21 GLN 20 10.051 10.727 -3.045 125 HE22 GLN 20 HE22 GLN 20 11.159 11.555 -4.047 126 H VAL 21 H VAL 21 8.362 11.983 1.954 127 HA VAL 21 HA VAL 21 5.619 11.258 1.213 128 HB VAL 21 HB VAL 21 4.916 12.234 3.462 129 HG11 VAL 21 HG11 VAL 21 5.402 10.117 4.668 130 HG12 VAL 21 HG12 VAL 21 6.491 9.660 3.356 131 HG13 VAL 21 HG13 VAL 21 4.770 9.868 3.042 132 HG21 VAL 21 HG21 VAL 21 7.836 11.772 4.074 133 HG22 VAL 21 HG22 VAL 21 6.583 12.129 5.263 134 HG23 VAL 21 HG23 VAL 21 7.014 13.331 4.045 135 H ASP 22 H ASP 22 5.168 12.724 -0.295 136 HA ASP 22 HA ASP 22 5.870 15.535 0.152 137 HB2 ASP 22 HB2 ASP 22 4.918 14.027 -2.290 138 HB3 ASP 22 HB1 ASP 22 5.060 15.780 -2.249 139 H ASP 23 H ASP 23 3.810 16.654 -1.458 140 HA ASP 23 HA ASP 23 1.653 16.686 0.444 141 HB2 ASP 23 HB2 ASP 23 0.639 18.366 -1.075 142 HB3 ASP 23 HB1 ASP 23 2.283 18.765 -0.640 143 H THR 24 H THR 24 2.009 15.780 -2.936 144 HA THR 24 HA THR 24 -0.564 14.355 -2.770 145 HB THR 24 HB THR 24 -0.778 14.946 -5.224 146 HG1 THR 24 HG1 THR 24 0.997 17.072 -4.785 147 HG21 THR 24 HG21 THR 24 -0.621 17.250 -3.263 148 HG22 THR 24 HG22 THR 24 -1.995 16.151 -3.439 149 HG23 THR 24 HG23 THR 24 -1.549 17.225 -4.767 150 H SER 25 H SER 25 1.906 13.143 -2.191 151 HA SER 25 HA SER 25 2.118 10.987 -3.982 152 HB2 SER 25 HB2 SER 25 4.352 13.032 -4.149 153 HB3 SER 25 HB1 SER 25 4.445 11.397 -4.800 154 HG SER 25 HG SER 25 2.216 12.781 -5.611 155 H ILE 26 H ILE 26 2.897 9.306 -2.868 156 HA ILE 26 HA ILE 26 4.938 9.712 -0.789 157 HB ILE 26 HB ILE 26 2.192 8.584 -0.265 158 HG12 ILE 26 HG12 ILE 26 3.975 10.440 1.316 159 HG13 ILE 26 HG11 ILE 26 2.603 10.926 0.330 160 HG21 ILE 26 HG21 ILE 26 3.018 7.617 1.843 161 HG22 ILE 26 HG22 ILE 26 4.669 7.960 1.327 162 HG23 ILE 26 HG23 ILE 26 3.683 6.815 0.417 163 HD11 ILE 26 HD11 ILE 26 1.149 9.559 1.822 164 HD12 ILE 26 HD12 ILE 26 1.922 10.936 2.608 165 HD13 ILE 26 HD13 ILE 26 2.553 9.302 2.860 166 H VAL 27 H VAL 27 6.333 7.882 -0.617 167 HA VAL 27 HA VAL 27 5.640 5.772 -2.565 168 HB VAL 27 HB VAL 27 8.420 6.677 -1.834 169 HG11 VAL 27 HG11 VAL 27 9.208 5.021 -3.196 170 HG12 VAL 27 HG12 VAL 27 7.802 5.084 -4.258 171 HG13 VAL 27 HG13 VAL 27 7.688 4.255 -2.702 172 HG21 VAL 27 HG21 VAL 27 7.233 8.409 -3.099 173 HG22 VAL 27 HG22 VAL 27 6.845 7.226 -4.350 174 HG23 VAL 27 HG23 VAL 27 8.523 7.680 -4.052 175 H VAL 28 H VAL 28 5.616 3.722 -1.819 176 HA VAL 28 HA VAL 28 6.827 3.283 0.825 177 HB VAL 28 HB VAL 28 4.955 2.473 1.735 178 HG11 VAL 28 HG11 VAL 28 3.562 3.735 -0.580 179 HG12 VAL 28 HG12 VAL 28 4.211 4.588 0.819 180 HG13 VAL 28 HG13 VAL 28 2.910 3.425 1.027 181 HG21 VAL 28 HG21 VAL 28 4.984 0.449 0.454 182 HG22 VAL 28 HG22 VAL 28 4.182 1.272 -0.888 183 HG23 VAL 28 HG23 VAL 28 3.320 1.031 0.635 184 H ARG 29 H ARG 29 7.731 1.243 1.183 185 HA ARG 29 HA ARG 29 8.001 -0.474 -1.211 186 HB2 ARG 29 HB2 ARG 29 10.281 0.103 0.670 187 HB3 ARG 29 HB1 ARG 29 10.349 -0.661 -0.908 188 HG2 ARG 29 HG2 ARG 29 9.848 1.456 -1.980 189 HG3 ARG 29 HG1 ARG 29 9.696 2.236 -0.404 190 HD2 ARG 29 HD2 ARG 29 12.171 1.037 -1.634 191 HD3 ARG 29 HD1 ARG 29 11.869 2.735 -1.261 192 HE ARG 29 HE ARG 29 11.814 0.882 0.985 193 HH11 ARG 29 HH11 ARG 29 13.651 3.217 -0.863 194 HH12 ARG 29 HH12 ARG 29 14.810 3.488 0.393 195 HH21 ARG 29 HH21 ARG 29 13.341 1.223 2.636 196 HH22 ARG 29 HH22 ARG 29 14.642 2.343 2.388 197 H TRP 30 H TRP 30 7.534 -2.487 -0.818 198 HA TRP 30 HA TRP 30 7.342 -3.345 1.998 199 HB2 TRP 30 HB2 TRP 30 5.633 -5.006 1.142 200 HB3 TRP 30 HB1 TRP 30 5.148 -3.321 1.069 201 HD1 TRP 30 HD1 TRP 30 6.125 -6.220 -1.175 202 HE1 TRP 30 HE1 TRP 30 5.319 -5.737 -3.565 203 HE3 TRP 30 HE3 TRP 30 4.513 -1.463 -0.483 204 HZ2 TRP 30 HZ2 TRP 30 4.094 -3.619 -4.949 205 HZ3 TRP 30 HZ3 TRP 30 3.504 -0.284 -2.384 206 HH2 TRP 30 HH2 TRP 30 3.293 -1.328 -4.555 207 H SER 31 H SER 31 8.062 -5.316 2.667 208 HA SER 31 HA SER 31 10.107 -6.550 1.033 209 HB2 SER 31 HB2 SER 31 9.192 -7.275 3.827 210 HB3 SER 31 HB1 SER 31 10.694 -7.768 3.047 211 HG SER 31 HG SER 31 11.031 -6.011 4.449 212 H ARG 32 H ARG 32 9.002 -7.567 -0.562 213 HA ARG 32 HA ARG 32 6.668 -8.932 -0.588 214 HB2 ARG 32 HB2 ARG 32 9.055 -9.849 -2.178 215 HB3 ARG 32 HB1 ARG 32 7.360 -9.919 -2.632 216 HG2 ARG 32 HG2 ARG 32 8.005 -8.111 -3.852 217 HG3 ARG 32 HG1 ARG 32 7.529 -7.307 -2.356 218 HD2 ARG 32 HD2 ARG 32 9.571 -6.330 -2.724 219 HD3 ARG 32 HD1 ARG 32 10.033 -7.691 -1.708 220 HE ARG 32 HE ARG 32 10.140 -8.454 -4.426 221 HH11 ARG 32 HH11 ARG 32 11.867 -6.544 -2.044 222 HH12 ARG 32 HH12 ARG 32 13.409 -6.765 -2.804 223 HH21 ARG 32 HH21 ARG 32 12.173 -8.737 -5.423 224 HH22 ARG 32 HH22 ARG 32 13.581 -7.998 -4.730 225 HA PRO 33 HA PRO 33 7.013 -12.571 1.722 226 HB2 PRO 33 HB2 PRO 33 4.942 -13.891 0.232 227 HB3 PRO 33 HB1 PRO 33 4.774 -12.930 1.706 228 HG2 PRO 33 HG2 PRO 33 3.753 -12.195 -0.735 229 HG3 PRO 33 HG1 PRO 33 4.184 -11.044 0.548 230 HD2 PRO 33 HD2 PRO 33 5.782 -11.893 -1.844 231 HD3 PRO 33 HD1 PRO 33 5.511 -10.255 -1.217 232 H GLN 34 H GLN 34 7.290 -14.868 1.791 233 HA GLN 34 HA GLN 34 8.848 -16.012 -0.332 234 HB2 GLN 34 HB2 GLN 34 7.640 -17.348 2.095 235 HB3 GLN 34 HB1 GLN 34 8.871 -18.022 1.037 236 HG2 GLN 34 HG2 GLN 34 10.459 -16.358 1.737 237 HG3 GLN 34 HG1 GLN 34 9.228 -15.548 2.706 238 HE21 GLN 34 HE21 GLN 34 11.325 -18.308 2.456 239 HE22 GLN 34 HE22 GLN 34 11.131 -18.853 4.087 240 H ALA 35 H ALA 35 5.540 -15.853 0.549 241 HA ALA 35 HA ALA 35 4.459 -18.070 -0.767 242 HB1 ALA 35 HB1 ALA 35 3.207 -15.331 -0.630 243 HB2 ALA 35 HB2 ALA 35 3.259 -16.445 0.741 244 HB3 ALA 35 HB3 ALA 35 2.389 -16.893 -0.726 245 HA PRO 36 HA PRO 36 5.059 -16.800 -5.053 246 HB2 PRO 36 HB2 PRO 36 3.018 -18.792 -5.707 247 HB3 PRO 36 HB1 PRO 36 4.718 -18.752 -6.177 248 HG2 PRO 36 HG2 PRO 36 3.728 -20.562 -4.422 249 HG3 PRO 36 HG1 PRO 36 5.392 -19.956 -4.343 250 HD2 PRO 36 HD2 PRO 36 3.012 -19.189 -2.697 251 HD3 PRO 36 HD1 PRO 36 4.708 -19.395 -2.207 252 H ILE 37 H ILE 37 4.086 -14.940 -5.500 253 HA ILE 37 HA ILE 37 1.170 -14.739 -5.174 254 HB ILE 37 HB ILE 37 1.537 -12.316 -4.738 255 HG12 ILE 37 HG12 ILE 37 4.453 -13.108 -4.734 256 HG13 ILE 37 HG11 ILE 37 3.664 -12.061 -5.897 257 HG21 ILE 37 HG21 ILE 37 2.233 -12.501 -2.443 258 HG22 ILE 37 HG22 ILE 37 3.140 -13.985 -2.781 259 HG23 ILE 37 HG23 ILE 37 1.377 -13.994 -2.863 260 HD11 ILE 37 HD11 ILE 37 4.968 -10.818 -4.256 261 HD12 ILE 37 HD12 ILE 37 3.958 -11.480 -2.969 262 HD13 ILE 37 HD13 ILE 37 3.253 -10.417 -4.185 263 H THR 38 H THR 38 0.061 -13.389 -6.707 264 HA THR 38 HA THR 38 1.328 -13.421 -9.332 265 HB THR 38 HB THR 38 -1.047 -12.815 -10.086 266 HG1 THR 38 HG1 THR 38 -2.596 -12.836 -8.613 267 HG21 THR 38 HG21 THR 38 -0.078 -14.995 -10.412 268 HG22 THR 38 HG22 THR 38 -1.769 -15.138 -9.951 269 HG23 THR 38 HG23 THR 38 -0.505 -15.459 -8.766 270 H GLY 39 H GLY 39 0.273 -11.132 -6.911 271 HA2 GLY 39 HA2 GLY 39 1.524 -9.004 -8.283 272 HA3 GLY 39 HA1 GLY 39 -0.215 -8.916 -8.504 273 H TYR 40 H TYR 40 0.096 -6.843 -7.439 274 HA TYR 40 HA TYR 40 -0.403 -7.204 -4.579 275 HB2 TYR 40 HB2 TYR 40 1.535 -5.277 -5.826 276 HB3 TYR 40 HB1 TYR 40 0.726 -4.891 -4.309 277 HD1 TYR 40 HD2 TYR 40 3.041 -7.264 -5.932 278 HD2 TYR 40 HD1 TYR 40 1.383 -5.880 -2.276 279 HE1 TYR 40 HE2 TYR 40 4.709 -8.567 -4.687 280 HE2 TYR 40 HE1 TYR 40 3.023 -7.193 -1.024 281 HH TYR 40 HH TYR 40 5.689 -8.762 -2.582 282 H ARG 41 H ARG 41 -2.264 -6.310 -4.001 283 HA ARG 41 HA ARG 41 -3.330 -4.051 -5.544 284 HB2 ARG 41 HB2 ARG 41 -4.585 -5.112 -3.046 285 HB3 ARG 41 HB1 ARG 41 -5.330 -4.330 -4.437 286 HG2 ARG 41 HG2 ARG 41 -4.004 -6.989 -4.717 287 HG3 ARG 41 HG1 ARG 41 -5.644 -6.877 -4.064 288 HD2 ARG 41 HD2 ARG 41 -4.736 -5.811 -6.733 289 HD3 ARG 41 HD1 ARG 41 -5.657 -7.294 -6.481 290 HE ARG 41 HE ARG 41 -6.643 -4.546 -6.099 291 HH11 ARG 41 HH11 ARG 41 -7.277 -7.987 -6.302 292 HH12 ARG 41 HH12 ARG 41 -8.993 -7.789 -6.400 293 HH21 ARG 41 HH21 ARG 41 -8.879 -4.277 -6.226 294 HH22 ARG 41 HH22 ARG 41 -9.916 -5.673 -6.358 295 H ILE 42 H ILE 42 -3.612 -2.015 -4.558 296 HA ILE 42 HA ILE 42 -2.375 -1.745 -1.894 297 HB ILE 42 HB ILE 42 -1.720 0.087 -4.182 298 HG12 ILE 42 HG12 ILE 42 0.016 -2.063 -2.998 299 HG13 ILE 42 HG11 ILE 42 -0.899 -2.258 -4.483 300 HG21 ILE 42 HG21 ILE 42 -0.047 1.001 -2.734 301 HG22 ILE 42 HG22 ILE 42 -0.341 -0.245 -1.522 302 HG23 ILE 42 HG23 ILE 42 -1.567 0.980 -1.840 303 HD11 ILE 42 HD11 ILE 42 1.392 -1.745 -4.962 304 HD12 ILE 42 HD12 ILE 42 1.289 -0.285 -3.983 305 HD13 ILE 42 HD13 ILE 42 0.355 -0.413 -5.472 306 H VAL 43 H VAL 43 -3.990 -0.971 -0.646 307 HA VAL 43 HA VAL 43 -5.592 1.214 -1.809 308 HB VAL 43 HB VAL 43 -6.341 -0.655 0.442 309 HG11 VAL 43 HG11 VAL 43 -7.140 1.537 0.973 310 HG12 VAL 43 HG12 VAL 43 -8.489 0.533 0.453 311 HG13 VAL 43 HG13 VAL 43 -7.808 1.732 -0.647 312 HG21 VAL 43 HG21 VAL 43 -7.606 -0.215 -2.253 313 HG22 VAL 43 HG22 VAL 43 -8.102 -1.390 -1.034 314 HG23 VAL 43 HG23 VAL 43 -6.547 -1.565 -1.848 315 H TYR 44 H TYR 44 -4.814 3.068 -1.243 316 HA TYR 44 HA TYR 44 -4.026 3.475 1.539 317 HB2 TYR 44 HB2 TYR 44 -2.861 5.579 0.497 318 HB3 TYR 44 HB1 TYR 44 -2.078 4.009 0.424 319 HD1 TYR 44 HD1 TYR 44 -2.544 2.624 -1.742 320 HD2 TYR 44 HD2 TYR 44 -3.051 6.832 -1.453 321 HE1 TYR 44 HE1 TYR 44 -2.320 2.790 -4.169 322 HE2 TYR 44 HE2 TYR 44 -2.834 7.027 -3.891 323 HH TYR 44 HH TYR 44 -1.890 5.799 -5.752 324 H SER 45 H SER 45 -5.120 4.727 2.709 325 HA SER 45 HA SER 45 -7.054 6.572 1.493 326 HB2 SER 45 HB2 SER 45 -7.811 4.507 3.575 327 HB3 SER 45 HB1 SER 45 -8.889 5.662 2.786 328 HG SER 45 HG SER 45 -7.668 4.350 0.867 329 HA PRO 46 HA PRO 46 -5.816 9.239 4.846 330 HB2 PRO 46 HB2 PRO 46 -7.917 10.937 4.754 331 HB3 PRO 46 HB1 PRO 46 -6.655 10.928 3.514 332 HG2 PRO 46 HG2 PRO 46 -9.351 9.607 3.470 333 HG3 PRO 46 HG1 PRO 46 -8.587 10.613 2.223 334 HD2 PRO 46 HD2 PRO 46 -8.558 7.947 2.061 335 HD3 PRO 46 HD1 PRO 46 -7.156 8.914 1.555 336 H SER 47 H SER 47 -6.429 9.783 6.971 337 HA SER 47 HA SER 47 -8.222 7.858 8.167 338 HB2 SER 47 HB2 SER 47 -6.389 9.922 9.399 339 HB3 SER 47 HB1 SER 47 -7.344 8.760 10.319 340 HG SER 47 HG SER 47 -4.954 8.393 9.263 341 H VAL 48 H VAL 48 -8.200 11.311 7.512 342 HA VAL 48 HA VAL 48 -10.808 11.503 8.882 343 HB VAL 48 HB VAL 48 -8.787 13.684 8.327 344 HG11 VAL 48 HG11 VAL 48 -10.306 15.175 9.535 345 HG12 VAL 48 HG12 VAL 48 -11.495 13.877 9.638 346 HG13 VAL 48 HG13 VAL 48 -11.048 14.541 8.066 347 HG21 VAL 48 HG21 VAL 48 -9.793 12.579 10.944 348 HG22 VAL 48 HG22 VAL 48 -8.566 13.829 10.728 349 HG23 VAL 48 HG23 VAL 48 -8.245 12.175 10.204 350 H GLU 49 H GLU 49 -8.991 12.520 6.007 351 HA GLU 49 HA GLU 49 -11.112 12.181 4.217 352 HB2 GLU 49 HB2 GLU 49 -12.045 14.153 5.438 353 HB3 GLU 49 HB1 GLU 49 -10.636 15.082 4.947 354 HG2 GLU 49 HG2 GLU 49 -12.607 15.523 3.552 355 HG3 GLU 49 HG1 GLU 49 -11.252 14.876 2.628 356 H GLY 50 H GLY 50 -10.416 12.419 2.093 357 HA2 GLY 50 HA2 GLY 50 -8.455 13.881 0.967 358 HA3 GLY 50 HA1 GLY 50 -7.536 12.643 1.812 359 H SER 51 H SER 51 -6.775 11.984 -0.299 360 HA SER 51 HA SER 51 -8.772 10.809 -2.079 361 HB2 SER 51 HB2 SER 51 -5.790 11.149 -2.475 362 HB3 SER 51 HB1 SER 51 -6.969 10.691 -3.707 363 HG SER 51 HG SER 51 -6.247 13.006 -3.500 364 H SER 52 H SER 52 -9.255 8.692 -1.897 365 HA SER 52 HA SER 52 -7.169 6.861 -0.923 366 HB2 SER 52 HB2 SER 52 -10.099 6.247 -1.401 367 HB3 SER 52 HB1 SER 52 -8.927 5.237 -0.548 368 HG SER 52 HG SER 52 -10.267 6.436 0.883 369 H THR 53 H THR 53 -6.388 5.221 -2.188 370 HA THR 53 HA THR 53 -7.579 4.821 -4.826 371 HB THR 53 HB THR 53 -4.661 5.563 -4.553 372 HG1 THR 53 HG1 THR 53 -6.924 7.105 -4.827 373 HG21 THR 53 HG21 THR 53 -6.412 5.168 -6.981 374 HG22 THR 53 HG22 THR 53 -5.123 4.093 -6.439 375 HG23 THR 53 HG23 THR 53 -4.736 5.720 -7.001 376 H GLU 54 H GLU 54 -6.926 2.882 -5.847 377 HA GLU 54 HA GLU 54 -5.355 1.023 -4.221 378 HB2 GLU 54 HB2 GLU 54 -7.779 0.448 -4.284 379 HB3 GLU 54 HB1 GLU 54 -7.679 0.345 -6.036 380 HG2 GLU 54 HG2 GLU 54 -5.949 -1.437 -5.745 381 HG3 GLU 54 HG1 GLU 54 -6.306 -1.411 -4.020 382 H LEU 55 H LEU 55 -3.439 0.751 -5.226 383 HA LEU 55 HA LEU 55 -3.416 0.814 -8.152 384 HB2 LEU 55 HB2 LEU 55 -1.087 0.985 -6.202 385 HB3 LEU 55 HB1 LEU 55 -0.927 0.891 -7.955 386 HG LEU 55 HG LEU 55 -2.062 3.105 -6.303 387 HD11 LEU 55 HD11 LEU 55 0.248 3.338 -6.643 388 HD12 LEU 55 HD12 LEU 55 -0.527 4.439 -7.781 389 HD13 LEU 55 HD13 LEU 55 0.119 2.899 -8.345 390 HD21 LEU 55 HD21 LEU 55 -2.722 4.205 -8.439 391 HD22 LEU 55 HD22 LEU 55 -3.706 2.807 -8.013 392 HD23 LEU 55 HD23 LEU 55 -2.461 2.662 -9.254 393 H ASN 56 H ASN 56 -2.129 -0.746 -9.309 394 HA ASN 56 HA ASN 56 -2.111 -3.386 -8.009 395 HB2 ASN 56 HB2 ASN 56 -3.977 -3.263 -9.602 396 HB3 ASN 56 HB1 ASN 56 -2.879 -2.726 -10.868 397 HD21 ASN 56 HD21 ASN 56 -4.026 -5.412 -9.019 398 HD22 ASN 56 HD22 ASN 56 -3.232 -6.646 -9.936 399 H LEU 57 H LEU 57 -0.092 -4.102 -7.860 400 HA LEU 57 HA LEU 57 1.849 -3.151 -9.856 401 HB2 LEU 57 HB2 LEU 57 2.230 -3.747 -6.911 402 HB3 LEU 57 HB1 LEU 57 3.562 -3.593 -8.032 403 HG LEU 57 HG LEU 57 1.828 -1.523 -6.836 404 HD11 LEU 57 HD11 LEU 57 4.698 -1.555 -7.725 405 HD12 LEU 57 HD12 LEU 57 4.128 -1.962 -6.111 406 HD13 LEU 57 HD13 LEU 57 3.914 -0.326 -6.731 407 HD21 LEU 57 HD21 LEU 57 3.043 -1.213 -9.568 408 HD22 LEU 57 HD22 LEU 57 2.358 0.081 -8.584 409 HD23 LEU 57 HD23 LEU 57 1.321 -1.214 -9.184 410 HA PRO 58 HA PRO 58 2.651 -7.326 -10.943 411 HB2 PRO 58 HB2 PRO 58 5.429 -7.220 -11.087 412 HB3 PRO 58 HB1 PRO 58 4.320 -6.820 -12.396 413 HG2 PRO 58 HG2 PRO 58 5.827 -5.034 -10.583 414 HG3 PRO 58 HG1 PRO 58 5.298 -4.762 -12.250 415 HD2 PRO 58 HD2 PRO 58 4.102 -3.631 -10.068 416 HD3 PRO 58 HD1 PRO 58 3.257 -3.945 -11.594 417 H GLU 59 H GLU 59 3.219 -9.207 -10.022 418 HA GLU 59 HA GLU 59 3.422 -9.660 -7.356 419 HB2 GLU 59 HB2 GLU 59 4.393 -11.862 -7.924 420 HB3 GLU 59 HB1 GLU 59 3.033 -11.435 -8.955 421 HG2 GLU 59 HG2 GLU 59 4.561 -10.786 -10.730 422 HG3 GLU 59 HG1 GLU 59 5.938 -11.154 -9.696 423 H THR 60 H THR 60 6.011 -8.732 -9.462 424 HA THR 60 HA THR 60 8.019 -9.318 -7.424 425 HB THR 60 HB THR 60 8.516 -10.217 -9.616 426 HG1 THR 60 HG1 THR 60 10.100 -8.070 -8.690 427 HG21 THR 60 HG21 THR 60 7.216 -8.714 -11.001 428 HG22 THR 60 HG22 THR 60 8.890 -8.738 -11.555 429 HG23 THR 60 HG23 THR 60 8.295 -7.376 -10.607 430 H ALA 61 H ALA 61 6.045 -6.952 -7.596 431 HA ALA 61 HA ALA 61 7.900 -4.708 -7.812 432 HB1 ALA 61 HB1 ALA 61 5.667 -4.405 -8.730 433 HB2 ALA 61 HB2 ALA 61 5.924 -3.306 -7.374 434 HB3 ALA 61 HB3 ALA 61 4.956 -4.766 -7.158 435 H ASN 62 H ASN 62 8.299 -3.279 -6.054 436 HA ASN 62 HA ASN 62 7.664 -4.404 -3.423 437 HB2 ASN 62 HB2 ASN 62 9.904 -4.242 -2.651 438 HB3 ASN 62 HB1 ASN 62 9.951 -5.131 -4.167 439 HD21 ASN 62 HD21 ASN 62 12.011 -3.590 -2.750 440 HD22 ASN 62 HD22 ASN 62 12.580 -2.414 -3.886 441 H SER 63 H SER 63 7.018 -1.875 -5.164 442 HA SER 63 HA SER 63 6.890 -0.102 -2.937 443 HB2 SER 63 HB2 SER 63 8.367 1.674 -3.877 444 HB3 SER 63 HB1 SER 63 9.253 0.220 -3.420 445 HG SER 63 HG SER 63 9.616 -0.244 -5.490 446 H VAL 64 H VAL 64 5.282 1.331 -3.236 447 HA VAL 64 HA VAL 64 4.348 1.797 -5.996 448 HB VAL 64 HB VAL 64 2.564 0.664 -4.821 449 HG11 VAL 64 HG11 VAL 64 2.172 2.747 -2.808 450 HG12 VAL 64 HG12 VAL 64 3.555 1.682 -2.563 451 HG13 VAL 64 HG13 VAL 64 1.942 1.000 -2.718 452 HG21 VAL 64 HG21 VAL 64 1.997 3.578 -5.019 453 HG22 VAL 64 HG22 VAL 64 0.805 2.279 -4.940 454 HG23 VAL 64 HG23 VAL 64 1.904 2.382 -6.311 455 H THR 65 H THR 65 4.221 3.858 -6.708 456 HA THR 65 HA THR 65 4.719 6.033 -4.841 457 HB THR 65 HB THR 65 4.551 5.842 -7.838 458 HG1 THR 65 HG1 THR 65 6.467 5.012 -7.118 459 HG21 THR 65 HG21 THR 65 3.775 8.058 -7.145 460 HG22 THR 65 HG22 THR 65 5.370 8.179 -7.889 461 HG23 THR 65 HG23 THR 65 5.207 8.259 -6.135 462 H LEU 66 H LEU 66 2.842 6.392 -3.781 463 HA LEU 66 HA LEU 66 0.255 6.416 -5.015 464 HB2 LEU 66 HB2 LEU 66 0.652 7.873 -2.501 465 HB3 LEU 66 HB1 LEU 66 -0.570 6.697 -2.932 466 HG LEU 66 HG LEU 66 2.252 5.922 -2.255 467 HD11 LEU 66 HD11 LEU 66 0.917 7.157 -0.460 468 HD12 LEU 66 HD12 LEU 66 1.693 5.629 -0.076 469 HD13 LEU 66 HD13 LEU 66 -0.043 5.679 -0.389 470 HD21 LEU 66 HD21 LEU 66 -0.349 4.441 -2.501 471 HD22 LEU 66 HD22 LEU 66 1.131 3.742 -1.836 472 HD23 LEU 66 HD23 LEU 66 1.077 4.258 -3.523 473 H SER 67 H SER 67 -1.017 8.256 -5.444 474 HA SER 67 HA SER 67 0.404 10.793 -5.580 475 HB2 SER 67 HB2 SER 67 -0.428 10.900 -8.056 476 HB3 SER 67 HB1 SER 67 1.052 10.017 -7.681 477 HG SER 67 HG SER 67 0.106 8.367 -8.549 478 H ASP 68 H ASP 68 -1.021 12.547 -6.368 479 HA ASP 68 HA ASP 68 -2.872 13.827 -6.186 480 HB2 ASP 68 HB2 ASP 68 -3.830 12.049 -7.715 481 HB3 ASP 68 HB1 ASP 68 -4.518 11.294 -6.282 482 H LEU 69 H LEU 69 -1.553 12.585 -3.840 483 HA LEU 69 HA LEU 69 -3.537 12.206 -1.829 484 HB2 LEU 69 HB2 LEU 69 -0.775 13.213 -1.211 485 HB3 LEU 69 HB1 LEU 69 -1.832 12.208 -0.241 486 HG LEU 69 HG LEU 69 -0.409 11.287 -2.719 487 HD11 LEU 69 HD11 LEU 69 0.960 10.030 -1.146 488 HD12 LEU 69 HD12 LEU 69 0.121 10.803 0.201 489 HD13 LEU 69 HD13 LEU 69 1.111 11.768 -0.894 490 HD21 LEU 69 HD21 LEU 69 -2.332 9.956 -2.499 491 HD22 LEU 69 HD22 LEU 69 -2.295 10.070 -0.739 492 HD23 LEU 69 HD23 LEU 69 -1.119 9.049 -1.580 493 H GLN 70 H GLN 70 -3.087 13.819 0.236 494 HA GLN 70 HA GLN 70 -3.304 16.569 -0.767 495 HB2 GLN 70 HB2 GLN 70 -4.929 15.448 1.519 496 HB3 GLN 70 HB1 GLN 70 -5.050 17.046 0.796 497 HG2 GLN 70 HG2 GLN 70 -5.581 14.572 -0.791 498 HG3 GLN 70 HG1 GLN 70 -6.823 15.324 0.207 499 HE21 GLN 70 HE21 GLN 70 -8.065 15.777 -1.624 500 HE22 GLN 70 HE22 GLN 70 -7.655 17.054 -2.713 501 HA PRO 71 HA PRO 71 -0.016 17.182 2.154 502 HB2 PRO 71 HB2 PRO 71 -0.224 19.894 2.376 503 HB3 PRO 71 HB1 PRO 71 0.584 19.057 1.047 504 HG2 PRO 71 HG2 PRO 71 -2.161 20.237 1.161 505 HG3 PRO 71 HG1 PRO 71 -0.984 20.266 -0.164 506 HD2 PRO 71 HD2 PRO 71 -3.094 18.584 -0.138 507 HD3 PRO 71 HD1 PRO 71 -1.537 18.142 -0.868 508 H GLY 72 H GLY 72 -0.050 16.863 4.287 509 HA2 GLY 72 HA2 GLY 72 -0.466 17.484 6.514 510 HA3 GLY 72 HA1 GLY 72 -1.782 18.508 5.964 511 H VAL 73 H VAL 73 -1.726 15.358 4.646 512 HA VAL 73 HA VAL 73 -3.972 14.651 6.411 513 HB VAL 73 HB VAL 73 -3.619 14.080 3.463 514 HG11 VAL 73 HG11 VAL 73 -4.621 12.120 4.156 515 HG12 VAL 73 HG12 VAL 73 -6.002 13.171 3.788 516 HG13 VAL 73 HG13 VAL 73 -5.499 12.921 5.460 517 HG21 VAL 73 HG21 VAL 73 -5.950 15.131 3.507 518 HG22 VAL 73 HG22 VAL 73 -4.531 16.184 3.598 519 HG23 VAL 73 HG23 VAL 73 -5.447 15.803 5.060 520 H GLN 74 H GLN 74 -4.135 12.650 7.229 521 HA GLN 74 HA GLN 74 -1.760 11.047 7.371 522 HB2 GLN 74 HB2 GLN 74 -3.634 11.656 9.127 523 HB3 GLN 74 HB1 GLN 74 -4.425 10.244 8.453 524 HG2 GLN 74 HG2 GLN 74 -1.723 10.308 9.767 525 HG3 GLN 74 HG1 GLN 74 -3.209 9.647 10.446 526 HE21 GLN 74 HE21 GLN 74 -0.554 9.143 8.331 527 HE22 GLN 74 HE22 GLN 74 -0.935 7.513 7.897 528 H TYR 75 H TYR 75 -1.331 9.387 6.036 529 HA TYR 75 HA TYR 75 -3.577 8.262 4.510 530 HB2 TYR 75 HB2 TYR 75 -0.847 9.107 3.640 531 HB3 TYR 75 HB1 TYR 75 -1.630 7.753 2.807 532 HD1 TYR 75 HD2 TYR 75 -3.945 8.103 1.859 533 HD2 TYR 75 HD1 TYR 75 -1.483 11.326 3.121 534 HE1 TYR 75 HE2 TYR 75 -5.323 9.655 0.553 535 HE2 TYR 75 HE1 TYR 75 -2.858 12.892 1.819 536 HH TYR 75 HH TYR 75 -4.416 12.755 -0.209 537 H ASN 76 H ASN 76 -4.039 6.338 5.158 538 HA ASN 76 HA ASN 76 -2.049 4.511 6.208 539 HB2 ASN 76 HB2 ASN 76 -4.991 4.031 5.667 540 HB3 ASN 76 HB1 ASN 76 -3.926 3.023 6.639 541 HD21 ASN 76 HD21 ASN 76 -5.731 5.980 6.483 542 HD22 ASN 76 HD22 ASN 76 -5.631 6.371 8.168 543 H ILE 77 H ILE 77 -0.776 3.589 4.702 544 HA ILE 77 HA ILE 77 -1.921 2.742 2.152 545 HB ILE 77 HB ILE 77 0.940 2.564 3.112 546 HG12 ILE 77 HG12 ILE 77 1.129 4.228 1.107 547 HG13 ILE 77 HG11 ILE 77 -0.526 4.607 1.504 548 HG21 ILE 77 HG21 ILE 77 1.235 2.355 0.523 549 HG22 ILE 77 HG22 ILE 77 -0.396 1.680 0.611 550 HG23 ILE 77 HG23 ILE 77 0.925 0.924 1.514 551 HD11 ILE 77 HD11 ILE 77 1.827 4.820 3.363 552 HD12 ILE 77 HD12 ILE 77 0.154 5.189 3.779 553 HD13 ILE 77 HD13 ILE 77 0.995 6.156 2.567 554 H THR 78 H THR 78 -2.841 0.880 2.051 555 HA THR 78 HA THR 78 -1.929 -1.283 3.787 556 HB THR 78 HB THR 78 -4.526 -0.940 2.292 557 HG1 THR 78 HG1 THR 78 -4.697 -0.941 5.009 558 HG21 THR 78 HG21 THR 78 -3.961 -3.295 2.680 559 HG22 THR 78 HG22 THR 78 -5.312 -2.806 3.702 560 HG23 THR 78 HG23 THR 78 -3.696 -2.956 4.391 561 H ILE 79 H ILE 79 -0.655 -2.751 2.812 562 HA ILE 79 HA ILE 79 -0.769 -2.969 -0.137 563 HB ILE 79 HB ILE 79 1.288 -4.334 1.618 564 HG12 ILE 79 HG12 ILE 79 1.787 -2.037 1.973 565 HG13 ILE 79 HG11 ILE 79 2.888 -2.625 0.730 566 HG21 ILE 79 HG21 ILE 79 1.257 -5.368 -0.452 567 HG22 ILE 79 HG22 ILE 79 2.592 -4.207 -0.536 568 HG23 ILE 79 HG23 ILE 79 1.048 -3.838 -1.309 569 HD11 ILE 79 HD11 ILE 79 1.921 -1.400 -0.918 570 HD12 ILE 79 HD12 ILE 79 1.774 -0.325 0.490 571 HD13 ILE 79 HD13 ILE 79 0.381 -1.256 -0.062 572 H TYR 80 H TYR 80 -1.237 -4.876 -1.181 573 HA TYR 80 HA TYR 80 -2.021 -7.170 0.503 574 HB2 TYR 80 HB2 TYR 80 -3.383 -6.306 -2.057 575 HB3 TYR 80 HB1 TYR 80 -3.877 -7.608 -0.989 576 HD1 TYR 80 HD1 TYR 80 -3.834 -3.945 -1.471 577 HD2 TYR 80 HD2 TYR 80 -5.096 -7.158 1.041 578 HE1 TYR 80 HE1 TYR 80 -5.387 -2.440 -0.314 579 HE2 TYR 80 HE2 TYR 80 -6.642 -5.644 2.201 580 HH TYR 80 HH TYR 80 -6.867 -3.175 2.606 581 H ALA 81 H ALA 81 -0.487 -8.691 0.068 582 HA ALA 81 HA ALA 81 0.656 -9.018 -2.573 583 HB1 ALA 81 HB1 ALA 81 2.115 -9.609 -0.789 584 HB2 ALA 81 HB2 ALA 81 1.628 -11.147 -1.526 585 HB3 ALA 81 HB3 ALA 81 0.889 -10.606 -0.002 586 H VAL 82 H VAL 82 -0.623 -9.812 -4.140 587 HA VAL 82 HA VAL 82 -2.767 -11.664 -3.322 588 HB VAL 82 HB VAL 82 -3.546 -9.709 -4.577 589 HG11 VAL 82 HG11 VAL 82 -1.619 -9.232 -5.933 590 HG12 VAL 82 HG12 VAL 82 -3.050 -9.441 -6.945 591 HG13 VAL 82 HG13 VAL 82 -1.856 -10.734 -6.828 592 HG21 VAL 82 HG21 VAL 82 -4.896 -10.857 -6.224 593 HG22 VAL 82 HG22 VAL 82 -4.743 -11.850 -4.773 594 HG23 VAL 82 HG23 VAL 82 -3.783 -12.227 -6.206 595 H GLU 83 H GLU 83 -2.865 -13.721 -3.989 596 HA GLU 83 HA GLU 83 -0.816 -14.658 -5.880 597 HB2 GLU 83 HB2 GLU 83 -2.329 -16.610 -4.233 598 HB3 GLU 83 HB1 GLU 83 -0.672 -16.646 -4.803 599 HG2 GLU 83 HG2 GLU 83 -0.006 -15.114 -3.111 600 HG3 GLU 83 HG1 GLU 83 -1.662 -14.999 -2.513 601 H GLU 84 H GLU 84 -1.614 -16.706 -7.027 602 HA GLU 84 HA GLU 84 -3.495 -16.116 -8.894 603 HB2 GLU 84 HB2 GLU 84 -2.960 -18.889 -7.829 604 HB3 GLU 84 HB1 GLU 84 -3.588 -18.485 -9.418 605 HG2 GLU 84 HG2 GLU 84 -1.477 -17.397 -9.981 606 HG3 GLU 84 HG1 GLU 84 -0.853 -17.789 -8.379 607 H ASN 85 H ASN 85 -4.113 -17.826 -5.828 608 HA ASN 85 HA ASN 85 -6.929 -18.012 -6.619 609 HB2 ASN 85 HB2 ASN 85 -7.091 -19.844 -4.940 610 HB3 ASN 85 HB1 ASN 85 -5.971 -20.174 -6.255 611 HD21 ASN 85 HD21 ASN 85 -3.795 -20.336 -5.833 612 HD22 ASN 85 HD22 ASN 85 -3.152 -20.412 -4.227 613 H GLN 86 H GLN 86 -4.931 -16.453 -4.241 614 HA GLN 86 HA GLN 86 -7.334 -15.522 -2.906 615 HB2 GLN 86 HB2 GLN 86 -6.748 -16.274 -0.752 616 HB3 GLN 86 HB1 GLN 86 -6.567 -17.656 -1.827 617 HG2 GLN 86 HG2 GLN 86 -4.134 -17.201 -1.912 618 HG3 GLN 86 HG1 GLN 86 -4.375 -15.951 -0.692 619 HE21 GLN 86 HE21 GLN 86 -4.338 -19.338 -1.350 620 HE22 GLN 86 HE22 GLN 86 -4.372 -19.871 0.288 621 H GLU 87 H GLU 87 -6.629 -14.028 -0.996 622 HA GLU 87 HA GLU 87 -4.329 -12.417 -1.901 623 HB2 GLU 87 HB2 GLU 87 -6.859 -11.458 -0.538 624 HB3 GLU 87 HB1 GLU 87 -5.504 -10.442 -1.011 625 HG2 GLU 87 HG2 GLU 87 -5.904 -11.025 -3.358 626 HG3 GLU 87 HG1 GLU 87 -7.278 -12.008 -2.870 627 H SER 88 H SER 88 -2.808 -11.912 -0.406 628 HA SER 88 HA SER 88 -2.776 -13.452 1.998 629 HB2 SER 88 HB2 SER 88 -0.844 -11.270 1.194 630 HB3 SER 88 HB1 SER 88 -0.547 -12.609 2.302 631 HG SER 88 HG SER 88 -0.762 -12.620 -0.502 632 H THR 89 H THR 89 -1.812 -12.199 4.015 633 HA THR 89 HA THR 89 -3.825 -10.566 5.078 634 HB THR 89 HB THR 89 -1.794 -10.025 6.730 635 HG1 THR 89 HG1 THR 89 -0.342 -11.847 6.666 636 HG21 THR 89 HG21 THR 89 -3.124 -12.728 6.496 637 HG22 THR 89 HG22 THR 89 -3.790 -11.314 7.311 638 HG23 THR 89 HG23 THR 89 -2.339 -12.091 7.941 639 HA PRO 90 HA PRO 90 -2.567 -6.603 3.636 640 HB2 PRO 90 HB2 PRO 90 -3.775 -4.985 5.388 641 HB3 PRO 90 HB1 PRO 90 -4.694 -6.044 4.314 642 HG2 PRO 90 HG2 PRO 90 -4.128 -6.323 7.218 643 HG3 PRO 90 HG1 PRO 90 -5.552 -6.831 6.294 644 HD2 PRO 90 HD2 PRO 90 -3.393 -8.444 7.108 645 HD3 PRO 90 HD1 PRO 90 -4.683 -8.886 5.977 646 H VAL 91 H VAL 91 -0.868 -5.325 3.686 647 HA VAL 91 HA VAL 91 0.751 -4.756 6.028 648 HB VAL 91 HB VAL 91 0.667 -3.727 3.203 649 HG11 VAL 91 HG11 VAL 91 2.479 -2.206 3.728 650 HG12 VAL 91 HG12 VAL 91 2.436 -2.706 5.414 651 HG13 VAL 91 HG13 VAL 91 1.071 -1.838 4.716 652 HG21 VAL 91 HG21 VAL 91 1.818 -5.870 3.614 653 HG22 VAL 91 HG22 VAL 91 2.892 -5.042 4.748 654 HG23 VAL 91 HG23 VAL 91 2.899 -4.598 3.039 655 H VAL 92 H VAL 92 0.175 -3.120 7.456 656 HA VAL 92 HA VAL 92 -1.321 -0.882 6.271 657 HB VAL 92 HB VAL 92 -1.492 -1.558 9.197 658 HG11 VAL 92 HG11 VAL 92 -3.187 0.085 7.322 659 HG12 VAL 92 HG12 VAL 92 -2.097 0.696 8.570 660 HG13 VAL 92 HG13 VAL 92 -3.546 -0.200 9.027 661 HG21 VAL 92 HG21 VAL 92 -3.671 -2.617 8.733 662 HG22 VAL 92 HG22 VAL 92 -2.330 -3.510 8.017 663 HG23 VAL 92 HG23 VAL 92 -3.349 -2.488 7.004 664 H ILE 93 H ILE 93 0.150 0.625 5.927 665 HA ILE 93 HA ILE 93 1.836 1.441 8.202 666 HB ILE 93 HB ILE 93 3.469 2.307 6.417 667 HG12 ILE 93 HG12 ILE 93 2.286 0.164 4.690 668 HG13 ILE 93 HG11 ILE 93 1.735 1.817 4.573 669 HG21 ILE 93 HG21 ILE 93 3.999 0.456 7.881 670 HG22 ILE 93 HG22 ILE 93 4.597 0.131 6.254 671 HG23 ILE 93 HG23 ILE 93 3.128 -0.658 6.828 672 HD11 ILE 93 HD11 ILE 93 3.403 1.423 2.914 673 HD12 ILE 93 HD12 ILE 93 4.525 0.832 4.147 674 HD13 ILE 93 HD13 ILE 93 4.044 2.530 4.142 675 H GLN 94 H GLN 94 1.089 3.330 8.916 676 HA GLN 94 HA GLN 94 -0.250 5.069 6.981 677 HB2 GLN 94 HB2 GLN 94 -1.324 6.119 8.962 678 HB3 GLN 94 HB1 GLN 94 -1.705 4.420 8.751 679 HG2 GLN 94 HG2 GLN 94 0.017 3.887 10.469 680 HG3 GLN 94 HG1 GLN 94 0.189 5.619 10.754 681 HE21 GLN 94 HE21 GLN 94 -1.499 6.750 11.725 682 HE22 GLN 94 HE22 GLN 94 -2.776 5.945 12.567 683 H GLN 95 H GLN 95 0.684 6.788 6.301 684 HA GLN 95 HA GLN 95 2.704 8.152 7.948 685 HB2 GLN 95 HB2 GLN 95 3.025 6.833 5.429 686 HB3 GLN 95 HB1 GLN 95 3.250 8.555 5.183 687 HG2 GLN 95 HG2 GLN 95 4.741 6.803 7.122 688 HG3 GLN 95 HG1 GLN 95 5.361 7.478 5.618 689 HE21 GLN 95 HE21 GLN 95 3.963 10.054 6.113 690 HE22 GLN 95 HE22 GLN 95 4.915 10.851 7.319 691 H GLU 96 H GLU 96 2.460 10.346 8.069 692 HA GLU 96 HA GLU 96 0.199 11.533 6.685 693 HB2 GLU 96 HB2 GLU 96 2.118 12.694 8.717 694 HB3 GLU 96 HB1 GLU 96 0.800 13.591 7.978 695 HG2 GLU 96 HG2 GLU 96 -0.038 12.960 10.036 696 HG3 GLU 96 HG1 GLU 96 -0.728 11.785 8.924 697 H THR 97 H THR 97 0.333 13.226 5.239 698 HA THR 97 HA THR 97 2.741 13.308 3.664 699 HB THR 97 HB THR 97 1.375 14.952 2.291 700 HG1 THR 97 HG1 THR 97 -0.953 14.774 2.852 701 HG21 THR 97 HG21 THR 97 1.503 12.628 1.649 702 HG22 THR 97 HG22 THR 97 -0.160 13.182 1.449 703 HG23 THR 97 HG23 THR 97 0.283 12.194 2.841 704 H THR 98 H THR 98 4.366 14.634 4.035 705 HA THR 98 HA THR 98 4.256 16.787 5.884 706 HB THR 98 HB THR 98 6.349 16.096 3.813 707 HG1 THR 98 HG1 THR 98 5.675 15.067 6.293 708 HG21 THR 98 HG21 THR 98 6.608 18.394 4.602 709 HG22 THR 98 HG22 THR 98 7.896 17.373 5.242 710 HG23 THR 98 HG23 THR 98 6.546 17.841 6.274 711 H GLY 99 H GLY 99 3.997 16.505 2.418 712 HA2 GLY 99 HA2 GLY 99 2.967 18.007 0.973 713 HA3 GLY 99 HA1 GLY 99 2.912 19.184 2.265 714 H THR 100 H THR 100 3.795 20.916 1.283 715 HA THR 100 HA THR 100 6.363 20.662 -0.055 716 HB THR 100 HB THR 100 4.779 23.176 0.492 717 HG1 THR 100 HG1 THR 100 4.479 21.169 -1.420 718 HG21 THR 100 HG21 THR 100 7.101 23.545 -0.070 719 HG22 THR 100 HG22 THR 100 6.036 24.081 -1.364 720 HG23 THR 100 HG23 THR 100 6.917 22.563 -1.521 721 HA PRO 101 HA PRO 101 8.526 21.137 3.845 722 HB2 PRO 101 HB2 PRO 101 10.669 22.003 1.964 723 HB3 PRO 101 HB1 PRO 101 10.732 20.818 3.274 724 HG2 PRO 101 HG2 PRO 101 10.622 20.024 0.740 725 HG3 PRO 101 HG1 PRO 101 9.720 19.162 2.000 726 HD2 PRO 101 HD2 PRO 101 8.731 21.064 -0.076 727 HD3 PRO 101 HD1 PRO 101 7.955 19.615 0.595 728 H ARG 102 H ARG 102 7.737 22.876 4.876 729 HA ARG 102 HA ARG 102 9.055 25.421 4.414 730 HB2 ARG 102 HB2 ARG 102 7.031 25.623 3.064 731 HB3 ARG 102 HB1 ARG 102 6.044 25.115 4.425 732 HG2 ARG 102 HG2 ARG 102 5.904 27.512 4.088 733 HG3 ARG 102 HG1 ARG 102 6.656 27.138 5.638 734 HD2 ARG 102 HD2 ARG 102 8.871 27.499 4.610 735 HD3 ARG 102 HD1 ARG 102 8.074 27.954 3.105 736 HE ARG 102 HE ARG 102 6.969 29.614 4.953 737 HH11 ARG 102 HH11 ARG 102 10.250 28.907 3.954 738 HH12 ARG 102 HH12 ARG 102 10.852 30.471 4.400 739 HH21 ARG 102 HH21 ARG 102 7.766 31.670 5.544 740 HH22 ARG 102 HH22 ARG 102 9.447 32.034 5.307 741 H SER 103 H SER 103 10.097 25.007 6.362 742 HA SER 103 HA SER 103 8.523 24.510 8.746 743 HB2 SER 103 HB2 SER 103 11.510 24.841 8.374 744 HB3 SER 103 HB1 SER 103 10.719 24.355 9.871 745 HG SER 103 HG SER 103 9.968 22.850 7.712 746 H ASP 104 H ASP 104 7.519 26.748 8.104 747 HA ASP 104 HA ASP 104 9.042 28.966 9.248 748 HB2 ASP 104 HB2 ASP 104 7.283 30.403 8.435 749 HB3 ASP 104 HB1 ASP 104 7.704 29.280 7.147 750 H GLY 105 H GLY 105 7.556 26.517 10.539 751 HA2 GLY 105 HA2 GLY 105 5.633 27.700 12.281 752 HA3 GLY 105 HA1 GLY 105 6.314 26.087 12.424 753 H THR 106 H THR 106 6.414 29.320 13.529 754 HA THR 106 HA THR 106 8.128 28.507 15.718 755 HB THR 106 HB THR 106 8.834 30.984 14.120 756 HG1 THR 106 HG1 THR 106 9.533 28.352 13.770 757 HG21 THR 106 HG21 THR 106 9.405 31.099 16.500 758 HG22 THR 106 HG22 THR 106 10.858 30.979 15.509 759 HG23 THR 106 HG23 THR 106 10.262 29.564 16.374 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 2.329 -26.364 -9.841 2 H2 GLY 1 HT2 GLY 1 1.740 -25.217 -10.933 3 H3 GLY 1 HT3 GLY 1 3.332 -25.766 -11.065 4 HA2 GLY 1 HA1 GLY 1 1.944 -26.777 -12.750 5 HA3 GLY 1 HA2 GLY 1 2.566 -27.974 -11.624 6 H SER 2 H SER 2 0.818 -29.340 -12.272 7 HA SER 2 HA SER 2 -1.888 -28.492 -11.722 8 HB2 SER 2 HB2 SER 2 -2.409 -30.871 -12.455 9 HB3 SER 2 HB1 SER 2 -1.622 -29.853 -13.660 10 HG SER 2 HG SER 2 0.198 -30.984 -13.471 11 H HIS 3 H HIS 3 0.634 -30.252 -10.160 12 HA HIS 3 HA HIS 3 -1.134 -31.449 -8.198 13 HB2 HIS 3 HB2 HIS 3 1.846 -31.489 -8.613 14 HB3 HIS 3 HB1 HIS 3 1.122 -32.103 -7.132 15 HD1 HIS 3 HD1 HIS 3 0.240 -34.431 -7.179 16 HD2 HIS 3 HD2 HIS 3 0.996 -32.946 -10.986 17 HE1 HIS 3 HE1 HIS 3 -0.062 -36.382 -8.736 18 HE2 HIS 3 HE2 HIS 3 0.295 -35.435 -11.044 19 H MET 4 H MET 4 -2.082 -29.843 -7.053 20 HA MET 4 HA MET 4 -0.457 -28.537 -5.064 21 HB2 MET 4 HB2 MET 4 -1.250 -26.257 -5.583 22 HB3 MET 4 HB1 MET 4 -0.237 -26.917 -6.857 23 HG2 MET 4 HG2 MET 4 -2.237 -27.446 -8.163 24 HG3 MET 4 HG1 MET 4 -3.242 -26.755 -6.890 25 HE1 MET 4 HE1 MET 4 -3.226 -24.181 -6.226 26 HE2 MET 4 HE2 MET 4 -2.197 -22.977 -6.999 27 HE3 MET 4 HE3 MET 4 -1.480 -24.232 -5.990 28 H GLY 5 H GLY 5 -2.358 -30.496 -4.822 29 HA2 GLY 5 HA2 GLY 5 -4.977 -29.595 -4.306 30 HA3 GLY 5 HA1 GLY 5 -4.250 -31.052 -3.644 31 H THR 6 H THR 6 -2.088 -29.609 -2.350 32 HA THR 6 HA THR 6 -3.294 -29.046 0.136 33 HB THR 6 HB THR 6 -0.955 -28.094 0.653 34 HG1 THR 6 HG1 THR 6 -0.422 -27.743 -1.600 35 HG21 THR 6 HG21 THR 6 -1.253 -30.940 -0.307 36 HG22 THR 6 HG22 THR 6 -1.656 -30.338 1.300 37 HG23 THR 6 HG23 THR 6 0.021 -30.345 0.756 38 H THR 7 H THR 7 -4.169 -27.236 0.896 39 HA THR 7 HA THR 7 -4.363 -24.878 -0.679 40 HB THR 7 HB THR 7 -5.049 -25.256 2.244 41 HG1 THR 7 HG1 THR 7 -7.093 -25.834 1.489 42 HG21 THR 7 HG21 THR 7 -6.043 -23.247 0.218 43 HG22 THR 7 HG22 THR 7 -4.952 -22.903 1.560 44 HG23 THR 7 HG23 THR 7 -6.614 -23.404 1.878 45 H THR 8 H THR 8 -2.744 -23.505 -0.956 46 HA THR 8 HA THR 8 -0.494 -23.398 0.796 47 HB THR 8 HB THR 8 -1.226 -21.552 -1.488 48 HG1 THR 8 HG1 THR 8 -0.610 -24.111 -1.548 49 HG21 THR 8 HG21 THR 8 1.433 -22.079 -0.150 50 HG22 THR 8 HG22 THR 8 0.481 -20.601 -0.012 51 HG23 THR 8 HG23 THR 8 1.178 -21.059 -1.565 52 H ALA 9 H ALA 9 -0.200 -22.160 2.522 53 HA ALA 9 HA ALA 9 -1.951 -19.835 2.928 54 HB1 ALA 9 HB1 ALA 9 -1.304 -19.956 5.279 55 HB2 ALA 9 HB2 ALA 9 -0.230 -21.309 4.923 56 HB3 ALA 9 HB3 ALA 9 -1.974 -21.492 4.730 57 HA PRO 10 HA PRO 10 1.910 -17.800 1.738 58 HB2 PRO 10 HB2 PRO 10 0.792 -15.582 0.728 59 HB3 PRO 10 HB1 PRO 10 0.787 -17.116 -0.153 60 HG2 PRO 10 HG2 PRO 10 -1.401 -15.809 1.408 61 HG3 PRO 10 HG1 PRO 10 -1.494 -16.711 -0.114 62 HD2 PRO 10 HD2 PRO 10 -2.105 -17.749 2.362 63 HD3 PRO 10 HD1 PRO 10 -1.682 -18.698 0.971 64 H ASP 11 H ASP 11 2.743 -15.527 2.140 65 HA ASP 11 HA ASP 11 1.771 -14.520 4.727 66 HB2 ASP 11 HB2 ASP 11 4.088 -14.153 5.420 67 HB3 ASP 11 HB1 ASP 11 3.823 -15.851 5.050 68 H ALA 12 H ALA 12 2.219 -12.275 5.116 69 HA ALA 12 HA ALA 12 2.207 -10.706 2.636 70 HB1 ALA 12 HB1 ALA 12 1.408 -8.880 4.080 71 HB2 ALA 12 HB2 ALA 12 1.563 -9.933 5.485 72 HB3 ALA 12 HB3 ALA 12 0.398 -10.318 4.219 73 HA PRO 13 HA PRO 13 6.249 -8.927 3.438 74 HB2 PRO 13 HB2 PRO 13 5.207 -6.285 2.681 75 HB3 PRO 13 HB1 PRO 13 6.428 -7.275 1.877 76 HG2 PRO 13 HG2 PRO 13 4.007 -6.895 0.796 77 HG3 PRO 13 HG1 PRO 13 4.855 -8.449 0.649 78 HD2 PRO 13 HD2 PRO 13 2.677 -7.651 2.543 79 HD3 PRO 13 HD1 PRO 13 2.830 -9.141 1.582 80 HA PRO 14 HA PRO 14 5.886 -7.162 7.585 81 HB2 PRO 14 HB2 PRO 14 8.696 -6.443 6.923 82 HB3 PRO 14 HB1 PRO 14 8.053 -7.256 8.352 83 HG2 PRO 14 HG2 PRO 14 9.376 -8.606 6.460 84 HG3 PRO 14 HG1 PRO 14 8.005 -9.321 7.326 85 HD2 PRO 14 HD2 PRO 14 8.148 -8.267 4.546 86 HD3 PRO 14 HD1 PRO 14 7.173 -9.590 5.208 87 H ASP 15 H ASP 15 6.154 -5.033 8.495 88 HA ASP 15 HA ASP 15 4.857 -3.071 7.195 89 HB2 ASP 15 HB2 ASP 15 7.037 -2.754 9.254 90 HB3 ASP 15 HB1 ASP 15 6.026 -1.421 8.711 91 HA PRO 16 HA PRO 16 7.810 -2.000 3.943 92 HB2 PRO 16 HB2 PRO 16 5.461 -0.411 3.075 93 HB3 PRO 16 HB1 PRO 16 6.427 -1.584 2.150 94 HG2 PRO 16 HG2 PRO 16 3.994 -2.228 2.965 95 HG3 PRO 16 HG1 PRO 16 5.311 -3.408 3.089 96 HD2 PRO 16 HD2 PRO 16 4.161 -1.649 5.239 97 HD3 PRO 16 HD1 PRO 16 4.494 -3.400 5.299 98 H THR 17 H THR 17 9.003 -0.227 3.579 99 HA THR 17 HA THR 17 8.621 1.977 5.483 100 HB THR 17 HB THR 17 11.063 1.267 3.836 101 HG1 THR 17 HG1 THR 17 10.532 0.764 6.601 102 HG21 THR 17 HG21 THR 17 11.021 3.609 4.506 103 HG22 THR 17 HG22 THR 17 12.244 2.734 5.427 104 HG23 THR 17 HG23 THR 17 10.701 3.143 6.175 105 H VAL 18 H VAL 18 7.868 3.762 4.862 106 HA VAL 18 HA VAL 18 7.702 4.535 2.084 107 HB VAL 18 HB VAL 18 7.069 6.103 4.590 108 HG11 VAL 18 HG11 VAL 18 5.921 7.679 3.086 109 HG12 VAL 18 HG12 VAL 18 6.546 6.792 1.688 110 HG13 VAL 18 HG13 VAL 18 7.656 7.617 2.788 111 HG21 VAL 18 HG21 VAL 18 4.748 5.699 4.031 112 HG22 VAL 18 HG22 VAL 18 5.600 4.164 4.201 113 HG23 VAL 18 HG23 VAL 18 5.227 4.793 2.599 114 H ASP 19 H ASP 19 9.280 5.451 0.986 115 HA ASP 19 HA ASP 19 11.675 6.253 2.439 116 HB2 ASP 19 HB2 ASP 19 11.957 4.706 0.584 117 HB3 ASP 19 HB1 ASP 19 11.188 5.845 -0.515 118 H GLN 20 H GLN 20 9.240 7.645 0.331 119 HA GLN 20 HA GLN 20 10.371 10.296 0.874 120 HB2 GLN 20 HB2 GLN 20 9.585 9.191 -1.821 121 HB3 GLN 20 HB1 GLN 20 9.726 10.915 -1.513 122 HG2 GLN 20 HG2 GLN 20 11.959 8.936 -1.115 123 HG3 GLN 20 HG1 GLN 20 11.724 9.897 -2.575 124 HE21 GLN 20 HE21 GLN 20 12.132 12.103 -2.510 125 HE22 GLN 20 HE22 GLN 20 12.990 12.847 -1.234 126 H VAL 21 H VAL 21 8.941 11.737 1.495 127 HA VAL 21 HA VAL 21 6.084 11.172 1.071 128 HB VAL 21 HB VAL 21 7.342 12.267 3.592 129 HG11 VAL 21 HG11 VAL 21 5.130 12.283 4.543 130 HG12 VAL 21 HG12 VAL 21 4.450 11.627 3.055 131 HG13 VAL 21 HG13 VAL 21 5.137 13.249 3.067 132 HG21 VAL 21 HG21 VAL 21 6.541 10.218 4.657 133 HG22 VAL 21 HG22 VAL 21 7.698 9.874 3.371 134 HG23 VAL 21 HG23 VAL 21 5.974 9.631 3.094 135 H ASP 22 H ASP 22 5.160 12.744 -0.056 136 HA ASP 22 HA ASP 22 6.028 15.523 0.412 137 HB2 ASP 22 HB2 ASP 22 5.236 14.204 -2.192 138 HB3 ASP 22 HB1 ASP 22 5.278 15.950 -1.985 139 H ASP 23 H ASP 23 4.066 16.833 -0.967 140 HA ASP 23 HA ASP 23 1.802 16.639 0.720 141 HB2 ASP 23 HB2 ASP 23 0.785 18.238 -0.980 142 HB3 ASP 23 HB1 ASP 23 2.271 18.763 -0.222 143 H THR 24 H THR 24 2.154 15.983 -2.741 144 HA THR 24 HA THR 24 -0.315 14.369 -2.631 145 HB THR 24 HB THR 24 -0.577 15.049 -5.040 146 HG1 THR 24 HG1 THR 24 1.320 17.093 -4.433 147 HG21 THR 24 HG21 THR 24 -1.807 16.167 -3.232 148 HG22 THR 24 HG22 THR 24 -1.382 17.307 -4.510 149 HG23 THR 24 HG23 THR 24 -0.459 17.283 -3.003 150 H SER 25 H SER 25 2.197 13.256 -2.090 151 HA SER 25 HA SER 25 2.426 11.136 -3.937 152 HB2 SER 25 HB2 SER 25 4.681 13.165 -3.981 153 HB3 SER 25 HB1 SER 25 4.773 11.547 -4.677 154 HG SER 25 HG SER 25 2.589 12.940 -5.547 155 H ILE 26 H ILE 26 3.166 9.429 -2.825 156 HA ILE 26 HA ILE 26 5.221 9.763 -0.772 157 HB ILE 26 HB ILE 26 2.451 8.720 -0.169 158 HG12 ILE 26 HG12 ILE 26 4.277 10.622 1.308 159 HG13 ILE 26 HG11 ILE 26 2.899 11.086 0.319 160 HG21 ILE 26 HG21 ILE 26 3.316 7.838 1.957 161 HG22 ILE 26 HG22 ILE 26 4.958 8.163 1.400 162 HG23 ILE 26 HG23 ILE 26 3.958 6.977 0.555 163 HD11 ILE 26 HD11 ILE 26 2.263 11.193 2.616 164 HD12 ILE 26 HD12 ILE 26 2.848 9.552 2.905 165 HD13 ILE 26 HD13 ILE 26 1.439 9.818 1.879 166 H VAL 27 H VAL 27 6.546 7.891 -0.629 167 HA VAL 27 HA VAL 27 5.737 5.783 -2.535 168 HB VAL 27 HB VAL 27 8.561 6.629 -1.917 169 HG11 VAL 27 HG11 VAL 27 9.259 4.945 -3.298 170 HG12 VAL 27 HG12 VAL 27 7.808 5.022 -4.295 171 HG13 VAL 27 HG13 VAL 27 7.750 4.216 -2.723 172 HG21 VAL 27 HG21 VAL 27 8.595 7.575 -4.181 173 HG22 VAL 27 HG22 VAL 27 7.415 8.387 -3.150 174 HG23 VAL 27 HG23 VAL 27 6.878 7.212 -4.351 175 H VAL 28 H VAL 28 5.687 3.753 -1.776 176 HA VAL 28 HA VAL 28 6.945 3.302 0.840 177 HB VAL 28 HB VAL 28 5.072 2.522 1.771 178 HG11 VAL 28 HG11 VAL 28 4.330 4.632 0.813 179 HG12 VAL 28 HG12 VAL 28 3.030 3.479 1.074 180 HG13 VAL 28 HG13 VAL 28 3.655 3.745 -0.553 181 HG21 VAL 28 HG21 VAL 28 5.113 0.490 0.479 182 HG22 VAL 28 HG22 VAL 28 4.238 1.304 -0.823 183 HG23 VAL 28 HG23 VAL 28 3.453 1.048 0.739 184 H ARG 29 H ARG 29 7.864 1.283 1.186 185 HA ARG 29 HA ARG 29 8.109 -0.441 -1.201 186 HB2 ARG 29 HB2 ARG 29 10.430 0.233 0.611 187 HB3 ARG 29 HB1 ARG 29 10.476 -0.588 -0.941 188 HG2 ARG 29 HG2 ARG 29 9.814 1.501 -2.048 189 HG3 ARG 29 HG1 ARG 29 9.815 2.313 -0.483 190 HD2 ARG 29 HD2 ARG 29 11.892 2.802 -1.540 191 HD3 ARG 29 HD1 ARG 29 12.216 1.658 -0.241 192 HE ARG 29 HE ARG 29 11.802 0.403 -2.792 193 HH11 ARG 29 HH11 ARG 29 14.151 1.939 -0.715 194 HH12 ARG 29 HH12 ARG 29 15.510 1.167 -1.465 195 HH21 ARG 29 HH21 ARG 29 13.596 -0.605 -3.801 196 HH22 ARG 29 HH22 ARG 29 15.200 -0.272 -3.221 197 H TRP 30 H TRP 30 7.692 -2.454 -0.794 198 HA TRP 30 HA TRP 30 7.594 -3.325 2.027 199 HB2 TRP 30 HB2 TRP 30 5.814 -4.942 1.253 200 HB3 TRP 30 HB1 TRP 30 5.366 -3.243 1.135 201 HD1 TRP 30 HD1 TRP 30 6.354 -6.188 -1.072 202 HE1 TRP 30 HE1 TRP 30 5.522 -5.747 -3.462 203 HE3 TRP 30 HE3 TRP 30 4.633 -1.461 -0.409 204 HZ2 TRP 30 HZ2 TRP 30 4.229 -3.660 -4.857 205 HZ3 TRP 30 HZ3 TRP 30 3.585 -0.317 -2.311 206 HH2 TRP 30 HH2 TRP 30 3.382 -1.381 -4.474 207 H SER 31 H SER 31 8.480 -5.233 2.639 208 HA SER 31 HA SER 31 10.281 -6.534 0.789 209 HB2 SER 31 HB2 SER 31 9.665 -7.239 3.670 210 HB3 SER 31 HB1 SER 31 11.048 -7.790 2.723 211 HG SER 31 HG SER 31 10.635 -5.035 2.965 212 H ARG 32 H ARG 32 8.899 -7.421 -0.681 213 HA ARG 32 HA ARG 32 6.551 -8.770 -0.382 214 HB2 ARG 32 HB2 ARG 32 7.319 -9.990 -2.534 215 HB3 ARG 32 HB1 ARG 32 7.148 -8.238 -2.558 216 HG2 ARG 32 HG2 ARG 32 9.786 -9.126 -1.744 217 HG3 ARG 32 HG1 ARG 32 9.351 -9.639 -3.376 218 HD2 ARG 32 HD2 ARG 32 8.947 -7.378 -4.037 219 HD3 ARG 32 HD1 ARG 32 9.096 -6.803 -2.370 220 HE ARG 32 HE ARG 32 11.461 -7.365 -2.490 221 HH11 ARG 32 HH11 ARG 32 9.755 -7.222 -5.550 222 HH12 ARG 32 HH12 ARG 32 11.188 -6.918 -6.473 223 HH21 ARG 32 HH21 ARG 32 13.342 -6.966 -3.708 224 HH22 ARG 32 HH22 ARG 32 13.222 -6.755 -5.426 225 HA PRO 33 HA PRO 33 7.185 -12.629 1.508 226 HB2 PRO 33 HB2 PRO 33 5.133 -13.947 -0.005 227 HB3 PRO 33 HB1 PRO 33 5.002 -13.196 1.586 228 HG2 PRO 33 HG2 PRO 33 3.764 -12.277 -0.690 229 HG3 PRO 33 HG1 PRO 33 4.133 -11.279 0.731 230 HD2 PRO 33 HD2 PRO 33 5.602 -11.522 -1.853 231 HD3 PRO 33 HD1 PRO 33 5.278 -10.086 -0.872 232 H GLN 34 H GLN 34 7.442 -14.954 1.275 233 HA GLN 34 HA GLN 34 9.006 -15.656 -1.085 234 HB2 GLN 34 HB2 GLN 34 8.507 -17.300 1.399 235 HB3 GLN 34 HB1 GLN 34 9.689 -17.619 0.142 236 HG2 GLN 34 HG2 GLN 34 10.900 -16.736 1.940 237 HG3 GLN 34 HG1 GLN 34 10.771 -15.429 0.770 238 HE21 GLN 34 HE21 GLN 34 8.144 -16.442 2.854 239 HE22 GLN 34 HE22 GLN 34 8.101 -15.003 3.813 240 H ALA 35 H ALA 35 5.864 -15.836 -0.025 241 HA ALA 35 HA ALA 35 5.017 -18.308 -1.132 242 HB1 ALA 35 HB1 ALA 35 3.355 -15.806 -0.882 243 HB2 ALA 35 HB2 ALA 35 3.745 -16.839 0.497 244 HB3 ALA 35 HB3 ALA 35 2.804 -17.484 -0.848 245 HA PRO 36 HA PRO 36 4.927 -17.046 -5.455 246 HB2 PRO 36 HB2 PRO 36 2.873 -19.085 -5.877 247 HB3 PRO 36 HB1 PRO 36 4.512 -19.012 -6.528 248 HG2 PRO 36 HG2 PRO 36 3.747 -20.834 -4.668 249 HG3 PRO 36 HG1 PRO 36 5.400 -20.204 -4.781 250 HD2 PRO 36 HD2 PRO 36 3.212 -19.467 -2.877 251 HD3 PRO 36 HD1 PRO 36 4.955 -19.643 -2.584 252 H ILE 37 H ILE 37 3.875 -15.216 -5.808 253 HA ILE 37 HA ILE 37 1.010 -15.063 -5.158 254 HB ILE 37 HB ILE 37 1.372 -12.665 -4.667 255 HG12 ILE 37 HG12 ILE 37 4.215 -13.368 -5.299 256 HG13 ILE 37 HG11 ILE 37 3.245 -12.034 -5.897 257 HG21 ILE 37 HG21 ILE 37 2.746 -14.781 -3.068 258 HG22 ILE 37 HG22 ILE 37 1.331 -13.799 -2.676 259 HG23 ILE 37 HG23 ILE 37 2.941 -13.091 -2.585 260 HD11 ILE 37 HD11 ILE 37 4.557 -12.337 -3.235 261 HD12 ILE 37 HD12 ILE 37 3.255 -11.180 -3.496 262 HD13 ILE 37 HD13 ILE 37 4.755 -11.050 -4.425 263 H THR 38 H THR 38 -0.212 -13.522 -6.505 264 HA THR 38 HA THR 38 0.789 -13.666 -9.255 265 HB THR 38 HB THR 38 -1.638 -13.197 -9.842 266 HG1 THR 38 HG1 THR 38 -2.496 -12.511 -7.928 267 HG21 THR 38 HG21 THR 38 -2.236 -15.488 -9.659 268 HG22 THR 38 HG22 THR 38 -1.078 -15.742 -8.352 269 HG23 THR 38 HG23 THR 38 -0.510 -15.389 -9.985 270 H GLY 39 H GLY 39 -0.094 -11.304 -6.845 271 HA2 GLY 39 HA2 GLY 39 1.021 -9.233 -8.393 272 HA3 GLY 39 HA1 GLY 39 -0.731 -9.166 -8.509 273 H TYR 40 H TYR 40 -0.217 -7.019 -7.524 274 HA TYR 40 HA TYR 40 -0.703 -7.319 -4.644 275 HB2 TYR 40 HB2 TYR 40 1.342 -5.573 -5.963 276 HB3 TYR 40 HB1 TYR 40 0.509 -4.984 -4.529 277 HD1 TYR 40 HD1 TYR 40 1.968 -8.285 -5.507 278 HD2 TYR 40 HD2 TYR 40 1.808 -5.142 -2.657 279 HE1 TYR 40 HE1 TYR 40 3.594 -9.465 -4.116 280 HE2 TYR 40 HE2 TYR 40 3.402 -6.344 -1.240 281 HH TYR 40 HH TYR 40 5.151 -9.058 -2.382 282 H ARG 41 H ARG 41 -2.476 -6.267 -4.009 283 HA ARG 41 HA ARG 41 -3.412 -3.998 -5.643 284 HB2 ARG 41 HB2 ARG 41 -4.815 -4.888 -3.174 285 HB3 ARG 41 HB1 ARG 41 -5.456 -4.181 -4.655 286 HG2 ARG 41 HG2 ARG 41 -4.294 -6.949 -4.502 287 HG3 ARG 41 HG1 ARG 41 -6.010 -6.612 -4.236 288 HD2 ARG 41 HD2 ARG 41 -4.436 -6.050 -6.747 289 HD3 ARG 41 HD1 ARG 41 -5.625 -7.337 -6.522 290 HE ARG 41 HE ARG 41 -6.626 -4.653 -6.057 291 HH11 ARG 41 HH11 ARG 41 -6.199 -7.253 -8.370 292 HH12 ARG 41 HH12 ARG 41 -7.393 -6.638 -9.468 293 HH21 ARG 41 HH21 ARG 41 -8.188 -3.848 -7.495 294 HH22 ARG 41 HH22 ARG 41 -8.525 -4.697 -8.969 295 H ILE 42 H ILE 42 -3.566 -1.931 -4.702 296 HA ILE 42 HA ILE 42 -2.433 -1.715 -1.983 297 HB ILE 42 HB ILE 42 -1.586 0.067 -4.242 298 HG12 ILE 42 HG12 ILE 42 0.004 -2.134 -2.958 299 HG13 ILE 42 HG11 ILE 42 -0.843 -2.309 -4.487 300 HG21 ILE 42 HG21 ILE 42 -0.334 -0.298 -1.525 301 HG22 ILE 42 HG22 ILE 42 -1.527 0.948 -1.883 302 HG23 ILE 42 HG23 ILE 42 0.022 0.950 -2.722 303 HD11 ILE 42 HD11 ILE 42 1.382 -0.396 -3.894 304 HD12 ILE 42 HD12 ILE 42 0.520 -0.518 -5.426 305 HD13 ILE 42 HD13 ILE 42 1.489 -1.874 -4.846 306 H VAL 43 H VAL 43 -3.953 -0.802 -0.762 307 HA VAL 43 HA VAL 43 -5.477 1.395 -2.022 308 HB VAL 43 HB VAL 43 -6.368 -0.449 0.196 309 HG11 VAL 43 HG11 VAL 43 -8.454 0.834 0.191 310 HG12 VAL 43 HG12 VAL 43 -7.702 2.021 -0.878 311 HG13 VAL 43 HG13 VAL 43 -7.074 1.770 0.752 312 HG21 VAL 43 HG21 VAL 43 -7.564 0.113 -2.505 313 HG22 VAL 43 HG22 VAL 43 -8.114 -1.084 -1.333 314 HG23 VAL 43 HG23 VAL 43 -6.555 -1.284 -2.134 315 H TYR 44 H TYR 44 -4.679 3.232 -1.463 316 HA TYR 44 HA TYR 44 -3.933 3.662 1.330 317 HB2 TYR 44 HB2 TYR 44 -2.709 5.725 0.251 318 HB3 TYR 44 HB1 TYR 44 -1.955 4.137 0.236 319 HD1 TYR 44 HD1 TYR 44 -2.310 2.707 -1.875 320 HD2 TYR 44 HD2 TYR 44 -2.975 6.901 -1.757 321 HE1 TYR 44 HE1 TYR 44 -2.084 2.786 -4.306 322 HE2 TYR 44 HE2 TYR 44 -2.749 7.007 -4.197 323 HH TYR 44 HH TYR 44 -1.720 5.709 -6.007 324 H SER 45 H SER 45 -5.045 4.925 2.456 325 HA SER 45 HA SER 45 -6.890 6.812 1.183 326 HB2 SER 45 HB2 SER 45 -8.690 5.952 2.756 327 HB3 SER 45 HB1 SER 45 -8.253 4.875 1.430 328 HG SER 45 HG SER 45 -7.160 4.701 4.048 329 HA PRO 46 HA PRO 46 -5.661 9.380 4.653 330 HB2 PRO 46 HB2 PRO 46 -7.972 10.986 4.052 331 HB3 PRO 46 HB1 PRO 46 -6.275 11.395 3.881 332 HG2 PRO 46 HG2 PRO 46 -7.933 11.040 1.765 333 HG3 PRO 46 HG1 PRO 46 -6.191 10.724 1.704 334 HD2 PRO 46 HD2 PRO 46 -8.464 8.811 1.954 335 HD3 PRO 46 HD1 PRO 46 -6.937 8.650 1.062 336 H SER 47 H SER 47 -6.167 9.208 6.707 337 HA SER 47 HA SER 47 -8.086 7.442 7.620 338 HB2 SER 47 HB2 SER 47 -6.847 9.674 9.235 339 HB3 SER 47 HB1 SER 47 -7.446 8.127 9.834 340 HG SER 47 HG SER 47 -5.769 7.319 8.156 341 H VAL 48 H VAL 48 -8.357 10.926 7.177 342 HA VAL 48 HA VAL 48 -10.993 10.822 8.472 343 HB VAL 48 HB VAL 48 -10.771 13.334 8.624 344 HG11 VAL 48 HG11 VAL 48 -10.431 11.892 10.545 345 HG12 VAL 48 HG12 VAL 48 -9.287 13.234 10.578 346 HG13 VAL 48 HG13 VAL 48 -8.751 11.632 10.075 347 HG21 VAL 48 HG21 VAL 48 -9.040 13.665 6.947 348 HG22 VAL 48 HG22 VAL 48 -7.909 12.704 7.900 349 HG23 VAL 48 HG23 VAL 48 -8.490 14.251 8.518 350 H GLU 49 H GLU 49 -9.326 12.024 5.578 351 HA GLU 49 HA GLU 49 -11.506 11.783 3.857 352 HB2 GLU 49 HB2 GLU 49 -12.526 13.562 5.215 353 HB3 GLU 49 HB1 GLU 49 -11.126 14.586 4.946 354 HG2 GLU 49 HG2 GLU 49 -12.964 15.273 3.542 355 HG3 GLU 49 HG1 GLU 49 -11.638 14.661 2.557 356 H GLY 50 H GLY 50 -10.962 12.378 1.723 357 HA2 GLY 50 HA2 GLY 50 -9.324 13.997 0.538 358 HA3 GLY 50 HA1 GLY 50 -8.116 13.045 1.389 359 H SER 51 H SER 51 -7.276 12.562 -0.727 360 HA SER 51 HA SER 51 -8.896 11.014 -2.547 361 HB2 SER 51 HB2 SER 51 -5.943 11.710 -2.675 362 HB3 SER 51 HB1 SER 51 -6.938 11.089 -4.000 363 HG SER 51 HG SER 51 -6.748 13.332 -4.152 364 H SER 52 H SER 52 -9.113 8.869 -2.447 365 HA SER 52 HA SER 52 -6.900 7.291 -1.308 366 HB2 SER 52 HB2 SER 52 -8.766 5.524 -0.953 367 HB3 SER 52 HB1 SER 52 -8.702 6.896 0.156 368 HG SER 52 HG SER 52 -10.522 7.649 -0.631 369 H THR 53 H THR 53 -6.199 5.495 -2.448 370 HA THR 53 HA THR 53 -7.436 4.997 -5.049 371 HB THR 53 HB THR 53 -4.541 5.835 -4.800 372 HG1 THR 53 HG1 THR 53 -6.883 7.258 -5.255 373 HG21 THR 53 HG21 THR 53 -6.245 5.277 -7.229 374 HG22 THR 53 HG22 THR 53 -4.928 4.269 -6.627 375 HG23 THR 53 HG23 THR 53 -4.589 5.883 -7.250 376 H GLU 54 H GLU 54 -6.888 3.025 -5.969 377 HA GLU 54 HA GLU 54 -5.178 1.234 -4.419 378 HB2 GLU 54 HB2 GLU 54 -7.479 0.445 -4.467 379 HB3 GLU 54 HB1 GLU 54 -7.530 0.608 -6.215 380 HG2 GLU 54 HG2 GLU 54 -5.747 -1.120 -6.366 381 HG3 GLU 54 HG1 GLU 54 -5.885 -1.346 -4.623 382 H LEU 55 H LEU 55 -3.261 0.920 -5.379 383 HA LEU 55 HA LEU 55 -3.187 0.965 -8.312 384 HB2 LEU 55 HB2 LEU 55 -0.911 1.155 -6.309 385 HB3 LEU 55 HB1 LEU 55 -0.675 0.921 -8.039 386 HG LEU 55 HG LEU 55 -1.867 3.285 -6.643 387 HD11 LEU 55 HD11 LEU 55 -0.109 4.448 -8.067 388 HD12 LEU 55 HD12 LEU 55 0.576 2.840 -8.310 389 HD13 LEU 55 HD13 LEU 55 0.443 3.511 -6.682 390 HD21 LEU 55 HD21 LEU 55 -3.292 2.923 -8.529 391 HD22 LEU 55 HD22 LEU 55 -1.907 2.649 -9.584 392 HD23 LEU 55 HD23 LEU 55 -2.201 4.255 -8.917 393 H ASN 56 H ASN 56 -2.364 -0.725 -9.498 394 HA ASN 56 HA ASN 56 -2.247 -3.284 -8.057 395 HB2 ASN 56 HB2 ASN 56 -4.048 -3.165 -9.725 396 HB3 ASN 56 HB1 ASN 56 -2.882 -2.726 -10.966 397 HD21 ASN 56 HD21 ASN 56 -2.386 -5.177 -8.467 398 HD22 ASN 56 HD22 ASN 56 -2.343 -6.519 -9.558 399 H LEU 57 H LEU 57 -0.250 -4.022 -7.791 400 HA LEU 57 HA LEU 57 1.787 -3.175 -9.734 401 HB2 LEU 57 HB2 LEU 57 2.027 -3.766 -6.773 402 HB3 LEU 57 HB1 LEU 57 3.413 -3.728 -7.840 403 HG LEU 57 HG LEU 57 1.834 -1.528 -6.699 404 HD11 LEU 57 HD11 LEU 57 4.141 -2.068 -6.063 405 HD12 LEU 57 HD12 LEU 57 3.974 -0.435 -6.704 406 HD13 LEU 57 HD13 LEU 57 4.659 -1.713 -7.708 407 HD21 LEU 57 HD21 LEU 57 2.953 -1.317 -9.478 408 HD22 LEU 57 HD22 LEU 57 2.336 0.011 -8.495 409 HD23 LEU 57 HD23 LEU 57 1.246 -1.265 -9.038 410 HA PRO 58 HA PRO 58 2.395 -7.355 -10.865 411 HB2 PRO 58 HB2 PRO 58 5.174 -7.381 -10.981 412 HB3 PRO 58 HB1 PRO 58 4.097 -6.906 -12.292 413 HG2 PRO 58 HG2 PRO 58 5.662 -5.223 -10.426 414 HG3 PRO 58 HG1 PRO 58 5.178 -4.903 -12.098 415 HD2 PRO 58 HD2 PRO 58 3.997 -3.742 -9.928 416 HD3 PRO 58 HD1 PRO 58 3.160 -4.010 -11.466 417 H GLU 59 H GLU 59 2.822 -9.269 -9.959 418 HA GLU 59 HA GLU 59 2.987 -9.758 -7.293 419 HB2 GLU 59 HB2 GLU 59 3.819 -12.027 -7.901 420 HB3 GLU 59 HB1 GLU 59 2.437 -11.498 -8.851 421 HG2 GLU 59 HG2 GLU 59 3.877 -10.964 -10.714 422 HG3 GLU 59 HG1 GLU 59 5.305 -11.364 -9.760 423 H THR 60 H THR 60 5.602 -8.800 -9.287 424 HA THR 60 HA THR 60 7.574 -9.628 -7.281 425 HB THR 60 HB THR 60 7.999 -10.542 -9.490 426 HG1 THR 60 HG1 THR 60 9.755 -8.573 -8.485 427 HG21 THR 60 HG21 THR 60 8.051 -7.676 -10.429 428 HG22 THR 60 HG22 THR 60 6.839 -8.890 -10.839 429 HG23 THR 60 HG23 THR 60 8.500 -9.078 -11.398 430 H ALA 61 H ALA 61 5.762 -7.123 -7.506 431 HA ALA 61 HA ALA 61 7.683 -4.976 -7.789 432 HB1 ALA 61 HB1 ALA 61 5.391 -4.630 -8.526 433 HB2 ALA 61 HB2 ALA 61 5.801 -3.509 -7.228 434 HB3 ALA 61 HB3 ALA 61 4.808 -4.927 -6.890 435 H ASN 62 H ASN 62 7.868 -3.327 -6.018 436 HA ASN 62 HA ASN 62 7.622 -4.434 -3.337 437 HB2 ASN 62 HB2 ASN 62 9.996 -4.068 -2.817 438 HB3 ASN 62 HB1 ASN 62 9.775 -5.301 -4.055 439 HD21 ASN 62 HD21 ASN 62 11.050 -2.185 -3.320 440 HD22 ASN 62 HD22 ASN 62 11.841 -1.918 -4.841 441 H SER 63 H SER 63 6.954 -1.912 -5.149 442 HA SER 63 HA SER 63 6.924 -0.107 -2.950 443 HB2 SER 63 HB2 SER 63 8.423 1.623 -4.050 444 HB3 SER 63 HB1 SER 63 9.248 0.215 -3.379 445 HG SER 63 HG SER 63 9.878 -0.332 -5.308 446 H VAL 64 H VAL 64 5.366 1.370 -3.224 447 HA VAL 64 HA VAL 64 4.395 1.856 -5.966 448 HB VAL 64 HB VAL 64 2.624 0.707 -4.797 449 HG11 VAL 64 HG11 VAL 64 3.613 1.638 -2.522 450 HG12 VAL 64 HG12 VAL 64 1.976 1.030 -2.697 451 HG13 VAL 64 HG13 VAL 64 2.275 2.768 -2.740 452 HG21 VAL 64 HG21 VAL 64 2.080 3.627 -4.980 453 HG22 VAL 64 HG22 VAL 64 0.865 2.354 -4.847 454 HG23 VAL 64 HG23 VAL 64 1.924 2.416 -6.251 455 H THR 65 H THR 65 4.325 3.929 -6.655 456 HA THR 65 HA THR 65 4.844 6.068 -4.753 457 HB THR 65 HB THR 65 4.812 5.897 -7.752 458 HG1 THR 65 HG1 THR 65 6.664 5.049 -6.703 459 HG21 THR 65 HG21 THR 65 3.993 8.111 -7.127 460 HG22 THR 65 HG22 THR 65 5.635 8.240 -7.756 461 HG23 THR 65 HG23 THR 65 5.348 8.325 -6.017 462 H LEU 66 H LEU 66 2.987 6.544 -3.762 463 HA LEU 66 HA LEU 66 0.429 6.631 -5.074 464 HB2 LEU 66 HB2 LEU 66 0.723 8.013 -2.519 465 HB3 LEU 66 HB1 LEU 66 -0.431 6.789 -3.001 466 HG LEU 66 HG LEU 66 2.402 6.084 -2.314 467 HD11 LEU 66 HD11 LEU 66 1.878 5.781 -0.112 468 HD12 LEU 66 HD12 LEU 66 0.142 5.903 -0.396 469 HD13 LEU 66 HD13 LEU 66 1.158 7.340 -0.498 470 HD21 LEU 66 HD21 LEU 66 1.340 3.900 -1.844 471 HD22 LEU 66 HD22 LEU 66 1.179 4.401 -3.529 472 HD23 LEU 66 HD23 LEU 66 -0.189 4.567 -2.428 473 H SER 67 H SER 67 -0.717 8.484 -5.631 474 HA SER 67 HA SER 67 0.744 11.017 -5.479 475 HB2 SER 67 HB2 SER 67 1.214 9.911 -7.679 476 HB3 SER 67 HB1 SER 67 -0.513 9.970 -8.025 477 HG SER 67 HG SER 67 1.171 11.803 -8.613 478 H ASP 68 H ASP 68 -0.667 12.833 -6.278 479 HA ASP 68 HA ASP 68 -2.465 14.162 -5.963 480 HB2 ASP 68 HB2 ASP 68 -3.939 11.612 -6.628 481 HB3 ASP 68 HB1 ASP 68 -4.711 13.188 -6.487 482 H LEU 69 H LEU 69 -1.324 12.865 -3.654 483 HA LEU 69 HA LEU 69 -3.414 12.223 -1.821 484 HB2 LEU 69 HB2 LEU 69 -0.770 13.342 -0.945 485 HB3 LEU 69 HB1 LEU 69 -1.798 12.167 -0.148 486 HG LEU 69 HG LEU 69 -0.181 11.590 -2.622 487 HD11 LEU 69 HD11 LEU 69 1.250 10.337 -1.116 488 HD12 LEU 69 HD12 LEU 69 0.290 10.877 0.262 489 HD13 LEU 69 HD13 LEU 69 1.217 12.045 -0.680 490 HD21 LEU 69 HD21 LEU 69 -1.985 10.089 -2.595 491 HD22 LEU 69 HD22 LEU 69 -2.017 10.046 -0.832 492 HD23 LEU 69 HD23 LEU 69 -0.726 9.214 -1.709 493 H GLN 70 H GLN 70 -3.297 13.701 0.356 494 HA GLN 70 HA GLN 70 -3.511 16.505 -0.501 495 HB2 GLN 70 HB2 GLN 70 -5.732 15.560 -0.096 496 HB3 GLN 70 HB1 GLN 70 -5.243 15.073 1.521 497 HG2 GLN 70 HG2 GLN 70 -4.974 17.392 2.166 498 HG3 GLN 70 HG1 GLN 70 -5.374 17.912 0.530 499 HE21 GLN 70 HE21 GLN 70 -7.486 17.772 -0.186 500 HE22 GLN 70 HE22 GLN 70 -8.815 17.572 0.904 501 HA PRO 71 HA PRO 71 -0.225 17.017 2.414 502 HB2 PRO 71 HB2 PRO 71 -0.371 19.738 2.627 503 HB3 PRO 71 HB1 PRO 71 0.409 18.869 1.304 504 HG2 PRO 71 HG2 PRO 71 -2.310 20.104 1.416 505 HG3 PRO 71 HG1 PRO 71 -1.128 20.119 0.094 506 HD2 PRO 71 HD2 PRO 71 -3.255 18.466 0.092 507 HD3 PRO 71 HD1 PRO 71 -1.692 17.987 -0.601 508 H GLY 72 H GLY 72 -0.148 16.808 4.541 509 HA2 GLY 72 HA2 GLY 72 -0.474 17.444 6.767 510 HA3 GLY 72 HA1 GLY 72 -1.796 18.484 6.258 511 H VAL 73 H VAL 73 -1.719 15.220 5.115 512 HA VAL 73 HA VAL 73 -3.862 14.547 7.023 513 HB VAL 73 HB VAL 73 -3.836 13.723 4.122 514 HG11 VAL 73 HG11 VAL 73 -6.280 13.354 4.672 515 HG12 VAL 73 HG12 VAL 73 -5.789 13.425 6.367 516 HG13 VAL 73 HG13 VAL 73 -5.123 12.180 5.310 517 HG21 VAL 73 HG21 VAL 73 -5.130 16.038 5.482 518 HG22 VAL 73 HG22 VAL 73 -5.887 15.256 4.094 519 HG23 VAL 73 HG23 VAL 73 -4.280 15.982 3.931 520 H GLN 74 H GLN 74 -4.076 12.428 7.620 521 HA GLN 74 HA GLN 74 -1.671 10.857 7.639 522 HB2 GLN 74 HB2 GLN 74 -3.446 11.315 9.482 523 HB3 GLN 74 HB1 GLN 74 -4.355 10.040 8.694 524 HG2 GLN 74 HG2 GLN 74 -3.180 9.061 10.503 525 HG3 GLN 74 HG1 GLN 74 -2.415 8.523 9.010 526 HE21 GLN 74 HE21 GLN 74 -0.326 9.165 8.557 527 HE22 GLN 74 HE22 GLN 74 0.683 9.938 9.725 528 H TYR 75 H TYR 75 -1.230 9.517 5.975 529 HA TYR 75 HA TYR 75 -3.487 8.401 4.479 530 HB2 TYR 75 HB2 TYR 75 -0.775 9.286 3.728 531 HB3 TYR 75 HB1 TYR 75 -1.356 7.825 2.921 532 HD1 TYR 75 HD1 TYR 75 -2.158 11.391 3.563 533 HD2 TYR 75 HD2 TYR 75 -2.986 7.928 1.239 534 HE1 TYR 75 HE1 TYR 75 -3.544 12.744 2.048 535 HE2 TYR 75 HE2 TYR 75 -4.368 9.270 -0.282 536 HH TYR 75 HH TYR 75 -5.545 11.286 -0.383 537 H ASN 76 H ASN 76 -4.060 6.457 4.990 538 HA ASN 76 HA ASN 76 -2.179 4.542 6.092 539 HB2 ASN 76 HB2 ASN 76 -5.116 4.228 5.417 540 HB3 ASN 76 HB1 ASN 76 -4.139 3.082 6.328 541 HD21 ASN 76 HD21 ASN 76 -3.630 3.523 8.458 542 HD22 ASN 76 HD22 ASN 76 -4.396 4.786 9.355 543 H ILE 77 H ILE 77 -0.834 3.736 4.570 544 HA ILE 77 HA ILE 77 -1.904 2.904 1.985 545 HB ILE 77 HB ILE 77 0.920 2.724 3.050 546 HG12 ILE 77 HG12 ILE 77 1.201 4.383 1.059 547 HG13 ILE 77 HG11 ILE 77 -0.474 4.759 1.369 548 HG21 ILE 77 HG21 ILE 77 0.989 1.085 1.465 549 HG22 ILE 77 HG22 ILE 77 1.299 2.515 0.462 550 HG23 ILE 77 HG23 ILE 77 -0.317 1.812 0.519 551 HD11 ILE 77 HD11 ILE 77 1.779 4.982 3.347 552 HD12 ILE 77 HD12 ILE 77 0.085 5.345 3.675 553 HD13 ILE 77 HD13 ILE 77 0.984 6.314 2.507 554 H THR 78 H THR 78 -2.778 1.016 1.794 555 HA THR 78 HA THR 78 -1.936 -1.118 3.602 556 HB THR 78 HB THR 78 -4.494 -0.744 2.062 557 HG1 THR 78 HG1 THR 78 -3.613 -0.027 4.575 558 HG21 THR 78 HG21 THR 78 -5.313 -2.681 3.345 559 HG22 THR 78 HG22 THR 78 -3.714 -2.880 4.060 560 HG23 THR 78 HG23 THR 78 -3.942 -3.123 2.328 561 H ILE 79 H ILE 79 -0.635 -2.577 2.741 562 HA ILE 79 HA ILE 79 -0.616 -2.917 -0.197 563 HB ILE 79 HB ILE 79 1.368 -4.237 1.665 564 HG12 ILE 79 HG12 ILE 79 1.882 -1.954 2.051 565 HG13 ILE 79 HG11 ILE 79 3.003 -2.528 0.815 566 HG21 ILE 79 HG21 ILE 79 2.757 -4.150 -0.413 567 HG22 ILE 79 HG22 ILE 79 1.283 -3.684 -1.268 568 HG23 ILE 79 HG23 ILE 79 1.370 -5.246 -0.443 569 HD11 ILE 79 HD11 ILE 79 1.880 -0.221 0.599 570 HD12 ILE 79 HD12 ILE 79 0.509 -1.149 -0.018 571 HD13 ILE 79 HD13 ILE 79 2.085 -1.258 -0.819 572 H TYR 80 H TYR 80 -1.673 -4.547 -1.037 573 HA TYR 80 HA TYR 80 -2.250 -6.927 0.589 574 HB2 TYR 80 HB2 TYR 80 -3.555 -6.070 -2.004 575 HB3 TYR 80 HB1 TYR 80 -4.068 -7.379 -0.952 576 HD1 TYR 80 HD2 TYR 80 -4.061 -3.737 -1.470 577 HD2 TYR 80 HD1 TYR 80 -5.321 -6.926 1.070 578 HE1 TYR 80 HE2 TYR 80 -5.658 -2.237 -0.368 579 HE2 TYR 80 HE1 TYR 80 -6.922 -5.421 2.170 580 HH TYR 80 HH TYR 80 -7.857 -2.497 0.907 581 H ALA 81 H ALA 81 -0.667 -8.422 0.192 582 HA ALA 81 HA ALA 81 0.359 -8.850 -2.482 583 HB1 ALA 81 HB1 ALA 81 1.823 -9.345 -0.586 584 HB2 ALA 81 HB2 ALA 81 1.494 -10.825 -1.494 585 HB3 ALA 81 HB3 ALA 81 0.665 -10.518 0.040 586 H VAL 82 H VAL 82 -0.641 -10.061 -3.991 587 HA VAL 82 HA VAL 82 -2.890 -11.724 -3.011 588 HB VAL 82 HB VAL 82 -3.729 -9.784 -4.259 589 HG11 VAL 82 HG11 VAL 82 -3.420 -9.609 -6.668 590 HG12 VAL 82 HG12 VAL 82 -2.211 -10.890 -6.584 591 HG13 VAL 82 HG13 VAL 82 -1.928 -9.354 -5.765 592 HG21 VAL 82 HG21 VAL 82 -5.222 -10.944 -5.742 593 HG22 VAL 82 HG22 VAL 82 -4.951 -11.928 -4.301 594 HG23 VAL 82 HG23 VAL 82 -4.123 -12.325 -5.810 595 H GLU 83 H GLU 83 -3.063 -13.784 -3.662 596 HA GLU 83 HA GLU 83 -0.934 -14.775 -5.431 597 HB2 GLU 83 HB2 GLU 83 -2.386 -16.409 -3.352 598 HB3 GLU 83 HB1 GLU 83 -0.958 -16.825 -4.272 599 HG2 GLU 83 HG2 GLU 83 -0.335 -16.401 -2.037 600 HG3 GLU 83 HG1 GLU 83 0.315 -15.163 -3.095 601 H GLU 84 H GLU 84 -1.610 -16.995 -6.308 602 HA GLU 84 HA GLU 84 -3.261 -16.604 -8.396 603 HB2 GLU 84 HB2 GLU 84 -2.810 -19.243 -7.015 604 HB3 GLU 84 HB1 GLU 84 -3.295 -19.021 -8.692 605 HG2 GLU 84 HG2 GLU 84 -1.182 -17.839 -9.125 606 HG3 GLU 84 HG1 GLU 84 -0.697 -18.137 -7.458 607 H ASN 85 H ASN 85 -4.332 -18.004 -5.284 608 HA ASN 85 HA ASN 85 -7.088 -17.693 -6.293 609 HB2 ASN 85 HB2 ASN 85 -6.251 -20.091 -6.159 610 HB3 ASN 85 HB1 ASN 85 -6.219 -19.889 -4.413 611 HD21 ASN 85 HD21 ASN 85 -8.137 -19.856 -3.276 612 HD22 ASN 85 HD22 ASN 85 -9.661 -20.246 -3.995 613 H GLN 86 H GLN 86 -4.881 -16.804 -3.888 614 HA GLN 86 HA GLN 86 -7.052 -16.194 -2.025 615 HB2 GLN 86 HB2 GLN 86 -5.503 -16.741 -0.172 616 HB3 GLN 86 HB1 GLN 86 -5.908 -18.113 -1.189 617 HG2 GLN 86 HG2 GLN 86 -3.400 -16.585 -1.681 618 HG3 GLN 86 HG1 GLN 86 -3.474 -17.799 -0.408 619 HE21 GLN 86 HE21 GLN 86 -3.729 -19.961 -0.963 620 HE22 GLN 86 HE22 GLN 86 -3.435 -20.546 -2.557 621 H GLU 87 H GLU 87 -6.242 -14.635 -0.301 622 HA GLU 87 HA GLU 87 -4.365 -12.673 -1.423 623 HB2 GLU 87 HB2 GLU 87 -6.927 -12.128 0.099 624 HB3 GLU 87 HB1 GLU 87 -5.765 -10.909 -0.387 625 HG2 GLU 87 HG2 GLU 87 -7.563 -10.811 -1.895 626 HG3 GLU 87 HG1 GLU 87 -6.219 -11.530 -2.762 627 H SER 88 H SER 88 -2.709 -12.231 -0.068 628 HA SER 88 HA SER 88 -2.573 -13.450 2.502 629 HB2 SER 88 HB2 SER 88 -0.759 -11.479 1.114 630 HB3 SER 88 HB1 SER 88 -0.400 -12.199 2.682 631 HG SER 88 HG SER 88 -0.534 -13.406 0.134 632 H THR 89 H THR 89 -1.782 -12.122 4.430 633 HA THR 89 HA THR 89 -3.790 -10.376 5.289 634 HB THR 89 HB THR 89 -1.923 -9.774 7.052 635 HG1 THR 89 HG1 THR 89 -0.098 -10.775 6.721 636 HG21 THR 89 HG21 THR 89 -3.888 -11.134 7.526 637 HG22 THR 89 HG22 THR 89 -2.455 -11.845 8.268 638 HG23 THR 89 HG23 THR 89 -3.116 -12.536 6.785 639 HA PRO 90 HA PRO 90 -2.506 -6.563 3.583 640 HB2 PRO 90 HB2 PRO 90 -3.947 -4.851 5.044 641 HB3 PRO 90 HB1 PRO 90 -4.714 -6.031 3.977 642 HG2 PRO 90 HG2 PRO 90 -4.382 -6.092 6.943 643 HG3 PRO 90 HG1 PRO 90 -5.758 -6.614 5.958 644 HD2 PRO 90 HD2 PRO 90 -3.815 -8.283 7.017 645 HD3 PRO 90 HD1 PRO 90 -4.898 -8.682 5.671 646 H VAL 91 H VAL 91 -0.894 -5.183 3.709 647 HA VAL 91 HA VAL 91 0.542 -4.494 6.134 648 HB VAL 91 HB VAL 91 0.656 -3.590 3.269 649 HG11 VAL 91 HG11 VAL 91 2.215 -2.465 5.587 650 HG12 VAL 91 HG12 VAL 91 0.972 -1.626 4.662 651 HG13 VAL 91 HG13 VAL 91 2.482 -2.087 3.890 652 HG21 VAL 91 HG21 VAL 91 2.901 -4.464 3.317 653 HG22 VAL 91 HG22 VAL 91 1.757 -5.715 3.823 654 HG23 VAL 91 HG23 VAL 91 2.737 -4.871 5.027 655 H VAL 92 H VAL 92 -0.103 -2.777 7.443 656 HA VAL 92 HA VAL 92 -1.496 -0.584 6.060 657 HB VAL 92 HB VAL 92 -1.969 -1.222 8.969 658 HG11 VAL 92 HG11 VAL 92 -2.428 1.058 8.332 659 HG12 VAL 92 HG12 VAL 92 -3.955 0.216 8.601 660 HG13 VAL 92 HG13 VAL 92 -3.388 0.516 6.955 661 HG21 VAL 92 HG21 VAL 92 -4.124 -2.193 8.302 662 HG22 VAL 92 HG22 VAL 92 -2.766 -3.126 7.672 663 HG23 VAL 92 HG23 VAL 92 -3.661 -2.042 6.607 664 H ILE 93 H ILE 93 0.027 0.902 5.827 665 HA ILE 93 HA ILE 93 1.560 1.691 8.217 666 HB ILE 93 HB ILE 93 3.250 2.624 6.481 667 HG12 ILE 93 HG12 ILE 93 2.115 0.432 4.768 668 HG13 ILE 93 HG11 ILE 93 1.650 2.102 4.565 669 HG21 ILE 93 HG21 ILE 93 2.986 -0.349 6.911 670 HG22 ILE 93 HG22 ILE 93 3.742 0.799 8.015 671 HG23 ILE 93 HG23 ILE 93 4.456 0.499 6.431 672 HD11 ILE 93 HD11 ILE 93 4.038 2.672 4.259 673 HD12 ILE 93 HD12 ILE 93 3.363 1.617 3.001 674 HD13 ILE 93 HD13 ILE 93 4.389 0.941 4.271 675 H GLN 94 H GLN 94 0.754 3.542 8.963 676 HA GLN 94 HA GLN 94 -0.453 5.386 7.050 677 HB2 GLN 94 HB2 GLN 94 -1.474 6.517 8.973 678 HB3 GLN 94 HB1 GLN 94 -1.900 4.819 8.898 679 HG2 GLN 94 HG2 GLN 94 0.279 5.855 10.686 680 HG3 GLN 94 HG1 GLN 94 -1.412 5.795 11.178 681 HE21 GLN 94 HE21 GLN 94 1.459 3.994 10.575 682 HE22 GLN 94 HE22 GLN 94 0.875 2.466 11.150 683 H GLN 95 H GLN 95 0.706 6.907 6.268 684 HA GLN 95 HA GLN 95 2.692 8.261 7.973 685 HB2 GLN 95 HB2 GLN 95 3.051 6.921 5.483 686 HB3 GLN 95 HB1 GLN 95 3.257 8.637 5.189 687 HG2 GLN 95 HG2 GLN 95 4.749 6.977 7.207 688 HG3 GLN 95 HG1 GLN 95 5.375 7.569 5.672 689 HE21 GLN 95 HE21 GLN 95 4.017 10.180 6.001 690 HE22 GLN 95 HE22 GLN 95 4.953 11.036 7.173 691 H GLU 96 H GLU 96 2.427 10.433 8.158 692 HA GLU 96 HA GLU 96 0.185 11.633 6.758 693 HB2 GLU 96 HB2 GLU 96 0.346 12.123 9.107 694 HB3 GLU 96 HB1 GLU 96 1.999 12.701 8.930 695 HG2 GLU 96 HG2 GLU 96 1.112 14.524 7.474 696 HG3 GLU 96 HG1 GLU 96 -0.514 13.979 7.878 697 H THR 97 H THR 97 0.301 13.033 5.180 698 HA THR 97 HA THR 97 2.670 13.368 3.689 699 HB THR 97 HB THR 97 1.254 15.051 2.426 700 HG1 THR 97 HG1 THR 97 -1.116 14.527 3.276 701 HG21 THR 97 HG21 THR 97 -0.189 13.369 1.470 702 HG22 THR 97 HG22 THR 97 -0.068 12.381 2.926 703 HG23 THR 97 HG23 THR 97 1.347 12.607 1.895 704 H THR 98 H THR 98 4.293 14.724 4.054 705 HA THR 98 HA THR 98 4.290 16.578 6.192 706 HB THR 98 HB THR 98 6.279 16.558 3.927 707 HG1 THR 98 HG1 THR 98 5.950 14.710 6.071 708 HG21 THR 98 HG21 THR 98 6.538 18.302 5.640 709 HG22 THR 98 HG22 THR 98 7.866 17.142 5.700 710 HG23 THR 98 HG23 THR 98 6.570 17.063 6.895 711 H GLY 99 H GLY 99 3.812 16.824 2.747 712 HA2 GLY 99 HA2 GLY 99 2.449 18.469 1.764 713 HA3 GLY 99 HA1 GLY 99 2.722 19.494 3.153 714 H THR 100 H THR 100 3.241 21.248 1.881 715 HA THR 100 HA THR 100 5.704 21.055 0.297 716 HB THR 100 HB THR 100 3.596 23.224 0.300 717 HG1 THR 100 HG1 THR 100 4.038 21.007 -1.436 718 HG21 THR 100 HG21 THR 100 4.646 23.929 -1.786 719 HG22 THR 100 HG22 THR 100 5.909 22.722 -1.551 720 HG23 THR 100 HG23 THR 100 5.735 24.055 -0.412 721 HA PRO 101 HA PRO 101 7.907 23.040 3.633 722 HB2 PRO 101 HB2 PRO 101 9.607 23.993 1.385 723 HB3 PRO 101 HB1 PRO 101 10.070 23.142 2.863 724 HG2 PRO 101 HG2 PRO 101 10.014 21.869 0.527 725 HG3 PRO 101 HG1 PRO 101 9.473 21.070 2.015 726 HD2 PRO 101 HD2 PRO 101 7.856 22.217 -0.215 727 HD3 PRO 101 HD1 PRO 101 7.566 20.763 0.759 728 H ARG 102 H ARG 102 6.938 24.675 0.707 729 HA ARG 102 HA ARG 102 7.156 27.302 1.917 730 HB2 ARG 102 HB2 ARG 102 6.189 26.344 -0.776 731 HB3 ARG 102 HB1 ARG 102 6.110 28.026 -0.272 732 HG2 ARG 102 HG2 ARG 102 8.519 28.109 -0.067 733 HG3 ARG 102 HG1 ARG 102 8.634 26.396 -0.475 734 HD2 ARG 102 HD2 ARG 102 9.130 27.917 -2.377 735 HD3 ARG 102 HD1 ARG 102 7.800 26.804 -2.686 736 HE ARG 102 HE ARG 102 6.699 29.172 -1.700 737 HH11 ARG 102 HH11 ARG 102 8.518 28.104 -4.496 738 HH12 ARG 102 HH12 ARG 102 7.778 29.243 -5.576 739 HH21 ARG 102 HH21 ARG 102 5.717 30.678 -3.104 740 HH22 ARG 102 HH22 ARG 102 6.190 30.724 -4.779 741 H SER 103 H SER 103 5.573 28.140 3.127 742 HA SER 103 HA SER 103 2.968 26.825 3.113 743 HB2 SER 103 HB2 SER 103 2.648 28.358 5.174 744 HB3 SER 103 HB1 SER 103 3.780 27.011 5.302 745 HG SER 103 HG SER 103 5.166 28.485 5.851 746 H ASP 104 H ASP 104 4.224 29.080 1.289 747 HA ASP 104 HA ASP 104 2.082 31.040 1.442 748 HB2 ASP 104 HB2 ASP 104 3.285 32.267 -0.244 749 HB3 ASP 104 HB1 ASP 104 4.456 31.709 0.944 750 H GLY 105 H GLY 105 1.199 31.666 -0.868 751 HA2 GLY 105 HA2 GLY 105 0.791 30.324 -3.054 752 HA3 GLY 105 HA1 GLY 105 0.053 29.183 -1.939 753 H THR 106 H THR 106 -1.398 30.577 -0.264 754 HA THR 106 HA THR 106 -3.028 32.449 -1.835 755 HB THR 106 HB THR 106 -4.194 30.373 0.030 756 HG1 THR 106 HG1 THR 106 -3.195 29.845 -2.267 757 HG21 THR 106 HG21 THR 106 -5.480 32.224 -1.984 758 HG22 THR 106 HG22 THR 106 -5.539 32.405 -0.232 759 HG23 THR 106 HG23 THR 106 -6.321 31.025 -1.001 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 -9.927 -31.952 -3.654 2 H2 GLY 1 HT2 GLY 1 -10.745 -30.593 -4.234 3 H3 GLY 1 HT3 GLY 1 -11.589 -32.024 -3.948 4 HA2 GLY 1 HA1 GLY 1 -10.266 -30.365 -1.879 5 HA3 GLY 1 HA2 GLY 1 -11.996 -30.407 -2.197 6 H SER 2 H SER 2 -12.483 -31.124 -0.127 7 HA SER 2 HA SER 2 -13.050 -32.666 1.424 8 HB2 SER 2 HB2 SER 2 -13.646 -34.156 -0.429 9 HB3 SER 2 HB1 SER 2 -11.970 -34.689 -0.557 10 HG SER 2 HG SER 2 -13.918 -35.341 1.315 11 H HIS 3 H HIS 3 -11.925 -32.472 3.210 12 HA HIS 3 HA HIS 3 -10.280 -32.596 4.759 13 HB2 HIS 3 HB2 HIS 3 -9.467 -34.954 3.055 14 HB3 HIS 3 HB1 HIS 3 -8.658 -34.538 4.562 15 HD1 HIS 3 HD1 HIS 3 -9.604 -35.595 6.601 16 HD2 HIS 3 HD2 HIS 3 -12.352 -35.487 3.487 17 HE1 HIS 3 HE1 HIS 3 -11.620 -36.837 7.438 18 HE2 HIS 3 HE2 HIS 3 -13.331 -36.597 5.605 19 H MET 4 H MET 4 -9.862 -30.550 3.318 20 HA MET 4 HA MET 4 -7.340 -30.566 1.912 21 HB2 MET 4 HB2 MET 4 -9.487 -29.101 1.516 22 HB3 MET 4 HB1 MET 4 -8.784 -28.075 2.754 23 HG2 MET 4 HG2 MET 4 -7.364 -28.869 0.227 24 HG3 MET 4 HG1 MET 4 -8.306 -27.392 0.408 25 HE1 MET 4 HE1 MET 4 -4.688 -25.992 0.358 26 HE2 MET 4 HE2 MET 4 -6.321 -25.840 -0.290 27 HE3 MET 4 HE3 MET 4 -5.377 -27.294 -0.612 28 H GLY 5 H GLY 5 -6.115 -31.400 3.741 29 HA2 GLY 5 HA2 GLY 5 -5.898 -29.818 6.138 30 HA3 GLY 5 HA1 GLY 5 -4.980 -31.265 5.754 31 H THR 6 H THR 6 -4.133 -30.086 3.147 32 HA THR 6 HA THR 6 -1.874 -28.602 4.220 33 HB THR 6 HB THR 6 -2.334 -29.425 1.346 34 HG1 THR 6 HG1 THR 6 -1.481 -30.879 3.599 35 HG21 THR 6 HG21 THR 6 -0.569 -27.754 1.699 36 HG22 THR 6 HG22 THR 6 0.113 -29.304 1.207 37 HG23 THR 6 HG23 THR 6 0.188 -28.804 2.896 38 H THR 7 H THR 7 -3.685 -26.925 4.712 39 HA THR 7 HA THR 7 -4.464 -25.276 2.473 40 HB THR 7 HB THR 7 -4.758 -24.621 5.410 41 HG1 THR 7 HG1 THR 7 -5.990 -26.553 3.882 42 HG21 THR 7 HG21 THR 7 -6.682 -23.306 4.621 43 HG22 THR 7 HG22 THR 7 -6.307 -23.763 2.959 44 HG23 THR 7 HG23 THR 7 -5.178 -22.765 3.876 45 H THR 8 H THR 8 -2.443 -24.640 1.645 46 HA THR 8 HA THR 8 -0.674 -23.090 3.352 47 HB THR 8 HB THR 8 -0.400 -23.681 0.400 48 HG1 THR 8 HG1 THR 8 -0.143 -25.288 2.584 49 HG21 THR 8 HG21 THR 8 1.978 -23.225 0.797 50 HG22 THR 8 HG22 THR 8 1.628 -22.855 2.485 51 HG23 THR 8 HG23 THR 8 0.988 -21.824 1.206 52 H ALA 9 H ALA 9 -0.768 -20.965 3.523 53 HA ALA 9 HA ALA 9 -2.315 -19.456 1.522 54 HB1 ALA 9 HB1 ALA 9 -3.524 -19.651 3.646 55 HB2 ALA 9 HB2 ALA 9 -3.054 -17.983 3.322 56 HB3 ALA 9 HB3 ALA 9 -2.149 -18.943 4.493 57 HA PRO 10 HA PRO 10 1.401 -17.137 0.984 58 HB2 PRO 10 HB2 PRO 10 0.321 -14.858 -0.066 59 HB3 PRO 10 HB1 PRO 10 0.577 -16.344 -0.989 60 HG2 PRO 10 HG2 PRO 10 -1.924 -15.285 0.258 61 HG3 PRO 10 HG1 PRO 10 -1.707 -16.109 -1.297 62 HD2 PRO 10 HD2 PRO 10 -2.662 -17.365 0.897 63 HD3 PRO 10 HD1 PRO 10 -1.738 -18.187 -0.324 64 H ASP 11 H ASP 11 2.584 -15.848 2.222 65 HA ASP 11 HA ASP 11 1.305 -14.479 4.438 66 HB2 ASP 11 HB2 ASP 11 3.697 -14.106 5.175 67 HB3 ASP 11 HB1 ASP 11 3.200 -15.788 5.062 68 H ALA 12 H ALA 12 2.171 -12.289 5.017 69 HA ALA 12 HA ALA 12 1.988 -10.595 2.629 70 HB1 ALA 12 HB1 ALA 12 0.404 -10.220 4.466 71 HB2 ALA 12 HB2 ALA 12 1.442 -8.816 4.214 72 HB3 ALA 12 HB3 ALA 12 1.750 -9.908 5.562 73 HA PRO 13 HA PRO 13 6.197 -9.149 3.049 74 HB2 PRO 13 HB2 PRO 13 5.301 -6.424 2.424 75 HB3 PRO 13 HB1 PRO 13 6.341 -7.497 1.484 76 HG2 PRO 13 HG2 PRO 13 3.856 -6.899 0.682 77 HG3 PRO 13 HG1 PRO 13 4.554 -8.510 0.420 78 HD2 PRO 13 HD2 PRO 13 2.670 -7.586 2.559 79 HD3 PRO 13 HD1 PRO 13 2.592 -9.058 1.562 80 HA PRO 14 HA PRO 14 6.339 -7.555 7.277 81 HB2 PRO 14 HB2 PRO 14 9.096 -6.978 6.276 82 HB3 PRO 14 HB1 PRO 14 8.590 -7.701 7.807 83 HG2 PRO 14 HG2 PRO 14 9.554 -9.228 5.863 84 HG3 PRO 14 HG1 PRO 14 8.182 -9.776 6.845 85 HD2 PRO 14 HD2 PRO 14 8.223 -8.750 4.045 86 HD3 PRO 14 HD1 PRO 14 7.177 -9.979 4.786 87 H ASP 15 H ASP 15 6.551 -5.556 8.239 88 HA ASP 15 HA ASP 15 5.207 -3.523 7.155 89 HB2 ASP 15 HB2 ASP 15 5.928 -3.702 9.527 90 HB3 ASP 15 HB1 ASP 15 7.523 -3.126 9.055 91 HA PRO 16 HA PRO 16 8.007 -2.113 3.892 92 HB2 PRO 16 HB2 PRO 16 5.577 -0.584 3.163 93 HB3 PRO 16 HB1 PRO 16 6.549 -1.688 2.158 94 HG2 PRO 16 HG2 PRO 16 4.169 -2.449 3.028 95 HG3 PRO 16 HG1 PRO 16 5.525 -3.585 3.080 96 HD2 PRO 16 HD2 PRO 16 4.405 -1.909 5.317 97 HD3 PRO 16 HD1 PRO 16 4.746 -3.662 5.309 98 H THR 17 H THR 17 9.129 -0.298 3.575 99 HA THR 17 HA THR 17 8.759 1.833 5.565 100 HB THR 17 HB THR 17 11.125 1.140 3.807 101 HG1 THR 17 HG1 THR 17 10.425 0.557 6.485 102 HG21 THR 17 HG21 THR 17 11.078 3.528 4.323 103 HG22 THR 17 HG22 THR 17 12.389 2.723 5.183 104 HG23 THR 17 HG23 THR 17 10.912 3.162 6.041 105 H VAL 18 H VAL 18 8.037 3.683 5.072 106 HA VAL 18 HA VAL 18 7.639 4.516 2.328 107 HB VAL 18 HB VAL 18 7.189 6.046 4.899 108 HG11 VAL 18 HG11 VAL 18 7.567 7.615 3.116 109 HG12 VAL 18 HG12 VAL 18 5.841 7.574 3.464 110 HG13 VAL 18 HG13 VAL 18 6.472 6.741 2.038 111 HG21 VAL 18 HG21 VAL 18 5.221 4.685 3.070 112 HG22 VAL 18 HG22 VAL 18 4.832 5.607 4.521 113 HG23 VAL 18 HG23 VAL 18 5.731 4.096 4.650 114 H ASP 19 H ASP 19 9.128 5.420 1.147 115 HA ASP 19 HA ASP 19 11.658 6.170 2.360 116 HB2 ASP 19 HB2 ASP 19 11.528 4.678 0.364 117 HB3 ASP 19 HB1 ASP 19 10.889 6.032 -0.561 118 H GLN 20 H GLN 20 9.022 7.644 0.577 119 HA GLN 20 HA GLN 20 10.181 10.289 1.093 120 HB2 GLN 20 HB2 GLN 20 9.044 9.353 -1.548 121 HB3 GLN 20 HB1 GLN 20 9.446 11.021 -1.170 122 HG2 GLN 20 HG2 GLN 20 11.782 10.421 -0.914 123 HG3 GLN 20 HG1 GLN 20 11.395 8.730 -1.228 124 HE21 GLN 20 HE21 GLN 20 11.746 11.889 -2.611 125 HE22 GLN 20 HE22 GLN 20 11.741 11.397 -4.244 126 H VAL 21 H VAL 21 8.770 11.785 1.701 127 HA VAL 21 HA VAL 21 5.903 11.199 1.492 128 HB VAL 21 HB VAL 21 7.212 12.280 3.992 129 HG11 VAL 21 HG11 VAL 21 4.950 13.102 3.616 130 HG12 VAL 21 HG12 VAL 21 5.009 12.008 4.998 131 HG13 VAL 21 HG13 VAL 21 4.369 11.445 3.454 132 HG21 VAL 21 HG21 VAL 21 7.767 9.924 3.720 133 HG22 VAL 21 HG22 VAL 21 6.061 9.537 3.499 134 HG23 VAL 21 HG23 VAL 21 6.632 10.154 5.051 135 H ASP 22 H ASP 22 5.029 12.811 0.365 136 HA ASP 22 HA ASP 22 5.878 15.557 0.969 137 HB2 ASP 22 HB2 ASP 22 5.564 14.306 -1.759 138 HB3 ASP 22 HB1 ASP 22 5.499 16.047 -1.518 139 H ASP 23 H ASP 23 4.090 16.738 -0.931 140 HA ASP 23 HA ASP 23 1.764 16.825 0.680 141 HB2 ASP 23 HB2 ASP 23 0.895 18.318 -1.168 142 HB3 ASP 23 HB1 ASP 23 2.408 18.822 -0.438 143 H THR 24 H THR 24 2.035 15.959 -2.756 144 HA THR 24 HA THR 24 -0.454 14.411 -2.455 145 HB THR 24 HB THR 24 -0.857 14.983 -4.846 146 HG1 THR 24 HG1 THR 24 1.142 16.979 -4.610 147 HG21 THR 24 HG21 THR 24 -1.509 17.301 -4.430 148 HG22 THR 24 HG22 THR 24 -0.414 17.378 -3.046 149 HG23 THR 24 HG23 THR 24 -1.828 16.320 -2.994 150 H SER 25 H SER 25 2.022 13.252 -1.934 151 HA SER 25 HA SER 25 2.194 11.076 -3.690 152 HB2 SER 25 HB2 SER 25 4.523 11.519 -4.559 153 HB3 SER 25 HB1 SER 25 3.270 12.546 -5.257 154 HG SER 25 HG SER 25 4.086 14.253 -4.285 155 H ILE 26 H ILE 26 3.046 9.415 -2.614 156 HA ILE 26 HA ILE 26 5.114 9.831 -0.580 157 HB ILE 26 HB ILE 26 2.394 8.651 0.023 158 HG12 ILE 26 HG12 ILE 26 4.078 10.696 1.477 159 HG13 ILE 26 HG11 ILE 26 2.677 11.047 0.473 160 HG21 ILE 26 HG21 ILE 26 3.286 7.844 2.160 161 HG22 ILE 26 HG22 ILE 26 4.912 8.286 1.635 162 HG23 ILE 26 HG23 ILE 26 4.023 7.024 0.780 163 HD11 ILE 26 HD11 ILE 26 2.710 9.534 3.072 164 HD12 ILE 26 HD12 ILE 26 1.292 9.727 2.042 165 HD13 ILE 26 HD13 ILE 26 2.042 11.143 2.778 166 H VAL 27 H VAL 27 6.419 7.890 -0.304 167 HA VAL 27 HA VAL 27 5.758 5.871 -2.361 168 HB VAL 27 HB VAL 27 8.528 6.774 -1.584 169 HG11 VAL 27 HG11 VAL 27 9.354 5.239 -3.108 170 HG12 VAL 27 HG12 VAL 27 7.847 5.189 -4.023 171 HG13 VAL 27 HG13 VAL 27 7.952 4.369 -2.462 172 HG21 VAL 27 HG21 VAL 27 7.345 8.533 -2.802 173 HG22 VAL 27 HG22 VAL 27 6.960 7.388 -4.087 174 HG23 VAL 27 HG23 VAL 27 8.637 7.836 -3.778 175 H VAL 28 H VAL 28 5.876 3.751 -1.724 176 HA VAL 28 HA VAL 28 7.095 3.262 0.892 177 HB VAL 28 HB VAL 28 5.293 2.298 1.798 178 HG11 VAL 28 HG11 VAL 28 4.510 4.485 1.163 179 HG12 VAL 28 HG12 VAL 28 3.210 3.305 1.262 180 HG13 VAL 28 HG13 VAL 28 3.825 3.806 -0.313 181 HG21 VAL 28 HG21 VAL 28 4.368 1.363 -0.877 182 HG22 VAL 28 HG22 VAL 28 3.618 0.960 0.669 183 HG23 VAL 28 HG23 VAL 28 5.266 0.417 0.310 184 H ARG 29 H ARG 29 7.951 1.205 1.220 185 HA ARG 29 HA ARG 29 8.288 -0.469 -1.186 186 HB2 ARG 29 HB2 ARG 29 10.456 0.448 0.718 187 HB3 ARG 29 HB1 ARG 29 10.672 -0.794 -0.505 188 HG2 ARG 29 HG2 ARG 29 10.133 0.892 -2.240 189 HG3 ARG 29 HG1 ARG 29 10.074 2.118 -0.973 190 HD2 ARG 29 HD2 ARG 29 12.489 0.393 -1.157 191 HD3 ARG 29 HD1 ARG 29 12.278 1.658 -2.365 192 HE ARG 29 HE ARG 29 12.463 3.278 -0.675 193 HH11 ARG 29 HH11 ARG 29 12.877 0.024 0.555 194 HH12 ARG 29 HH12 ARG 29 13.665 0.534 2.012 195 HH21 ARG 29 HH21 ARG 29 13.540 3.961 1.217 196 HH22 ARG 29 HH22 ARG 29 14.050 2.777 2.386 197 H TRP 30 H TRP 30 7.758 -2.461 -0.813 198 HA TRP 30 HA TRP 30 7.669 -3.411 1.980 199 HB2 TRP 30 HB2 TRP 30 5.844 -4.961 1.196 200 HB3 TRP 30 HB1 TRP 30 5.429 -3.254 1.089 201 HD1 TRP 30 HD1 TRP 30 6.325 -6.212 -1.115 202 HE1 TRP 30 HE1 TRP 30 5.506 -5.770 -3.505 203 HE3 TRP 30 HE3 TRP 30 4.726 -1.443 -0.490 204 HZ2 TRP 30 HZ2 TRP 30 4.273 -3.675 -4.914 205 HZ3 TRP 30 HZ3 TRP 30 3.706 -0.300 -2.406 206 HH2 TRP 30 HH2 TRP 30 3.479 -1.378 -4.555 207 H SER 31 H SER 31 8.477 -5.417 2.499 208 HA SER 31 HA SER 31 10.240 -6.617 0.518 209 HB2 SER 31 HB2 SER 31 11.018 -6.157 2.866 210 HB3 SER 31 HB1 SER 31 9.881 -7.382 3.427 211 HG SER 31 HG SER 31 11.461 -8.711 3.054 212 H ARG 32 H ARG 32 9.049 -7.762 -0.857 213 HA ARG 32 HA ARG 32 6.630 -8.956 -0.515 214 HB2 ARG 32 HB2 ARG 32 8.752 -9.993 -2.378 215 HB3 ARG 32 HB1 ARG 32 7.012 -10.083 -2.589 216 HG2 ARG 32 HG2 ARG 32 7.438 -8.311 -3.937 217 HG3 ARG 32 HG1 ARG 32 7.227 -7.459 -2.406 218 HD2 ARG 32 HD2 ARG 32 9.223 -6.559 -2.743 219 HD3 ARG 32 HD1 ARG 32 9.896 -8.157 -2.404 220 HE ARG 32 HE ARG 32 9.084 -7.719 -5.149 221 HH11 ARG 32 HH11 ARG 32 11.708 -7.547 -2.837 222 HH12 ARG 32 HH12 ARG 32 12.944 -7.664 -4.050 223 HH21 ARG 32 HH21 ARG 32 10.704 -7.855 -6.738 224 HH22 ARG 32 HH22 ARG 32 12.377 -7.848 -6.262 225 HA PRO 33 HA PRO 33 6.986 -12.662 1.712 226 HB2 PRO 33 HB2 PRO 33 4.970 -13.990 0.109 227 HB3 PRO 33 HB1 PRO 33 4.784 -13.214 1.685 228 HG2 PRO 33 HG2 PRO 33 3.653 -12.261 -0.607 229 HG3 PRO 33 HG1 PRO 33 4.125 -11.221 0.758 230 HD2 PRO 33 HD2 PRO 33 5.601 -11.796 -1.781 231 HD3 PRO 33 HD1 PRO 33 5.336 -10.242 -0.975 232 H GLN 34 H GLN 34 7.382 -14.924 1.702 233 HA GLN 34 HA GLN 34 8.978 -15.908 -0.477 234 HB2 GLN 34 HB2 GLN 34 9.511 -16.422 1.850 235 HB3 GLN 34 HB1 GLN 34 7.974 -17.250 2.040 236 HG2 GLN 34 HG2 GLN 34 8.732 -18.852 0.273 237 HG3 GLN 34 HG1 GLN 34 10.315 -18.079 0.345 238 HE21 GLN 34 HE21 GLN 34 7.995 -20.026 2.052 239 HE22 GLN 34 HE22 GLN 34 9.078 -20.612 3.270 240 H ALA 35 H ALA 35 5.741 -15.725 0.246 241 HA ALA 35 HA ALA 35 4.736 -18.124 -0.902 242 HB1 ALA 35 HB1 ALA 35 2.594 -17.096 -0.732 243 HB2 ALA 35 HB2 ALA 35 3.306 -15.484 -0.673 244 HB3 ALA 35 HB3 ALA 35 3.517 -16.595 0.688 245 HA PRO 36 HA PRO 36 4.826 -16.848 -5.242 246 HB2 PRO 36 HB2 PRO 36 2.743 -18.915 -5.523 247 HB3 PRO 36 HB1 PRO 36 4.303 -18.786 -6.341 248 HG2 PRO 36 HG2 PRO 36 3.831 -20.656 -4.464 249 HG3 PRO 36 HG1 PRO 36 5.424 -19.904 -4.666 250 HD2 PRO 36 HD2 PRO 36 3.315 -19.356 -2.616 251 HD3 PRO 36 HD1 PRO 36 5.080 -19.416 -2.432 252 H ILE 37 H ILE 37 3.773 -15.022 -5.574 253 HA ILE 37 HA ILE 37 0.888 -14.859 -4.988 254 HB ILE 37 HB ILE 37 1.273 -12.413 -4.650 255 HG12 ILE 37 HG12 ILE 37 4.004 -13.260 -5.392 256 HG13 ILE 37 HG11 ILE 37 3.163 -11.763 -5.737 257 HG21 ILE 37 HG21 ILE 37 2.157 -12.522 -2.410 258 HG22 ILE 37 HG22 ILE 37 3.019 -14.034 -2.773 259 HG23 ILE 37 HG23 ILE 37 1.253 -14.019 -2.714 260 HD11 ILE 37 HD11 ILE 37 4.946 -11.187 -4.346 261 HD12 ILE 37 HD12 ILE 37 4.639 -12.543 -3.262 262 HD13 ILE 37 HD13 ILE 37 3.523 -11.179 -3.300 263 H THR 38 H THR 38 -0.340 -13.513 -6.519 264 HA THR 38 HA THR 38 0.801 -13.717 -9.198 265 HB THR 38 HB THR 38 -1.594 -13.157 -9.895 266 HG1 THR 38 HG1 THR 38 -3.152 -13.423 -8.344 267 HG21 THR 38 HG21 THR 38 -0.631 -15.344 -10.134 268 HG22 THR 38 HG22 THR 38 -2.299 -15.464 -9.588 269 HG23 THR 38 HG23 THR 38 -0.980 -15.713 -8.445 270 H GLY 39 H GLY 39 -0.154 -11.267 -6.913 271 HA2 GLY 39 HA2 GLY 39 1.117 -9.277 -8.471 272 HA3 GLY 39 HA1 GLY 39 -0.629 -9.129 -8.609 273 H TYR 40 H TYR 40 -0.133 -7.001 -7.617 274 HA TYR 40 HA TYR 40 -0.563 -7.278 -4.730 275 HB2 TYR 40 HB2 TYR 40 1.536 -5.613 -6.064 276 HB3 TYR 40 HB1 TYR 40 0.727 -4.983 -4.633 277 HD1 TYR 40 HD2 TYR 40 2.100 -8.308 -5.623 278 HD2 TYR 40 HD1 TYR 40 1.950 -5.218 -2.721 279 HE1 TYR 40 HE2 TYR 40 3.662 -9.559 -4.220 280 HE2 TYR 40 HE1 TYR 40 3.479 -6.485 -1.289 281 HH TYR 40 HH TYR 40 5.205 -9.201 -2.433 282 H ARG 41 H ARG 41 -2.278 -6.166 -4.067 283 HA ARG 41 HA ARG 41 -3.153 -3.864 -5.689 284 HB2 ARG 41 HB2 ARG 41 -4.664 -4.862 -3.319 285 HB3 ARG 41 HB1 ARG 41 -5.247 -4.074 -4.786 286 HG2 ARG 41 HG2 ARG 41 -4.076 -6.841 -4.719 287 HG3 ARG 41 HG1 ARG 41 -5.809 -6.518 -4.562 288 HD2 ARG 41 HD2 ARG 41 -4.070 -5.766 -6.911 289 HD3 ARG 41 HD1 ARG 41 -5.199 -7.119 -6.861 290 HE ARG 41 HE ARG 41 -6.219 -4.401 -6.436 291 HH11 ARG 41 HH11 ARG 41 -6.025 -7.268 -8.448 292 HH12 ARG 41 HH12 ARG 41 -7.348 -6.792 -9.462 293 HH21 ARG 41 HH21 ARG 41 -7.939 -3.773 -7.760 294 HH22 ARG 41 HH22 ARG 41 -8.438 -4.797 -9.076 295 H ILE 42 H ILE 42 -3.439 -1.844 -4.668 296 HA ILE 42 HA ILE 42 -2.265 -1.642 -1.966 297 HB ILE 42 HB ILE 42 -1.475 0.162 -4.236 298 HG12 ILE 42 HG12 ILE 42 0.202 -1.977 -2.965 299 HG13 ILE 42 HG11 ILE 42 -0.714 -2.231 -4.442 300 HG21 ILE 42 HG21 ILE 42 -1.376 1.123 -1.950 301 HG22 ILE 42 HG22 ILE 42 0.203 1.004 -2.721 302 HG23 ILE 42 HG23 ILE 42 -0.268 -0.171 -1.492 303 HD11 ILE 42 HD11 ILE 42 1.480 -0.237 -4.035 304 HD12 ILE 42 HD12 ILE 42 0.550 -0.448 -5.517 305 HD13 ILE 42 HD13 ILE 42 1.589 -1.748 -4.931 306 H VAL 43 H VAL 43 -3.866 -0.810 -0.761 307 HA VAL 43 HA VAL 43 -5.407 1.392 -1.973 308 HB VAL 43 HB VAL 43 -6.193 -0.441 0.295 309 HG11 VAL 43 HG11 VAL 43 -6.906 1.781 0.845 310 HG12 VAL 43 HG12 VAL 43 -8.293 0.810 0.361 311 HG13 VAL 43 HG13 VAL 43 -7.608 1.991 -0.759 312 HG21 VAL 43 HG21 VAL 43 -8.013 -1.084 -1.165 313 HG22 VAL 43 HG22 VAL 43 -6.471 -1.342 -1.981 314 HG23 VAL 43 HG23 VAL 43 -7.462 0.060 -2.386 315 H TYR 44 H TYR 44 -4.582 3.244 -1.448 316 HA TYR 44 HA TYR 44 -3.819 3.691 1.335 317 HB2 TYR 44 HB2 TYR 44 -2.682 5.802 0.260 318 HB3 TYR 44 HB1 TYR 44 -1.874 4.241 0.217 319 HD1 TYR 44 HD1 TYR 44 -2.314 2.810 -1.924 320 HD2 TYR 44 HD2 TYR 44 -2.892 7.016 -1.716 321 HE1 TYR 44 HE1 TYR 44 -2.104 2.932 -4.355 322 HE2 TYR 44 HE2 TYR 44 -2.685 7.166 -4.157 323 HH TYR 44 HH TYR 44 -1.744 5.929 -6.001 324 H SER 45 H SER 45 -4.927 4.927 2.490 325 HA SER 45 HA SER 45 -6.899 6.728 1.297 326 HB2 SER 45 HB2 SER 45 -7.912 4.441 1.567 327 HB3 SER 45 HB1 SER 45 -7.649 4.592 3.304 328 HG SER 45 HG SER 45 -9.759 5.330 2.090 329 HA PRO 46 HA PRO 46 -5.750 9.323 4.763 330 HB2 PRO 46 HB2 PRO 46 -8.416 10.447 4.386 331 HB3 PRO 46 HB1 PRO 46 -6.852 11.245 4.334 332 HG2 PRO 46 HG2 PRO 46 -8.236 10.839 2.099 333 HG3 PRO 46 HG1 PRO 46 -6.471 10.646 2.128 334 HD2 PRO 46 HD2 PRO 46 -8.609 8.549 2.198 335 HD3 PRO 46 HD1 PRO 46 -7.082 8.578 1.289 336 H SER 47 H SER 47 -6.310 9.684 6.900 337 HA SER 47 HA SER 47 -7.664 7.492 8.104 338 HB2 SER 47 HB2 SER 47 -5.630 8.595 9.046 339 HB3 SER 47 HB1 SER 47 -6.618 10.002 9.432 340 HG SER 47 HG SER 47 -7.684 8.862 10.955 341 H VAL 48 H VAL 48 -8.554 10.850 7.460 342 HA VAL 48 HA VAL 48 -11.160 10.222 8.666 343 HB VAL 48 HB VAL 48 -10.187 11.999 9.924 344 HG11 VAL 48 HG11 VAL 48 -8.543 12.775 8.340 345 HG12 VAL 48 HG12 VAL 48 -9.520 14.126 8.907 346 HG13 VAL 48 HG13 VAL 48 -9.808 13.436 7.309 347 HG21 VAL 48 HG21 VAL 48 -12.572 12.197 9.512 348 HG22 VAL 48 HG22 VAL 48 -12.253 13.098 8.029 349 HG23 VAL 48 HG23 VAL 48 -11.826 13.793 9.593 350 H GLU 49 H GLU 49 -9.608 11.909 5.936 351 HA GLU 49 HA GLU 49 -11.474 11.023 4.049 352 HB2 GLU 49 HB2 GLU 49 -12.992 12.563 5.314 353 HB3 GLU 49 HB1 GLU 49 -11.937 13.898 4.877 354 HG2 GLU 49 HG2 GLU 49 -13.962 13.704 3.465 355 HG3 GLU 49 HG1 GLU 49 -12.451 13.637 2.558 356 H GLY 50 H GLY 50 -11.036 11.791 1.934 357 HA2 GLY 50 HA2 GLY 50 -9.607 13.781 0.923 358 HA3 GLY 50 HA1 GLY 50 -8.322 12.834 1.665 359 H SER 51 H SER 51 -7.429 12.491 -0.442 360 HA SER 51 HA SER 51 -9.018 11.010 -2.361 361 HB2 SER 51 HB2 SER 51 -7.509 12.799 -3.127 362 HB3 SER 51 HB1 SER 51 -6.124 11.916 -2.481 363 HG SER 51 HG SER 51 -6.340 11.518 -4.689 364 H SER 52 H SER 52 -9.127 8.857 -2.368 365 HA SER 52 HA SER 52 -6.846 7.334 -1.281 366 HB2 SER 52 HB2 SER 52 -8.535 5.499 -0.859 367 HB3 SER 52 HB1 SER 52 -8.772 6.949 0.126 368 HG SER 52 HG SER 52 -10.674 7.130 -0.727 369 H THR 53 H THR 53 -6.151 5.510 -2.427 370 HA THR 53 HA THR 53 -7.414 4.981 -5.011 371 HB THR 53 HB THR 53 -4.500 5.780 -4.858 372 HG1 THR 53 HG1 THR 53 -6.805 7.265 -5.187 373 HG21 THR 53 HG21 THR 53 -6.302 5.230 -7.218 374 HG22 THR 53 HG22 THR 53 -4.976 4.210 -6.656 375 HG23 THR 53 HG23 THR 53 -4.639 5.813 -7.309 376 H GLU 54 H GLU 54 -6.828 2.975 -5.927 377 HA GLU 54 HA GLU 54 -5.050 1.283 -4.337 378 HB2 GLU 54 HB2 GLU 54 -7.406 0.481 -4.373 379 HB3 GLU 54 HB1 GLU 54 -7.323 0.393 -6.127 380 HG2 GLU 54 HG2 GLU 54 -5.432 -1.220 -5.877 381 HG3 GLU 54 HG1 GLU 54 -5.747 -1.229 -4.144 382 H LEU 55 H LEU 55 -3.145 0.977 -5.326 383 HA LEU 55 HA LEU 55 -3.096 1.043 -8.254 384 HB2 LEU 55 HB2 LEU 55 -0.796 1.172 -6.265 385 HB3 LEU 55 HB1 LEU 55 -0.588 0.996 -8.007 386 HG LEU 55 HG LEU 55 -1.750 3.315 -6.515 387 HD11 LEU 55 HD11 LEU 55 -0.027 4.537 -7.885 388 HD12 LEU 55 HD12 LEU 55 0.627 2.952 -8.300 389 HD13 LEU 55 HD13 LEU 55 0.582 3.478 -6.617 390 HD21 LEU 55 HD21 LEU 55 -1.848 2.782 -9.474 391 HD22 LEU 55 HD22 LEU 55 -2.151 4.353 -8.737 392 HD23 LEU 55 HD23 LEU 55 -3.216 2.995 -8.382 393 H ASN 56 H ASN 56 -1.934 -0.604 -9.420 394 HA ASN 56 HA ASN 56 -2.033 -3.201 -8.038 395 HB2 ASN 56 HB2 ASN 56 -3.908 -2.958 -9.641 396 HB3 ASN 56 HB1 ASN 56 -2.748 -2.650 -10.930 397 HD21 ASN 56 HD21 ASN 56 -4.147 -5.030 -8.847 398 HD22 ASN 56 HD22 ASN 56 -3.494 -6.418 -9.644 399 H LEU 57 H LEU 57 -0.069 -4.024 -7.870 400 HA LEU 57 HA LEU 57 1.935 -3.226 -9.871 401 HB2 LEU 57 HB2 LEU 57 2.275 -3.830 -6.913 402 HB3 LEU 57 HB1 LEU 57 3.611 -3.712 -8.036 403 HG LEU 57 HG LEU 57 1.952 -1.602 -6.818 404 HD11 LEU 57 HD11 LEU 57 4.071 -0.452 -6.763 405 HD12 LEU 57 HD12 LEU 57 4.805 -1.715 -7.752 406 HD13 LEU 57 HD13 LEU 57 4.244 -2.086 -6.126 407 HD21 LEU 57 HD21 LEU 57 1.410 -1.290 -9.159 408 HD22 LEU 57 HD22 LEU 57 3.126 -1.305 -9.567 409 HD23 LEU 57 HD23 LEU 57 2.466 -0.008 -8.571 410 HA PRO 58 HA PRO 58 2.483 -7.500 -10.789 411 HB2 PRO 58 HB2 PRO 58 5.233 -7.573 -11.067 412 HB3 PRO 58 HB1 PRO 58 4.103 -7.092 -12.332 413 HG2 PRO 58 HG2 PRO 58 5.795 -5.415 -10.566 414 HG3 PRO 58 HG1 PRO 58 5.275 -5.126 -12.232 415 HD2 PRO 58 HD2 PRO 58 4.188 -3.877 -10.058 416 HD3 PRO 58 HD1 PRO 58 3.311 -4.144 -11.573 417 H GLU 59 H GLU 59 3.000 -9.353 -9.801 418 HA GLU 59 HA GLU 59 3.128 -9.665 -7.110 419 HB2 GLU 59 HB2 GLU 59 3.932 -11.968 -7.551 420 HB3 GLU 59 HB1 GLU 59 2.603 -11.487 -8.596 421 HG2 GLU 59 HG2 GLU 59 4.180 -11.050 -10.407 422 HG3 GLU 59 HG1 GLU 59 5.517 -11.513 -9.358 423 H THR 60 H THR 60 5.801 -8.931 -9.157 424 HA THR 60 HA THR 60 7.722 -9.647 -7.067 425 HB THR 60 HB THR 60 8.208 -10.612 -9.232 426 HG1 THR 60 HG1 THR 60 10.241 -10.259 -8.847 427 HG21 THR 60 HG21 THR 60 8.225 -7.780 -10.269 428 HG22 THR 60 HG22 THR 60 7.061 -9.045 -10.672 429 HG23 THR 60 HG23 THR 60 8.744 -9.200 -11.178 430 H ALA 61 H ALA 61 5.933 -7.056 -7.696 431 HA ALA 61 HA ALA 61 7.932 -4.984 -7.806 432 HB1 ALA 61 HB1 ALA 61 4.992 -4.839 -7.159 433 HB2 ALA 61 HB2 ALA 61 5.729 -4.571 -8.738 434 HB3 ALA 61 HB3 ALA 61 6.046 -3.450 -7.414 435 H ASN 62 H ASN 62 8.265 -3.412 -6.069 436 HA ASN 62 HA ASN 62 7.703 -4.483 -3.407 437 HB2 ASN 62 HB2 ASN 62 10.000 -4.402 -2.710 438 HB3 ASN 62 HB1 ASN 62 9.895 -5.395 -4.157 439 HD21 ASN 62 HD21 ASN 62 11.242 -2.611 -2.720 440 HD22 ASN 62 HD22 ASN 62 12.192 -2.097 -4.072 441 H SER 63 H SER 63 7.196 -1.949 -5.204 442 HA SER 63 HA SER 63 7.275 -0.099 -2.992 443 HB2 SER 63 HB2 SER 63 8.895 0.636 -5.458 444 HB3 SER 63 HB1 SER 63 8.748 1.550 -3.961 445 HG SER 63 HG SER 63 9.642 -0.852 -3.320 446 H VAL 64 H VAL 64 5.638 1.372 -3.238 447 HA VAL 64 HA VAL 64 4.664 1.875 -5.980 448 HB VAL 64 HB VAL 64 2.845 0.721 -4.869 449 HG11 VAL 64 HG11 VAL 64 2.198 0.989 -2.766 450 HG12 VAL 64 HG12 VAL 64 2.446 2.733 -2.791 451 HG13 VAL 64 HG13 VAL 64 3.815 1.647 -2.560 452 HG21 VAL 64 HG21 VAL 64 1.116 2.375 -4.945 453 HG22 VAL 64 HG22 VAL 64 2.229 2.500 -6.303 454 HG23 VAL 64 HG23 VAL 64 2.333 3.651 -4.968 455 H THR 65 H THR 65 4.680 3.967 -6.627 456 HA THR 65 HA THR 65 5.082 6.050 -4.635 457 HB THR 65 HB THR 65 5.139 6.008 -7.639 458 HG1 THR 65 HG1 THR 65 6.916 5.098 -6.271 459 HG21 THR 65 HG21 THR 65 6.002 8.332 -7.500 460 HG22 THR 65 HG22 THR 65 5.696 8.325 -5.763 461 HG23 THR 65 HG23 THR 65 4.351 8.205 -6.897 462 H LEU 66 H LEU 66 3.186 6.448 -3.700 463 HA LEU 66 HA LEU 66 0.665 6.444 -5.080 464 HB2 LEU 66 HB2 LEU 66 0.859 7.813 -2.502 465 HB3 LEU 66 HB1 LEU 66 -0.268 6.584 -3.033 466 HG LEU 66 HG LEU 66 2.544 5.845 -2.344 467 HD11 LEU 66 HD11 LEU 66 0.344 5.748 -0.357 468 HD12 LEU 66 HD12 LEU 66 1.341 7.187 -0.537 469 HD13 LEU 66 HD13 LEU 66 2.091 5.650 -0.126 470 HD21 LEU 66 HD21 LEU 66 1.393 3.713 -1.794 471 HD22 LEU 66 HD22 LEU 66 1.256 4.182 -3.491 472 HD23 LEU 66 HD23 LEU 66 -0.104 4.434 -2.396 473 H SER 67 H SER 67 -0.547 8.255 -5.636 474 HA SER 67 HA SER 67 0.755 10.845 -5.385 475 HB2 SER 67 HB2 SER 67 1.566 9.806 -7.515 476 HB3 SER 67 HB1 SER 67 -0.106 9.732 -8.067 477 HG SER 67 HG SER 67 0.869 11.593 -8.862 478 H ASP 68 H ASP 68 -0.700 12.557 -6.360 479 HA ASP 68 HA ASP 68 -2.640 13.714 -6.284 480 HB2 ASP 68 HB2 ASP 68 -3.331 11.954 -7.949 481 HB3 ASP 68 HB1 ASP 68 -4.042 11.055 -6.614 482 H LEU 69 H LEU 69 -1.418 12.583 -3.870 483 HA LEU 69 HA LEU 69 -3.552 12.006 -2.036 484 HB2 LEU 69 HB2 LEU 69 -0.938 13.126 -1.088 485 HB3 LEU 69 HB1 LEU 69 -1.991 11.947 -0.336 486 HG LEU 69 HG LEU 69 -0.192 11.383 -2.685 487 HD11 LEU 69 HD11 LEU 69 1.024 11.810 -0.616 488 HD12 LEU 69 HD12 LEU 69 1.088 10.104 -1.059 489 HD13 LEU 69 HD13 LEU 69 0.009 10.642 0.227 490 HD21 LEU 69 HD21 LEU 69 -1.966 9.862 -2.851 491 HD22 LEU 69 HD22 LEU 69 -2.203 9.835 -1.102 492 HD23 LEU 69 HD23 LEU 69 -0.820 8.994 -1.814 493 H GLN 70 H GLN 70 -3.429 13.573 0.069 494 HA GLN 70 HA GLN 70 -3.682 16.334 -0.931 495 HB2 GLN 70 HB2 GLN 70 -5.127 15.023 1.374 496 HB3 GLN 70 HB1 GLN 70 -5.246 16.716 0.917 497 HG2 GLN 70 HG2 GLN 70 -5.975 14.486 -0.941 498 HG3 GLN 70 HG1 GLN 70 -7.117 15.226 0.181 499 HE21 GLN 70 HE21 GLN 70 -7.796 17.336 -0.175 500 HE22 GLN 70 HE22 GLN 70 -7.521 18.163 -1.668 501 HA PRO 71 HA PRO 71 -0.303 17.233 1.842 502 HB2 PRO 71 HB2 PRO 71 -0.681 19.939 1.960 503 HB3 PRO 71 HB1 PRO 71 0.165 19.095 0.662 504 HG2 PRO 71 HG2 PRO 71 -2.635 20.124 0.744 505 HG3 PRO 71 HG1 PRO 71 -1.474 20.141 -0.596 506 HD2 PRO 71 HD2 PRO 71 -3.498 18.352 -0.441 507 HD3 PRO 71 HD1 PRO 71 -1.936 17.964 -1.188 508 H GLY 72 H GLY 72 -0.276 17.022 3.990 509 HA2 GLY 72 HA2 GLY 72 -0.741 17.506 6.210 510 HA3 GLY 72 HA1 GLY 72 -1.963 18.650 5.675 511 H VAL 73 H VAL 73 -1.718 15.248 4.786 512 HA VAL 73 HA VAL 73 -4.115 14.684 6.379 513 HB VAL 73 HB VAL 73 -3.804 14.071 3.423 514 HG11 VAL 73 HG11 VAL 73 -5.697 12.989 5.460 515 HG12 VAL 73 HG12 VAL 73 -4.821 12.134 4.184 516 HG13 VAL 73 HG13 VAL 73 -6.183 13.193 3.778 517 HG21 VAL 73 HG21 VAL 73 -5.618 15.827 5.007 518 HG22 VAL 73 HG22 VAL 73 -6.117 15.150 3.460 519 HG23 VAL 73 HG23 VAL 73 -4.693 16.199 3.547 520 H GLN 74 H GLN 74 -4.211 12.709 7.273 521 HA GLN 74 HA GLN 74 -1.818 11.155 7.416 522 HB2 GLN 74 HB2 GLN 74 -3.744 11.684 9.147 523 HB3 GLN 74 HB1 GLN 74 -4.461 10.239 8.460 524 HG2 GLN 74 HG2 GLN 74 -1.768 10.404 9.790 525 HG3 GLN 74 HG1 GLN 74 -3.233 9.731 10.491 526 HE21 GLN 74 HE21 GLN 74 -0.608 9.245 8.314 527 HE22 GLN 74 HE22 GLN 74 -0.941 7.588 7.952 528 H TYR 75 H TYR 75 -1.298 9.546 6.073 529 HA TYR 75 HA TYR 75 -3.456 8.364 4.474 530 HB2 TYR 75 HB2 TYR 75 -0.753 9.320 3.755 531 HB3 TYR 75 HB1 TYR 75 -1.281 7.816 2.989 532 HD1 TYR 75 HD2 TYR 75 -2.127 11.385 3.445 533 HD2 TYR 75 HD1 TYR 75 -2.962 7.793 1.332 534 HE1 TYR 75 HE2 TYR 75 -3.532 12.643 1.869 535 HE2 TYR 75 HE1 TYR 75 -4.376 9.039 -0.239 536 HH TYR 75 HH TYR 75 -5.538 11.027 -0.471 537 H ASN 76 H ASN 76 -3.966 6.447 5.136 538 HA ASN 76 HA ASN 76 -1.979 4.599 6.169 539 HB2 ASN 76 HB2 ASN 76 -4.913 4.123 5.573 540 HB3 ASN 76 HB1 ASN 76 -3.854 3.081 6.515 541 HD21 ASN 76 HD21 ASN 76 -3.347 3.642 8.620 542 HD22 ASN 76 HD22 ASN 76 -4.180 4.892 9.473 543 H ILE 77 H ILE 77 -0.676 3.738 4.645 544 HA ILE 77 HA ILE 77 -1.783 2.937 2.062 545 HB ILE 77 HB ILE 77 1.053 2.722 3.086 546 HG12 ILE 77 HG12 ILE 77 1.349 4.380 1.124 547 HG13 ILE 77 HG11 ILE 77 -0.333 4.756 1.387 548 HG21 ILE 77 HG21 ILE 77 -0.219 1.840 0.555 549 HG22 ILE 77 HG22 ILE 77 1.079 1.078 1.489 550 HG23 ILE 77 HG23 ILE 77 1.408 2.514 0.502 551 HD11 ILE 77 HD11 ILE 77 1.103 6.322 2.541 552 HD12 ILE 77 HD12 ILE 77 1.870 5.000 3.421 553 HD13 ILE 77 HD13 ILE 77 0.168 5.373 3.697 554 H THR 78 H THR 78 -2.615 1.046 1.810 555 HA THR 78 HA THR 78 -1.805 -1.104 3.612 556 HB THR 78 HB THR 78 -4.359 -0.735 2.062 557 HG1 THR 78 HG1 THR 78 -3.709 -0.348 4.811 558 HG21 THR 78 HG21 THR 78 -3.793 -3.101 2.469 559 HG22 THR 78 HG22 THR 78 -5.192 -2.604 3.420 560 HG23 THR 78 HG23 THR 78 -3.612 -2.755 4.188 561 H ILE 79 H ILE 79 -0.509 -2.564 2.689 562 HA ILE 79 HA ILE 79 -0.586 -2.865 -0.249 563 HB ILE 79 HB ILE 79 1.424 -4.246 1.540 564 HG12 ILE 79 HG12 ILE 79 1.956 -1.971 1.962 565 HG13 ILE 79 HG11 ILE 79 3.062 -2.536 0.711 566 HG21 ILE 79 HG21 ILE 79 1.268 -3.644 -1.381 567 HG22 ILE 79 HG22 ILE 79 1.386 -5.218 -0.581 568 HG23 ILE 79 HG23 ILE 79 2.766 -4.110 -0.578 569 HD11 ILE 79 HD11 ILE 79 0.575 -1.122 -0.077 570 HD12 ILE 79 HD12 ILE 79 2.141 -1.227 -0.901 571 HD13 ILE 79 HD13 ILE 79 1.951 -0.214 0.542 572 H TYR 80 H TYR 80 -1.230 -4.701 -1.226 573 HA TYR 80 HA TYR 80 -2.018 -6.984 0.475 574 HB2 TYR 80 HB2 TYR 80 -3.360 -6.079 -2.087 575 HB3 TYR 80 HB1 TYR 80 -3.877 -7.390 -1.040 576 HD1 TYR 80 HD1 TYR 80 -3.801 -3.722 -1.491 577 HD2 TYR 80 HD2 TYR 80 -5.087 -6.948 0.994 578 HE1 TYR 80 HE1 TYR 80 -5.363 -2.224 -0.337 579 HE2 TYR 80 HE2 TYR 80 -6.644 -5.441 2.151 580 HH TYR 80 HH TYR 80 -6.915 -3.026 2.568 581 H ALA 81 H ALA 81 -0.499 -8.539 0.032 582 HA ALA 81 HA ALA 81 0.520 -8.960 -2.647 583 HB1 ALA 81 HB1 ALA 81 2.027 -9.559 -0.881 584 HB2 ALA 81 HB2 ALA 81 1.503 -11.078 -1.633 585 HB3 ALA 81 HB3 ALA 81 0.809 -10.556 -0.082 586 H VAL 82 H VAL 82 -0.785 -9.791 -4.156 587 HA VAL 82 HA VAL 82 -3.030 -11.451 -3.184 588 HB VAL 82 HB VAL 82 -3.765 -9.503 -4.469 589 HG11 VAL 82 HG11 VAL 82 -3.385 -9.352 -6.869 590 HG12 VAL 82 HG12 VAL 82 -2.251 -10.698 -6.758 591 HG13 VAL 82 HG13 VAL 82 -1.897 -9.176 -5.939 592 HG21 VAL 82 HG21 VAL 82 -5.247 -10.633 -6.015 593 HG22 VAL 82 HG22 VAL 82 -5.090 -11.568 -4.526 594 HG23 VAL 82 HG23 VAL 82 -4.214 -12.064 -5.980 595 H GLU 83 H GLU 83 -3.436 -13.442 -3.918 596 HA GLU 83 HA GLU 83 -1.426 -14.670 -5.679 597 HB2 GLU 83 HB2 GLU 83 -1.313 -15.372 -3.345 598 HB3 GLU 83 HB1 GLU 83 -2.977 -15.935 -3.428 599 HG2 GLU 83 HG2 GLU 83 -1.658 -17.143 -5.561 600 HG3 GLU 83 HG1 GLU 83 -0.544 -17.227 -4.208 601 H GLU 84 H GLU 84 -2.384 -16.659 -6.816 602 HA GLU 84 HA GLU 84 -4.337 -16.133 -8.572 603 HB2 GLU 84 HB2 GLU 84 -3.893 -18.851 -7.335 604 HB3 GLU 84 HB1 GLU 84 -4.637 -18.532 -8.893 605 HG2 GLU 84 HG2 GLU 84 -2.488 -17.511 -9.626 606 HG3 GLU 84 HG1 GLU 84 -1.776 -18.066 -8.111 607 H ASN 85 H ASN 85 -4.953 -17.799 -5.456 608 HA ASN 85 HA ASN 85 -7.812 -17.182 -5.880 609 HB2 ASN 85 HB2 ASN 85 -6.731 -19.657 -4.516 610 HB3 ASN 85 HB1 ASN 85 -8.419 -19.286 -4.833 611 HD21 ASN 85 HD21 ASN 85 -5.472 -20.489 -6.108 612 HD22 ASN 85 HD22 ASN 85 -6.084 -20.977 -7.650 613 H GLN 86 H GLN 86 -5.286 -16.281 -4.040 614 HA GLN 86 HA GLN 86 -6.935 -16.068 -1.621 615 HB2 GLN 86 HB2 GLN 86 -4.038 -16.923 -1.583 616 HB3 GLN 86 HB1 GLN 86 -5.088 -16.714 -0.188 617 HG2 GLN 86 HG2 GLN 86 -6.517 -18.542 -1.048 618 HG3 GLN 86 HG1 GLN 86 -5.357 -18.788 -2.352 619 HE21 GLN 86 HE21 GLN 86 -3.290 -19.607 -1.849 620 HE22 GLN 86 HE22 GLN 86 -3.003 -20.452 -0.369 621 H GLU 87 H GLU 87 -5.837 -14.626 0.027 622 HA GLU 87 HA GLU 87 -4.235 -12.501 -1.212 623 HB2 GLU 87 HB2 GLU 87 -6.677 -12.040 0.519 624 HB3 GLU 87 HB1 GLU 87 -5.580 -10.791 -0.046 625 HG2 GLU 87 HG2 GLU 87 -6.234 -11.195 -2.328 626 HG3 GLU 87 HG1 GLU 87 -7.254 -12.543 -1.825 627 H SER 88 H SER 88 -2.531 -12.000 0.021 628 HA SER 88 HA SER 88 -2.096 -13.211 2.549 629 HB2 SER 88 HB2 SER 88 -0.655 -10.868 1.287 630 HB3 SER 88 HB1 SER 88 -0.048 -11.883 2.594 631 HG SER 88 HG SER 88 0.820 -12.885 0.935 632 H THR 89 H THR 89 -1.692 -12.019 4.572 633 HA THR 89 HA THR 89 -3.738 -10.288 5.341 634 HB THR 89 HB THR 89 -1.980 -9.687 7.219 635 HG1 THR 89 HG1 THR 89 -0.836 -12.132 6.835 636 HG21 THR 89 HG21 THR 89 -3.143 -12.452 6.870 637 HG22 THR 89 HG22 THR 89 -3.967 -11.055 7.564 638 HG23 THR 89 HG23 THR 89 -2.580 -11.762 8.392 639 HA PRO 90 HA PRO 90 -2.475 -6.499 3.668 640 HB2 PRO 90 HB2 PRO 90 -3.812 -4.737 5.195 641 HB3 PRO 90 HB1 PRO 90 -4.640 -5.881 4.134 642 HG2 PRO 90 HG2 PRO 90 -4.277 -5.959 7.089 643 HG3 PRO 90 HG1 PRO 90 -5.655 -6.487 6.111 644 HD2 PRO 90 HD2 PRO 90 -3.682 -8.129 7.178 645 HD3 PRO 90 HD1 PRO 90 -4.801 -8.568 5.875 646 H VAL 91 H VAL 91 -0.821 -5.158 3.700 647 HA VAL 91 HA VAL 91 0.727 -4.500 6.066 648 HB VAL 91 HB VAL 91 0.756 -3.581 3.199 649 HG11 VAL 91 HG11 VAL 91 2.597 -2.108 3.732 650 HG12 VAL 91 HG12 VAL 91 2.521 -2.578 5.424 651 HG13 VAL 91 HG13 VAL 91 1.193 -1.676 4.699 652 HG21 VAL 91 HG21 VAL 91 2.853 -4.973 4.855 653 HG22 VAL 91 HG22 VAL 91 2.973 -4.535 3.147 654 HG23 VAL 91 HG23 VAL 91 1.799 -5.748 3.668 655 H VAL 92 H VAL 92 -0.002 -2.871 7.442 656 HA VAL 92 HA VAL 92 -1.270 -0.589 6.082 657 HB VAL 92 HB VAL 92 -1.751 -1.237 8.986 658 HG11 VAL 92 HG11 VAL 92 -2.125 1.067 8.319 659 HG12 VAL 92 HG12 VAL 92 -3.666 0.279 8.664 660 HG13 VAL 92 HG13 VAL 92 -3.159 0.535 6.992 661 HG21 VAL 92 HG21 VAL 92 -3.928 -2.152 8.327 662 HG22 VAL 92 HG22 VAL 92 -2.606 -3.103 7.648 663 HG23 VAL 92 HG23 VAL 92 -3.492 -1.969 6.628 664 H ILE 93 H ILE 93 0.279 0.833 5.840 665 HA ILE 93 HA ILE 93 1.888 1.580 8.191 666 HB ILE 93 HB ILE 93 3.523 2.515 6.410 667 HG12 ILE 93 HG12 ILE 93 2.269 0.392 4.696 668 HG13 ILE 93 HG11 ILE 93 1.846 2.079 4.552 669 HG21 ILE 93 HG21 ILE 93 4.029 0.634 7.879 670 HG22 ILE 93 HG22 ILE 93 4.695 0.384 6.266 671 HG23 ILE 93 HG23 ILE 93 3.228 -0.463 6.756 672 HD11 ILE 93 HD11 ILE 93 4.534 0.851 4.127 673 HD12 ILE 93 HD12 ILE 93 4.232 2.588 4.174 674 HD13 ILE 93 HD13 ILE 93 3.483 1.589 2.912 675 H GLN 94 H GLN 94 1.312 3.504 8.963 676 HA GLN 94 HA GLN 94 -0.163 5.268 7.148 677 HB2 GLN 94 HB2 GLN 94 -1.200 6.242 9.126 678 HB3 GLN 94 HB1 GLN 94 -1.436 4.503 9.075 679 HG2 GLN 94 HG2 GLN 94 0.344 4.206 10.721 680 HG3 GLN 94 HG1 GLN 94 0.581 5.952 10.776 681 HE21 GLN 94 HE21 GLN 94 -2.314 6.458 10.535 682 HE22 GLN 94 HE22 GLN 94 -2.972 6.103 12.095 683 H GLN 95 H GLN 95 0.731 7.032 6.466 684 HA GLN 95 HA GLN 95 2.683 8.448 8.146 685 HB2 GLN 95 HB2 GLN 95 3.188 7.122 5.664 686 HB3 GLN 95 HB1 GLN 95 3.325 8.851 5.395 687 HG2 GLN 95 HG2 GLN 95 4.826 7.231 7.439 688 HG3 GLN 95 HG1 GLN 95 5.475 7.888 5.939 689 HE21 GLN 95 HE21 GLN 95 3.938 10.413 6.297 690 HE22 GLN 95 HE22 GLN 95 4.805 11.290 7.513 691 H GLU 96 H GLU 96 2.332 10.633 8.233 692 HA GLU 96 HA GLU 96 0.033 11.676 6.799 693 HB2 GLU 96 HB2 GLU 96 1.865 12.997 8.811 694 HB3 GLU 96 HB1 GLU 96 0.470 13.771 8.078 695 HG2 GLU 96 HG2 GLU 96 -0.269 13.095 10.165 696 HG3 GLU 96 HG1 GLU 96 -0.898 11.873 9.065 697 H THR 97 H THR 97 0.089 13.044 5.123 698 HA THR 97 HA THR 97 2.475 13.337 3.630 699 HB THR 97 HB THR 97 1.099 14.871 2.212 700 HG1 THR 97 HG1 THR 97 -1.212 14.864 2.853 701 HG21 THR 97 HG21 THR 97 -0.453 13.155 1.449 702 HG22 THR 97 HG22 THR 97 -0.266 12.287 2.973 703 HG23 THR 97 HG23 THR 97 1.100 12.424 1.867 704 H THR 98 H THR 98 4.021 14.802 3.785 705 HA THR 98 HA THR 98 4.064 16.633 5.943 706 HB THR 98 HB THR 98 5.950 16.552 3.589 707 HG1 THR 98 HG1 THR 98 5.884 14.948 5.953 708 HG21 THR 98 HG21 THR 98 6.316 18.451 5.036 709 HG22 THR 98 HG22 THR 98 7.602 17.275 5.305 710 HG23 THR 98 HG23 THR 98 6.283 17.418 6.463 711 H GLY 99 H GLY 99 3.426 16.915 2.526 712 HA2 GLY 99 HA2 GLY 99 2.146 18.657 1.573 713 HA3 GLY 99 HA1 GLY 99 2.523 19.658 2.959 714 H THR 100 H THR 100 3.304 21.413 1.882 715 HA THR 100 HA THR 100 5.940 21.046 0.665 716 HB THR 100 HB THR 100 3.859 22.835 -0.591 717 HG1 THR 100 HG1 THR 100 4.596 20.156 -1.170 718 HG21 THR 100 HG21 THR 100 5.400 22.907 -2.457 719 HG22 THR 100 HG22 THR 100 6.529 21.875 -1.581 720 HG23 THR 100 HG23 THR 100 6.159 23.491 -0.981 721 HA PRO 101 HA PRO 101 6.646 24.659 3.306 722 HB2 PRO 101 HB2 PRO 101 9.287 24.647 2.008 723 HB3 PRO 101 HB1 PRO 101 8.882 24.504 3.720 724 HG2 PRO 101 HG2 PRO 101 9.812 22.414 2.321 725 HG3 PRO 101 HG1 PRO 101 8.600 22.215 3.601 726 HD2 PRO 101 HD2 PRO 101 8.218 22.280 0.627 727 HD3 PRO 101 HD1 PRO 101 7.488 21.197 1.833 728 H ARG 102 H ARG 102 5.098 25.254 1.285 729 HA ARG 102 HA ARG 102 6.434 27.051 -0.583 730 HB2 ARG 102 HB2 ARG 102 4.673 25.492 -1.375 731 HB3 ARG 102 HB1 ARG 102 3.520 26.282 -0.313 732 HG2 ARG 102 HG2 ARG 102 3.770 28.356 -1.567 733 HG3 ARG 102 HG1 ARG 102 4.943 27.572 -2.627 734 HD2 ARG 102 HD2 ARG 102 2.068 26.744 -2.269 735 HD3 ARG 102 HD1 ARG 102 2.709 27.652 -3.635 736 HE ARG 102 HE ARG 102 4.233 25.429 -3.636 737 HH11 ARG 102 HH11 ARG 102 0.766 25.906 -3.512 738 HH12 ARG 102 HH12 ARG 102 0.404 24.446 -4.374 739 HH21 ARG 102 HH21 ARG 102 3.754 23.496 -4.771 740 HH22 ARG 102 HH22 ARG 102 2.098 23.071 -5.077 741 H SER 103 H SER 103 6.229 29.255 -0.526 742 HA SER 103 HA SER 103 5.974 31.320 0.387 743 HB2 SER 103 HB2 SER 103 3.503 30.176 1.718 744 HB3 SER 103 HB1 SER 103 3.860 31.881 1.449 745 HG SER 103 HG SER 103 4.046 30.660 -0.892 746 H ASP 104 H ASP 104 7.830 29.887 1.556 747 HA ASP 104 HA ASP 104 7.432 29.498 4.371 748 HB2 ASP 104 HB2 ASP 104 9.707 28.769 4.432 749 HB3 ASP 104 HB1 ASP 104 9.019 28.154 2.934 750 H GLY 105 H GLY 105 9.347 30.457 5.795 751 HA2 GLY 105 HA2 GLY 105 10.453 32.358 6.581 752 HA3 GLY 105 HA1 GLY 105 9.866 33.250 5.182 753 H THR 106 H THR 106 7.795 34.151 5.220 754 HA THR 106 HA THR 106 6.587 34.292 7.903 755 HB THR 106 HB THR 106 6.369 36.394 5.742 756 HG1 THR 106 HG1 THR 106 8.545 36.209 6.454 757 HG21 THR 106 HG21 THR 106 5.632 37.825 7.593 758 HG22 THR 106 HG22 THR 106 5.789 36.467 8.707 759 HG23 THR 106 HG23 THR 106 4.584 36.417 7.421 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 -7.104 -36.029 -1.444 2 H2 GLY 1 HT2 GLY 1 -8.623 -35.996 -2.186 3 H3 GLY 1 HT3 GLY 1 -7.804 -37.464 -1.998 4 HA2 GLY 1 HA1 GLY 1 -9.580 -37.255 -0.378 5 HA3 GLY 1 HA2 GLY 1 -7.998 -37.330 0.386 6 H SER 2 H SER 2 -9.985 -36.336 1.871 7 HA SER 2 HA SER 2 -10.429 -33.553 1.598 8 HB2 SER 2 HB2 SER 2 -10.615 -35.247 4.101 9 HB3 SER 2 HB1 SER 2 -11.387 -33.684 3.832 10 HG SER 2 HG SER 2 -12.412 -34.800 1.959 11 H HIS 3 H HIS 3 -8.139 -35.449 3.528 12 HA HIS 3 HA HIS 3 -6.808 -32.967 4.322 13 HB2 HIS 3 HB2 HIS 3 -7.385 -34.777 6.024 14 HB3 HIS 3 HB1 HIS 3 -6.134 -35.754 5.266 15 HD1 HIS 3 HD1 HIS 3 -6.656 -33.005 7.656 16 HD2 HIS 3 HD2 HIS 3 -3.472 -34.709 5.599 17 HE1 HIS 3 HE1 HIS 3 -4.584 -32.120 8.766 18 HE2 HIS 3 HE2 HIS 3 -2.681 -33.012 7.382 19 H MET 4 H MET 4 -5.770 -32.407 2.453 20 HA MET 4 HA MET 4 -4.305 -34.312 0.886 21 HB2 MET 4 HB2 MET 4 -4.314 -31.292 0.742 22 HB3 MET 4 HB1 MET 4 -3.671 -32.379 -0.482 23 HG2 MET 4 HG2 MET 4 -5.889 -33.268 -0.893 24 HG3 MET 4 HG1 MET 4 -6.551 -32.242 0.379 25 HE1 MET 4 HE1 MET 4 -8.377 -31.220 -1.195 26 HE2 MET 4 HE2 MET 4 -7.824 -32.287 -2.486 27 HE3 MET 4 HE3 MET 4 -8.041 -30.565 -2.796 28 H GLY 5 H GLY 5 -3.593 -32.174 3.504 29 HA2 GLY 5 HA2 GLY 5 -1.311 -33.271 4.396 30 HA3 GLY 5 HA1 GLY 5 -0.726 -32.260 3.083 31 H THR 6 H THR 6 -0.472 -30.124 3.411 32 HA THR 6 HA THR 6 -1.237 -29.106 6.064 33 HB THR 6 HB THR 6 1.204 -29.121 5.571 34 HG1 THR 6 HG1 THR 6 0.801 -26.411 5.619 35 HG21 THR 6 HG21 THR 6 2.125 -27.539 3.951 36 HG22 THR 6 HG22 THR 6 0.494 -27.103 3.443 37 HG23 THR 6 HG23 THR 6 1.099 -28.733 3.158 38 H THR 7 H THR 7 -2.221 -27.074 6.228 39 HA THR 7 HA THR 7 -3.910 -26.325 4.068 40 HB THR 7 HB THR 7 -4.301 -24.263 5.608 41 HG1 THR 7 HG1 THR 7 -2.371 -24.618 6.857 42 HG21 THR 7 HG21 THR 7 -5.871 -26.135 5.388 43 HG22 THR 7 HG22 THR 7 -5.784 -25.566 7.054 44 HG23 THR 7 HG23 THR 7 -4.953 -27.047 6.585 45 H THR 8 H THR 8 -3.202 -25.302 2.309 46 HA THR 8 HA THR 8 -0.743 -23.959 2.130 47 HB THR 8 HB THR 8 -3.132 -23.607 0.305 48 HG1 THR 8 HG1 THR 8 -0.972 -25.481 0.173 49 HG21 THR 8 HG21 THR 8 -1.434 -23.057 -1.383 50 HG22 THR 8 HG22 THR 8 -0.172 -23.218 -0.161 51 HG23 THR 8 HG23 THR 8 -1.374 -21.936 -0.020 52 H ALA 9 H ALA 9 -0.173 -22.044 2.844 53 HA ALA 9 HA ALA 9 -2.102 -19.875 2.979 54 HB1 ALA 9 HB1 ALA 9 -0.600 -20.808 5.423 55 HB2 ALA 9 HB2 ALA 9 -2.332 -20.986 5.147 56 HB3 ALA 9 HB3 ALA 9 -1.628 -19.379 5.320 57 HA PRO 10 HA PRO 10 1.818 -18.006 1.791 58 HB2 PRO 10 HB2 PRO 10 0.739 -15.903 0.515 59 HB3 PRO 10 HB1 PRO 10 0.789 -17.511 -0.216 60 HG2 PRO 10 HG2 PRO 10 -1.474 -16.097 1.103 61 HG3 PRO 10 HG1 PRO 10 -1.483 -17.126 -0.339 62 HD2 PRO 10 HD2 PRO 10 -2.228 -17.959 2.172 63 HD3 PRO 10 HD1 PRO 10 -1.699 -19.022 0.903 64 H ASP 11 H ASP 11 2.548 -15.616 2.034 65 HA ASP 11 HA ASP 11 1.483 -14.546 4.561 66 HB2 ASP 11 HB2 ASP 11 4.399 -14.882 3.815 67 HB3 ASP 11 HB1 ASP 11 3.821 -14.023 5.237 68 H ALA 12 H ALA 12 2.172 -12.291 4.951 69 HA ALA 12 HA ALA 12 2.058 -10.746 2.464 70 HB1 ALA 12 HB1 ALA 12 1.723 -9.892 5.345 71 HB2 ALA 12 HB2 ALA 12 0.417 -10.252 4.215 72 HB3 ALA 12 HB3 ALA 12 1.476 -8.870 3.930 73 HA PRO 13 HA PRO 13 6.244 -9.231 2.911 74 HB2 PRO 13 HB2 PRO 13 5.362 -6.494 2.325 75 HB3 PRO 13 HB1 PRO 13 6.387 -7.563 1.364 76 HG2 PRO 13 HG2 PRO 13 3.900 -6.934 0.590 77 HG3 PRO 13 HG1 PRO 13 4.585 -8.545 0.299 78 HD2 PRO 13 HD2 PRO 13 2.722 -7.641 2.463 79 HD3 PRO 13 HD1 PRO 13 2.628 -9.098 1.444 80 HA PRO 14 HA PRO 14 6.472 -7.666 7.153 81 HB2 PRO 14 HB2 PRO 14 9.199 -7.077 6.081 82 HB3 PRO 14 HB1 PRO 14 8.734 -7.808 7.622 83 HG2 PRO 14 HG2 PRO 14 9.650 -9.316 5.636 84 HG3 PRO 14 HG1 PRO 14 8.323 -9.880 6.667 85 HD2 PRO 14 HD2 PRO 14 8.253 -8.876 3.868 86 HD3 PRO 14 HD1 PRO 14 7.228 -10.085 4.663 87 H ASP 15 H ASP 15 6.822 -5.664 8.138 88 HA ASP 15 HA ASP 15 5.436 -3.604 7.125 89 HB2 ASP 15 HB2 ASP 15 6.172 -3.783 9.457 90 HB3 ASP 15 HB1 ASP 15 7.808 -3.350 8.978 91 HA PRO 16 HA PRO 16 8.150 -2.144 3.798 92 HB2 PRO 16 HB2 PRO 16 5.693 -0.618 3.166 93 HB3 PRO 16 HB1 PRO 16 6.635 -1.701 2.112 94 HG2 PRO 16 HG2 PRO 16 4.281 -2.478 3.040 95 HG3 PRO 16 HG1 PRO 16 5.637 -3.614 3.027 96 HD2 PRO 16 HD2 PRO 16 4.588 -1.982 5.326 97 HD3 PRO 16 HD1 PRO 16 4.925 -3.734 5.275 98 H THR 17 H THR 17 9.153 -0.242 3.381 99 HA THR 17 HA THR 17 8.753 1.879 5.403 100 HB THR 17 HB THR 17 11.231 1.327 3.754 101 HG1 THR 17 HG1 THR 17 10.391 0.361 6.284 102 HG21 THR 17 HG21 THR 17 11.047 3.615 4.636 103 HG22 THR 17 HG22 THR 17 12.356 2.724 5.412 104 HG23 THR 17 HG23 THR 17 10.830 2.966 6.261 105 H VAL 18 H VAL 18 8.226 3.784 4.851 106 HA VAL 18 HA VAL 18 7.881 4.511 2.051 107 HB VAL 18 HB VAL 18 7.279 6.057 4.581 108 HG11 VAL 18 HG11 VAL 18 7.794 7.599 2.768 109 HG12 VAL 18 HG12 VAL 18 6.070 7.632 3.131 110 HG13 VAL 18 HG13 VAL 18 6.654 6.770 1.702 111 HG21 VAL 18 HG21 VAL 18 5.443 4.692 2.621 112 HG22 VAL 18 HG22 VAL 18 4.950 5.614 4.040 113 HG23 VAL 18 HG23 VAL 18 5.845 4.107 4.236 114 H ASP 19 H ASP 19 9.338 5.537 0.899 115 HA ASP 19 HA ASP 19 11.794 6.418 2.227 116 HB2 ASP 19 HB2 ASP 19 12.063 4.823 0.414 117 HB3 ASP 19 HB1 ASP 19 11.165 5.868 -0.682 118 H GLN 20 H GLN 20 9.091 7.655 0.476 119 HA GLN 20 HA GLN 20 10.218 10.362 0.592 120 HB2 GLN 20 HB2 GLN 20 8.921 9.057 -1.805 121 HB3 GLN 20 HB1 GLN 20 9.167 10.789 -1.662 122 HG2 GLN 20 HG2 GLN 20 11.367 8.743 -1.590 123 HG3 GLN 20 HG1 GLN 20 10.874 9.638 -3.026 124 HE21 GLN 20 HE21 GLN 20 13.429 9.594 -1.614 125 HE22 GLN 20 HE22 GLN 20 13.767 11.218 -1.198 126 H VAL 21 H VAL 21 8.867 11.730 1.531 127 HA VAL 21 HA VAL 21 5.985 11.183 1.364 128 HB VAL 21 HB VAL 21 7.423 12.244 3.797 129 HG11 VAL 21 HG11 VAL 21 5.216 13.234 3.538 130 HG12 VAL 21 HG12 VAL 21 5.238 12.110 4.897 131 HG13 VAL 21 HG13 VAL 21 4.504 11.628 3.368 132 HG21 VAL 21 HG21 VAL 21 6.080 9.583 3.336 133 HG22 VAL 21 HG22 VAL 21 6.718 10.155 4.879 134 HG23 VAL 21 HG23 VAL 21 7.810 9.865 3.524 135 H ASP 22 H ASP 22 5.172 12.720 0.114 136 HA ASP 22 HA ASP 22 6.110 15.484 0.517 137 HB2 ASP 22 HB2 ASP 22 6.668 14.379 -1.717 138 HB3 ASP 22 HB1 ASP 22 4.942 14.392 -2.050 139 H ASP 23 H ASP 23 4.000 16.572 -1.158 140 HA ASP 23 HA ASP 23 1.895 16.584 0.834 141 HB2 ASP 23 HB2 ASP 23 2.294 18.128 -1.728 142 HB3 ASP 23 HB1 ASP 23 0.893 18.324 -0.702 143 H THR 24 H THR 24 2.090 16.038 -2.668 144 HA THR 24 HA THR 24 -0.428 14.491 -2.539 145 HB THR 24 HB THR 24 -0.582 15.079 -5.002 146 HG1 THR 24 HG1 THR 24 1.212 15.951 -5.741 147 HG21 THR 24 HG21 THR 24 -1.464 17.316 -4.580 148 HG22 THR 24 HG22 THR 24 -0.595 17.386 -3.048 149 HG23 THR 24 HG23 THR 24 -1.906 16.226 -3.266 150 H SER 25 H SER 25 2.073 13.305 -1.958 151 HA SER 25 HA SER 25 2.334 11.206 -3.828 152 HB2 SER 25 HB2 SER 25 4.616 13.208 -3.812 153 HB3 SER 25 HB1 SER 25 4.625 11.646 -4.625 154 HG SER 25 HG SER 25 2.466 13.049 -5.394 155 H ILE 26 H ILE 26 3.095 9.495 -2.729 156 HA ILE 26 HA ILE 26 5.178 9.834 -0.703 157 HB ILE 26 HB ILE 26 2.445 8.705 -0.068 158 HG12 ILE 26 HG12 ILE 26 4.207 10.677 1.396 159 HG13 ILE 26 HG11 ILE 26 2.810 11.090 0.414 160 HG21 ILE 26 HG21 ILE 26 4.041 7.025 0.636 161 HG22 ILE 26 HG22 ILE 26 3.367 7.850 2.045 162 HG23 ILE 26 HG23 ILE 26 4.990 8.252 1.480 163 HD11 ILE 26 HD11 ILE 26 2.816 9.533 2.986 164 HD12 ILE 26 HD12 ILE 26 1.395 9.797 1.975 165 HD13 ILE 26 HD13 ILE 26 2.207 11.171 2.728 166 H VAL 27 H VAL 27 6.510 7.950 -0.560 167 HA VAL 27 HA VAL 27 5.751 5.892 -2.540 168 HB VAL 27 HB VAL 27 8.547 6.815 -1.903 169 HG11 VAL 27 HG11 VAL 27 7.892 5.210 -4.305 170 HG12 VAL 27 HG12 VAL 27 7.807 4.380 -2.750 171 HG13 VAL 27 HG13 VAL 27 9.317 5.154 -3.261 172 HG21 VAL 27 HG21 VAL 27 8.554 7.808 -4.129 173 HG22 VAL 27 HG22 VAL 27 7.285 8.519 -3.132 174 HG23 VAL 27 HG23 VAL 27 6.874 7.324 -4.362 175 H VAL 28 H VAL 28 5.753 3.839 -1.851 176 HA VAL 28 HA VAL 28 7.023 3.313 0.743 177 HB VAL 28 HB VAL 28 5.179 2.441 1.656 178 HG11 VAL 28 HG11 VAL 28 4.452 4.627 0.888 179 HG12 VAL 28 HG12 VAL 28 3.136 3.478 1.081 180 HG13 VAL 28 HG13 VAL 28 3.736 3.866 -0.531 181 HG21 VAL 28 HG21 VAL 28 4.311 1.417 -1.008 182 HG22 VAL 28 HG22 VAL 28 3.487 1.102 0.520 183 HG23 VAL 28 HG23 VAL 28 5.133 0.503 0.255 184 H ARG 29 H ARG 29 7.870 1.240 1.049 185 HA ARG 29 HA ARG 29 8.134 -0.429 -1.375 186 HB2 ARG 29 HB2 ARG 29 10.449 0.152 0.463 187 HB3 ARG 29 HB1 ARG 29 10.489 -0.589 -1.128 188 HG2 ARG 29 HG2 ARG 29 10.006 1.512 -2.180 189 HG3 ARG 29 HG1 ARG 29 9.757 2.284 -0.611 190 HD2 ARG 29 HD2 ARG 29 12.330 1.164 -1.706 191 HD3 ARG 29 HD1 ARG 29 11.944 2.858 -1.415 192 HE ARG 29 HE ARG 29 11.816 1.145 0.915 193 HH11 ARG 29 HH11 ARG 29 13.805 3.272 -1.024 194 HH12 ARG 29 HH12 ARG 29 14.922 3.605 0.259 195 HH21 ARG 29 HH21 ARG 29 13.293 1.559 2.597 196 HH22 ARG 29 HH22 ARG 29 14.624 2.640 2.327 197 H TRP 30 H TRP 30 7.702 -2.453 -0.978 198 HA TRP 30 HA TRP 30 7.666 -3.350 1.835 199 HB2 TRP 30 HB2 TRP 30 5.857 -4.950 1.111 200 HB3 TRP 30 HB1 TRP 30 5.411 -3.252 1.004 201 HD1 TRP 30 HD1 TRP 30 6.248 -6.232 -1.197 202 HE1 TRP 30 HE1 TRP 30 5.366 -5.800 -3.568 203 HE3 TRP 30 HE3 TRP 30 4.711 -1.435 -0.575 204 HZ2 TRP 30 HZ2 TRP 30 4.116 -3.707 -4.963 205 HZ3 TRP 30 HZ3 TRP 30 3.650 -0.298 -2.476 206 HH2 TRP 30 HH2 TRP 30 3.356 -1.395 -4.607 207 H SER 31 H SER 31 8.435 -5.355 2.385 208 HA SER 31 HA SER 31 10.277 -6.563 0.490 209 HB2 SER 31 HB2 SER 31 9.795 -7.197 3.412 210 HB3 SER 31 HB1 SER 31 11.132 -7.789 2.427 211 HG SER 31 HG SER 31 11.720 -5.977 3.711 212 H ARG 32 H ARG 32 9.091 -7.747 -0.923 213 HA ARG 32 HA ARG 32 6.702 -9.006 -0.569 214 HB2 ARG 32 HB2 ARG 32 8.843 -10.084 -2.380 215 HB3 ARG 32 HB1 ARG 32 7.106 -10.165 -2.604 216 HG2 ARG 32 HG2 ARG 32 7.596 -8.468 -4.036 217 HG3 ARG 32 HG1 ARG 32 7.317 -7.548 -2.555 218 HD2 ARG 32 HD2 ARG 32 9.384 -6.765 -2.557 219 HD3 ARG 32 HD1 ARG 32 10.054 -8.397 -2.691 220 HE ARG 32 HE ARG 32 9.026 -7.321 -5.162 221 HH11 ARG 32 HH11 ARG 32 11.824 -7.573 -3.076 222 HH12 ARG 32 HH12 ARG 32 12.966 -7.350 -4.363 223 HH21 ARG 32 HH21 ARG 32 10.518 -7.019 -6.856 224 HH22 ARG 32 HH22 ARG 32 12.220 -7.017 -6.515 225 HA PRO 33 HA PRO 33 7.213 -12.647 1.765 226 HB2 PRO 33 HB2 PRO 33 5.166 -14.066 0.303 227 HB3 PRO 33 HB1 PRO 33 5.011 -13.199 1.835 228 HG2 PRO 33 HG2 PRO 33 3.818 -12.416 -0.510 229 HG3 PRO 33 HG1 PRO 33 4.236 -11.304 0.815 230 HD2 PRO 33 HD2 PRO 33 5.720 -11.880 -1.715 231 HD3 PRO 33 HD1 PRO 33 5.423 -10.324 -0.927 232 H GLN 34 H GLN 34 7.579 -14.966 1.745 233 HA GLN 34 HA GLN 34 9.131 -15.879 -0.519 234 HB2 GLN 34 HB2 GLN 34 8.381 -17.303 2.041 235 HB3 GLN 34 HB1 GLN 34 9.509 -17.890 0.833 236 HG2 GLN 34 HG2 GLN 34 10.802 -17.011 2.598 237 HG3 GLN 34 HG1 GLN 34 10.909 -15.866 1.267 238 HE21 GLN 34 HE21 GLN 34 8.148 -16.174 3.426 239 HE22 GLN 34 HE22 GLN 34 8.339 -14.630 4.181 240 H ALA 35 H ALA 35 5.971 -15.835 0.460 241 HA ALA 35 HA ALA 35 4.914 -18.243 -0.562 242 HB1 ALA 35 HB1 ALA 35 3.467 -15.608 -0.471 243 HB2 ALA 35 HB2 ALA 35 3.819 -16.540 0.992 244 HB3 ALA 35 HB3 ALA 35 2.807 -17.236 -0.275 245 HA PRO 36 HA PRO 36 4.758 -17.176 -4.912 246 HB2 PRO 36 HB2 PRO 36 2.886 -18.985 -5.682 247 HB3 PRO 36 HB1 PRO 36 4.568 -19.423 -5.374 248 HG2 PRO 36 HG2 PRO 36 2.162 -19.817 -3.664 249 HG3 PRO 36 HG1 PRO 36 3.579 -20.860 -3.870 250 HD2 PRO 36 HD2 PRO 36 3.167 -19.172 -1.726 251 HD3 PRO 36 HD1 PRO 36 4.753 -19.770 -2.245 252 H ILE 37 H ILE 37 3.796 -15.325 -5.362 253 HA ILE 37 HA ILE 37 0.915 -15.015 -4.828 254 HB ILE 37 HB ILE 37 1.351 -12.611 -4.450 255 HG12 ILE 37 HG12 ILE 37 4.123 -13.458 -5.135 256 HG13 ILE 37 HG11 ILE 37 3.238 -12.025 -5.615 257 HG21 ILE 37 HG21 ILE 37 1.480 -14.412 -2.576 258 HG22 ILE 37 HG22 ILE 37 2.029 -12.761 -2.221 259 HG23 ILE 37 HG23 ILE 37 3.214 -14.042 -2.561 260 HD11 ILE 37 HD11 ILE 37 3.477 -11.243 -3.230 261 HD12 ILE 37 HD12 ILE 37 4.948 -11.286 -4.206 262 HD13 ILE 37 HD13 ILE 37 4.630 -12.561 -3.031 263 H THR 38 H THR 38 -0.218 -13.625 -6.376 264 HA THR 38 HA THR 38 0.990 -13.898 -9.023 265 HB THR 38 HB THR 38 -1.370 -13.473 -9.835 266 HG1 THR 38 HG1 THR 38 -2.960 -13.388 -8.389 267 HG21 THR 38 HG21 THR 38 -0.352 -15.664 -9.823 268 HG22 THR 38 HG22 THR 38 -2.054 -15.764 -9.400 269 HG23 THR 38 HG23 THR 38 -0.827 -15.897 -8.144 270 H GLY 39 H GLY 39 -0.251 -11.424 -6.873 271 HA2 GLY 39 HA2 GLY 39 1.018 -9.408 -8.442 272 HA3 GLY 39 HA1 GLY 39 -0.735 -9.330 -8.551 273 H TYR 40 H TYR 40 -0.281 -7.161 -7.571 274 HA TYR 40 HA TYR 40 -0.666 -7.437 -4.676 275 HB2 TYR 40 HB2 TYR 40 1.390 -5.738 -6.037 276 HB3 TYR 40 HB1 TYR 40 0.599 -5.129 -4.589 277 HD1 TYR 40 HD2 TYR 40 1.983 -8.445 -5.606 278 HD2 TYR 40 HD1 TYR 40 1.892 -5.343 -2.709 279 HE1 TYR 40 HE2 TYR 40 3.590 -9.681 -4.242 280 HE2 TYR 40 HE1 TYR 40 3.469 -6.597 -1.317 281 HH TYR 40 HH TYR 40 5.183 -9.308 -2.500 282 H ARG 41 H ARG 41 -2.384 -6.330 -3.980 283 HA ARG 41 HA ARG 41 -3.355 -4.052 -5.575 284 HB2 ARG 41 HB2 ARG 41 -4.628 -4.960 -3.030 285 HB3 ARG 41 HB1 ARG 41 -5.348 -4.184 -4.438 286 HG2 ARG 41 HG2 ARG 41 -4.210 -6.953 -4.546 287 HG3 ARG 41 HG1 ARG 41 -5.873 -6.653 -4.022 288 HD2 ARG 41 HD2 ARG 41 -4.671 -5.919 -6.686 289 HD3 ARG 41 HD1 ARG 41 -5.820 -7.224 -6.378 290 HE ARG 41 HE ARG 41 -6.775 -4.622 -5.573 291 HH11 ARG 41 HH11 ARG 41 -6.545 -6.930 -8.199 292 HH12 ARG 41 HH12 ARG 41 -7.847 -6.225 -9.103 293 HH21 ARG 41 HH21 ARG 41 -8.490 -3.686 -6.763 294 HH22 ARG 41 HH22 ARG 41 -8.958 -4.393 -8.283 295 H ILE 42 H ILE 42 -3.501 -1.983 -4.625 296 HA ILE 42 HA ILE 42 -2.292 -1.715 -1.944 297 HB ILE 42 HB ILE 42 -1.587 0.080 -4.244 298 HG12 ILE 42 HG12 ILE 42 0.150 -2.039 -3.018 299 HG13 ILE 42 HG11 ILE 42 -0.786 -2.292 -4.482 300 HG21 ILE 42 HG21 ILE 42 -1.459 0.995 -1.915 301 HG22 ILE 42 HG22 ILE 42 0.067 1.002 -2.793 302 HG23 ILE 42 HG23 ILE 42 -0.239 -0.230 -1.568 303 HD11 ILE 42 HD11 ILE 42 1.495 -1.776 -5.008 304 HD12 ILE 42 HD12 ILE 42 1.391 -0.279 -4.089 305 HD13 ILE 42 HD13 ILE 42 0.437 -0.477 -5.559 306 H VAL 43 H VAL 43 -3.887 -0.874 -0.721 307 HA VAL 43 HA VAL 43 -5.450 1.311 -1.935 308 HB VAL 43 HB VAL 43 -6.230 -0.514 0.341 309 HG11 VAL 43 HG11 VAL 43 -7.650 1.909 -0.727 310 HG12 VAL 43 HG12 VAL 43 -6.951 1.706 0.879 311 HG13 VAL 43 HG13 VAL 43 -8.334 0.731 0.396 312 HG21 VAL 43 HG21 VAL 43 -8.051 -1.162 -1.125 313 HG22 VAL 43 HG22 VAL 43 -6.502 -1.435 -1.925 314 HG23 VAL 43 HG23 VAL 43 -7.483 -0.033 -2.352 315 H TYR 44 H TYR 44 -4.645 3.168 -1.417 316 HA TYR 44 HA TYR 44 -3.873 3.648 1.359 317 HB2 TYR 44 HB2 TYR 44 -2.703 5.722 0.271 318 HB3 TYR 44 HB1 TYR 44 -1.919 4.148 0.224 319 HD1 TYR 44 HD1 TYR 44 -2.281 2.739 -1.899 320 HD2 TYR 44 HD2 TYR 44 -3.027 6.918 -1.713 321 HE1 TYR 44 HE1 TYR 44 -2.095 2.856 -4.332 322 HE2 TYR 44 HE2 TYR 44 -2.842 7.061 -4.156 323 HH TYR 44 HH TYR 44 -1.898 5.870 -5.998 324 H SER 45 H SER 45 -4.969 4.928 2.492 325 HA SER 45 HA SER 45 -6.944 6.692 1.220 326 HB2 SER 45 HB2 SER 45 -8.616 5.802 2.939 327 HB3 SER 45 HB1 SER 45 -8.211 4.728 1.601 328 HG SER 45 HG SER 45 -7.514 4.557 4.308 329 HA PRO 46 HA PRO 46 -5.727 9.498 4.496 330 HB2 PRO 46 HB2 PRO 46 -7.655 11.328 4.111 331 HB3 PRO 46 HB1 PRO 46 -6.334 11.117 2.952 332 HG2 PRO 46 HG2 PRO 46 -9.134 10.044 2.842 333 HG3 PRO 46 HG1 PRO 46 -8.199 10.848 1.566 334 HD2 PRO 46 HD2 PRO 46 -8.449 8.163 1.710 335 HD3 PRO 46 HD1 PRO 46 -6.984 8.949 1.088 336 H SER 47 H SER 47 -6.276 9.796 6.589 337 HA SER 47 HA SER 47 -8.281 8.120 7.686 338 HB2 SER 47 HB2 SER 47 -6.653 10.261 9.068 339 HB3 SER 47 HB1 SER 47 -7.494 8.915 9.841 340 HG SER 47 HG SER 47 -5.794 7.756 9.468 341 H VAL 48 H VAL 48 -8.234 11.548 6.892 342 HA VAL 48 HA VAL 48 -10.879 11.763 8.173 343 HB VAL 48 HB VAL 48 -10.507 14.202 8.344 344 HG11 VAL 48 HG11 VAL 48 -8.402 12.515 9.686 345 HG12 VAL 48 HG12 VAL 48 -10.062 12.733 10.239 346 HG13 VAL 48 HG13 VAL 48 -8.952 14.104 10.219 347 HG21 VAL 48 HG21 VAL 48 -8.228 15.087 8.091 348 HG22 VAL 48 HG22 VAL 48 -8.884 14.499 6.563 349 HG23 VAL 48 HG23 VAL 48 -7.708 13.529 7.449 350 H GLU 49 H GLU 49 -9.012 12.711 5.313 351 HA GLU 49 HA GLU 49 -11.137 12.453 3.523 352 HB2 GLU 49 HB2 GLU 49 -12.062 14.452 4.639 353 HB3 GLU 49 HB1 GLU 49 -10.573 15.328 4.306 354 HG2 GLU 49 HG2 GLU 49 -10.991 15.038 1.887 355 HG3 GLU 49 HG1 GLU 49 -12.529 14.273 2.278 356 H GLY 50 H GLY 50 -10.413 12.605 1.426 357 HA2 GLY 50 HA2 GLY 50 -8.525 14.090 0.242 358 HA3 GLY 50 HA1 GLY 50 -7.547 12.910 1.103 359 H SER 51 H SER 51 -6.802 12.233 -0.993 360 HA SER 51 HA SER 51 -8.770 10.862 -2.656 361 HB2 SER 51 HB2 SER 51 -7.147 12.402 -3.731 362 HB3 SER 51 HB1 SER 51 -5.818 11.383 -3.170 363 HG SER 51 HG SER 51 -7.871 10.750 -5.028 364 H SER 52 H SER 52 -9.129 8.745 -2.316 365 HA SER 52 HA SER 52 -6.886 7.127 -1.318 366 HB2 SER 52 HB2 SER 52 -8.665 5.393 -0.809 367 HB3 SER 52 HB1 SER 52 -8.758 6.866 0.155 368 HG SER 52 HG SER 52 -10.804 6.299 -0.598 369 H THR 53 H THR 53 -6.215 5.337 -2.433 370 HA THR 53 HA THR 53 -7.503 4.787 -5.002 371 HB THR 53 HB THR 53 -4.618 5.688 -4.841 372 HG1 THR 53 HG1 THR 53 -6.841 7.124 -4.930 373 HG21 THR 53 HG21 THR 53 -4.996 4.054 -6.614 374 HG22 THR 53 HG22 THR 53 -4.701 5.658 -7.289 375 HG23 THR 53 HG23 THR 53 -6.343 5.015 -7.226 376 H GLU 54 H GLU 54 -6.951 2.803 -5.905 377 HA GLU 54 HA GLU 54 -5.181 1.087 -4.336 378 HB2 GLU 54 HB2 GLU 54 -7.509 0.302 -4.301 379 HB3 GLU 54 HB1 GLU 54 -7.546 0.308 -6.058 380 HG2 GLU 54 HG2 GLU 54 -5.839 -1.428 -6.114 381 HG3 GLU 54 HG1 GLU 54 -5.768 -1.425 -4.354 382 H LEU 55 H LEU 55 -3.278 0.875 -5.339 383 HA LEU 55 HA LEU 55 -3.269 0.866 -8.270 384 HB2 LEU 55 HB2 LEU 55 -0.944 1.125 -6.326 385 HB3 LEU 55 HB1 LEU 55 -0.764 0.943 -8.068 386 HG LEU 55 HG LEU 55 -1.990 3.226 -6.568 387 HD11 LEU 55 HD11 LEU 55 -0.340 4.507 -7.975 388 HD12 LEU 55 HD12 LEU 55 0.370 2.946 -8.393 389 HD13 LEU 55 HD13 LEU 55 0.333 3.481 -6.710 390 HD21 LEU 55 HD21 LEU 55 -2.101 2.689 -9.531 391 HD22 LEU 55 HD22 LEU 55 -2.485 4.236 -8.775 392 HD23 LEU 55 HD23 LEU 55 -3.468 2.815 -8.422 393 H ASN 56 H ASN 56 -2.233 -0.786 -9.440 394 HA ASN 56 HA ASN 56 -2.184 -3.338 -7.976 395 HB2 ASN 56 HB2 ASN 56 -4.072 -3.116 -9.592 396 HB3 ASN 56 HB1 ASN 56 -2.899 -2.895 -10.886 397 HD21 ASN 56 HD21 ASN 56 -4.334 -5.139 -8.670 398 HD22 ASN 56 HD22 ASN 56 -3.713 -6.577 -9.404 399 H LEU 57 H LEU 57 -0.216 -4.181 -7.834 400 HA LEU 57 HA LEU 57 1.763 -3.385 -9.861 401 HB2 LEU 57 HB2 LEU 57 2.137 -3.918 -6.894 402 HB3 LEU 57 HB1 LEU 57 3.464 -3.828 -8.030 403 HG LEU 57 HG LEU 57 1.794 -1.676 -6.879 404 HD11 LEU 57 HD11 LEU 57 4.095 -2.155 -6.160 405 HD12 LEU 57 HD12 LEU 57 3.903 -0.530 -6.813 406 HD13 LEU 57 HD13 LEU 57 4.656 -1.791 -7.788 407 HD21 LEU 57 HD21 LEU 57 1.281 -1.447 -9.232 408 HD22 LEU 57 HD22 LEU 57 3.002 -1.479 -9.620 409 HD23 LEU 57 HD23 LEU 57 2.335 -0.148 -8.675 410 HA PRO 58 HA PRO 58 2.340 -7.676 -10.688 411 HB2 PRO 58 HB2 PRO 58 5.074 -7.763 -11.022 412 HB3 PRO 58 HB1 PRO 58 3.929 -7.258 -12.267 413 HG2 PRO 58 HG2 PRO 58 5.658 -5.612 -10.498 414 HG3 PRO 58 HG1 PRO 58 5.150 -5.315 -12.168 415 HD2 PRO 58 HD2 PRO 58 4.066 -4.046 -10.004 416 HD3 PRO 58 HD1 PRO 58 3.187 -4.315 -11.518 417 H GLU 59 H GLU 59 2.914 -9.530 -9.686 418 HA GLU 59 HA GLU 59 3.146 -9.812 -6.996 419 HB2 GLU 59 HB2 GLU 59 4.039 -12.084 -7.432 420 HB3 GLU 59 HB1 GLU 59 2.660 -11.681 -8.445 421 HG2 GLU 59 HG2 GLU 59 4.083 -11.288 -10.329 422 HG3 GLU 59 HG1 GLU 59 5.525 -11.465 -9.335 423 H THR 60 H THR 60 5.723 -9.052 -9.166 424 HA THR 60 HA THR 60 7.751 -9.630 -7.134 425 HB THR 60 HB THR 60 8.119 -10.661 -9.312 426 HG1 THR 60 HG1 THR 60 10.072 -10.245 -8.487 427 HG21 THR 60 HG21 THR 60 6.930 -9.091 -10.719 428 HG22 THR 60 HG22 THR 60 8.584 -9.283 -11.299 429 HG23 THR 60 HG23 THR 60 8.131 -7.844 -10.386 430 H ALA 61 H ALA 61 5.861 -7.152 -7.598 431 HA ALA 61 HA ALA 61 7.795 -5.006 -7.864 432 HB1 ALA 61 HB1 ALA 61 5.550 -4.673 -8.733 433 HB2 ALA 61 HB2 ALA 61 5.878 -3.522 -7.437 434 HB3 ALA 61 HB3 ALA 61 4.871 -4.937 -7.129 435 H ASN 62 H ASN 62 8.021 -3.360 -6.136 436 HA ASN 62 HA ASN 62 7.556 -4.389 -3.448 437 HB2 ASN 62 HB2 ASN 62 9.880 -4.165 -2.777 438 HB3 ASN 62 HB1 ASN 62 9.735 -5.320 -4.095 439 HD21 ASN 62 HD21 ASN 62 12.017 -3.742 -3.168 440 HD22 ASN 62 HD22 ASN 62 12.564 -2.851 -4.545 441 H SER 63 H SER 63 6.896 -1.922 -5.232 442 HA SER 63 HA SER 63 6.985 -0.060 -3.075 443 HB2 SER 63 HB2 SER 63 8.455 1.625 -4.303 444 HB3 SER 63 HB1 SER 63 9.296 0.229 -3.629 445 HG SER 63 HG SER 63 8.619 -0.518 -6.023 446 H VAL 64 H VAL 64 5.439 1.463 -3.348 447 HA VAL 64 HA VAL 64 4.442 1.964 -6.078 448 HB VAL 64 HB VAL 64 2.663 0.777 -4.956 449 HG11 VAL 64 HG11 VAL 64 3.642 1.670 -2.654 450 HG12 VAL 64 HG12 VAL 64 2.023 1.022 -2.847 451 HG13 VAL 64 HG13 VAL 64 2.275 2.768 -2.846 452 HG21 VAL 64 HG21 VAL 64 0.896 2.392 -5.002 453 HG22 VAL 64 HG22 VAL 64 1.994 2.562 -6.367 454 HG23 VAL 64 HG23 VAL 64 2.082 3.697 -5.018 455 H THR 65 H THR 65 4.385 4.061 -6.710 456 HA THR 65 HA THR 65 4.866 6.143 -4.735 457 HB THR 65 HB THR 65 4.858 6.075 -7.737 458 HG1 THR 65 HG1 THR 65 6.695 5.361 -6.159 459 HG21 THR 65 HG21 THR 65 4.003 8.254 -7.029 460 HG22 THR 65 HG22 THR 65 5.641 8.428 -7.659 461 HG23 THR 65 HG23 THR 65 5.359 8.447 -5.919 462 H LEU 66 H LEU 66 2.998 6.579 -3.749 463 HA LEU 66 HA LEU 66 0.449 6.629 -5.076 464 HB2 LEU 66 HB2 LEU 66 0.680 7.981 -2.501 465 HB3 LEU 66 HB1 LEU 66 -0.426 6.723 -3.007 466 HG LEU 66 HG LEU 66 2.421 6.080 -2.346 467 HD11 LEU 66 HD11 LEU 66 0.220 5.876 -0.368 468 HD12 LEU 66 HD12 LEU 66 1.183 7.342 -0.521 469 HD13 LEU 66 HD13 LEU 66 1.969 5.815 -0.132 470 HD21 LEU 66 HD21 LEU 66 -0.154 4.532 -2.376 471 HD22 LEU 66 HD22 LEU 66 1.406 3.884 -1.855 472 HD23 LEU 66 HD23 LEU 66 1.169 4.386 -3.533 473 H SER 67 H SER 67 -0.707 8.448 -5.670 474 HA SER 67 HA SER 67 0.696 11.008 -5.453 475 HB2 SER 67 HB2 SER 67 1.291 9.914 -7.626 476 HB3 SER 67 HB1 SER 67 -0.418 9.924 -8.050 477 HG SER 67 HG SER 67 1.411 11.937 -8.177 478 H ASP 68 H ASP 68 -0.746 12.790 -6.331 479 HA ASP 68 HA ASP 68 -2.606 14.052 -6.112 480 HB2 ASP 68 HB2 ASP 68 -4.018 11.416 -6.559 481 HB3 ASP 68 HB1 ASP 68 -4.823 12.980 -6.532 482 H LEU 69 H LEU 69 -1.381 12.727 -3.741 483 HA LEU 69 HA LEU 69 -3.448 12.173 -1.871 484 HB2 LEU 69 HB2 LEU 69 -0.793 13.311 -1.038 485 HB3 LEU 69 HB1 LEU 69 -1.847 12.212 -0.175 486 HG LEU 69 HG LEU 69 -0.199 11.465 -2.578 487 HD11 LEU 69 HD11 LEU 69 1.123 10.227 -0.941 488 HD12 LEU 69 HD12 LEU 69 0.149 10.913 0.361 489 HD13 LEU 69 HD13 LEU 69 1.160 11.963 -0.632 490 HD21 LEU 69 HD21 LEU 69 -2.160 10.070 -0.800 491 HD22 LEU 69 HD22 LEU 69 -0.853 9.149 -1.552 492 HD23 LEU 69 HD23 LEU 69 -2.032 10.003 -2.560 493 H GLN 70 H GLN 70 -3.218 13.701 0.287 494 HA GLN 70 HA GLN 70 -3.645 16.458 -0.624 495 HB2 GLN 70 HB2 GLN 70 -5.794 15.288 -0.149 496 HB3 GLN 70 HB1 GLN 70 -5.257 15.028 1.503 497 HG2 GLN 70 HG2 GLN 70 -6.718 16.877 1.547 498 HG3 GLN 70 HG1 GLN 70 -5.089 17.525 1.730 499 HE21 GLN 70 HE21 GLN 70 -7.824 17.194 -0.399 500 HE22 GLN 70 HE22 GLN 70 -7.360 18.433 -1.510 501 HA PRO 71 HA PRO 71 -0.288 16.978 2.241 502 HB2 PRO 71 HB2 PRO 71 -0.404 19.716 2.296 503 HB3 PRO 71 HB1 PRO 71 0.428 18.754 1.066 504 HG2 PRO 71 HG2 PRO 71 -2.273 20.037 0.970 505 HG3 PRO 71 HG1 PRO 71 -1.034 19.929 -0.296 506 HD2 PRO 71 HD2 PRO 71 -3.186 18.326 -0.282 507 HD3 PRO 71 HD1 PRO 71 -1.601 17.755 -0.842 508 H GLY 72 H GLY 72 -0.223 16.966 4.395 509 HA2 GLY 72 HA2 GLY 72 -0.664 17.663 6.572 510 HA3 GLY 72 HA1 GLY 72 -1.938 18.708 5.957 511 H VAL 73 H VAL 73 -1.809 15.407 4.974 512 HA VAL 73 HA VAL 73 -4.034 14.758 6.789 513 HB VAL 73 HB VAL 73 -3.925 14.057 3.848 514 HG11 VAL 73 HG11 VAL 73 -5.114 12.319 4.798 515 HG12 VAL 73 HG12 VAL 73 -6.376 13.495 4.384 516 HG13 VAL 73 HG13 VAL 73 -5.808 13.353 6.049 517 HG21 VAL 73 HG21 VAL 73 -6.097 15.406 3.896 518 HG22 VAL 73 HG22 VAL 73 -4.557 16.273 3.820 519 HG23 VAL 73 HG23 VAL 73 -5.429 16.146 5.352 520 H GLN 74 H GLN 74 -4.223 12.646 7.399 521 HA GLN 74 HA GLN 74 -1.765 11.146 7.403 522 HB2 GLN 74 HB2 GLN 74 -3.749 11.595 9.206 523 HB3 GLN 74 HB1 GLN 74 -4.208 10.011 8.599 524 HG2 GLN 74 HG2 GLN 74 -1.488 10.672 9.677 525 HG3 GLN 74 HG1 GLN 74 -2.783 9.958 10.634 526 HE21 GLN 74 HE21 GLN 74 -0.461 9.457 8.109 527 HE22 GLN 74 HE22 GLN 74 -0.612 7.738 8.045 528 H TYR 75 H TYR 75 -1.323 9.605 5.947 529 HA TYR 75 HA TYR 75 -3.588 8.455 4.462 530 HB2 TYR 75 HB2 TYR 75 -0.928 9.442 3.566 531 HB3 TYR 75 HB1 TYR 75 -1.606 8.041 2.732 532 HD1 TYR 75 HD2 TYR 75 -3.647 8.225 1.434 533 HD2 TYR 75 HD1 TYR 75 -1.992 11.629 3.372 534 HE1 TYR 75 HE2 TYR 75 -5.107 9.682 0.104 535 HE2 TYR 75 HE1 TYR 75 -3.453 13.096 2.045 536 HH TYR 75 HH TYR 75 -4.705 13.046 -0.072 537 H ASN 76 H ASN 76 -3.984 6.470 5.021 538 HA ASN 76 HA ASN 76 -1.897 4.722 6.026 539 HB2 ASN 76 HB2 ASN 76 -4.868 4.310 5.635 540 HB3 ASN 76 HB1 ASN 76 -3.785 3.071 6.254 541 HD21 ASN 76 HD21 ASN 76 -3.606 6.500 7.018 542 HD22 ASN 76 HD22 ASN 76 -4.002 6.332 8.691 543 H ILE 77 H ILE 77 -0.634 3.737 4.579 544 HA ILE 77 HA ILE 77 -1.746 2.913 2.002 545 HB ILE 77 HB ILE 77 1.102 2.718 2.995 546 HG12 ILE 77 HG12 ILE 77 1.337 4.408 1.028 547 HG13 ILE 77 HG11 ILE 77 -0.325 4.792 1.394 548 HG21 ILE 77 HG21 ILE 77 -0.213 1.879 0.472 549 HG22 ILE 77 HG22 ILE 77 1.099 1.102 1.375 550 HG23 ILE 77 HG23 ILE 77 1.414 2.551 0.404 551 HD11 ILE 77 HD11 ILE 77 1.992 4.967 3.303 552 HD12 ILE 77 HD12 ILE 77 0.311 5.335 3.693 553 HD13 ILE 77 HD13 ILE 77 1.180 6.318 2.513 554 H THR 78 H THR 78 -2.671 1.044 1.917 555 HA THR 78 HA THR 78 -1.732 -1.092 3.672 556 HB THR 78 HB THR 78 -4.350 -0.781 2.212 557 HG1 THR 78 HG1 THR 78 -4.205 -0.698 4.998 558 HG21 THR 78 HG21 THR 78 -3.470 -2.759 4.327 559 HG22 THR 78 HG22 THR 78 -3.781 -3.127 2.630 560 HG23 THR 78 HG23 THR 78 -5.105 -2.621 3.680 561 H ILE 79 H ILE 79 -0.458 -2.557 2.691 562 HA ILE 79 HA ILE 79 -0.639 -2.854 -0.239 563 HB ILE 79 HB ILE 79 1.417 -4.261 1.474 564 HG12 ILE 79 HG12 ILE 79 1.959 -1.988 1.916 565 HG13 ILE 79 HG11 ILE 79 3.038 -2.544 0.637 566 HG21 ILE 79 HG21 ILE 79 1.174 -3.619 -1.433 567 HG22 ILE 79 HG22 ILE 79 1.326 -5.201 -0.657 568 HG23 ILE 79 HG23 ILE 79 2.700 -4.084 -0.684 569 HD11 ILE 79 HD11 ILE 79 2.061 -1.241 -0.956 570 HD12 ILE 79 HD12 ILE 79 1.967 -0.219 0.493 571 HD13 ILE 79 HD13 ILE 79 0.543 -1.096 -0.061 572 H TYR 80 H TYR 80 -1.116 -4.788 -1.210 573 HA TYR 80 HA TYR 80 -1.982 -6.995 0.537 574 HB2 TYR 80 HB2 TYR 80 -3.350 -6.084 -2.003 575 HB3 TYR 80 HB1 TYR 80 -3.859 -7.402 -0.964 576 HD1 TYR 80 HD1 TYR 80 -3.716 -3.726 -1.338 577 HD2 TYR 80 HD2 TYR 80 -5.092 -6.987 1.049 578 HE1 TYR 80 HE1 TYR 80 -5.247 -2.222 -0.152 579 HE2 TYR 80 HE2 TYR 80 -6.619 -5.474 2.238 580 HH TYR 80 HH TYR 80 -6.821 -3.053 2.720 581 H ALA 81 H ALA 81 -0.514 -8.598 0.094 582 HA ALA 81 HA ALA 81 0.406 -9.075 -2.605 583 HB1 ALA 81 HB1 ALA 81 0.626 -10.755 -0.085 584 HB2 ALA 81 HB2 ALA 81 1.892 -9.780 -0.826 585 HB3 ALA 81 HB3 ALA 81 1.308 -11.239 -1.649 586 H VAL 82 H VAL 82 -0.781 -10.074 -4.102 587 HA VAL 82 HA VAL 82 -3.090 -11.646 -3.116 588 HB VAL 82 HB VAL 82 -3.862 -9.734 -4.418 589 HG11 VAL 82 HG11 VAL 82 -2.273 -10.853 -6.694 590 HG12 VAL 82 HG12 VAL 82 -1.957 -9.346 -5.836 591 HG13 VAL 82 HG13 VAL 82 -3.425 -9.523 -6.793 592 HG21 VAL 82 HG21 VAL 82 -4.191 -12.270 -6.000 593 HG22 VAL 82 HG22 VAL 82 -5.279 -10.875 -5.998 594 HG23 VAL 82 HG23 VAL 82 -5.105 -11.859 -4.543 595 H GLU 83 H GLU 83 -3.345 -13.703 -3.737 596 HA GLU 83 HA GLU 83 -1.287 -14.786 -5.533 597 HB2 GLU 83 HB2 GLU 83 -2.682 -16.417 -3.416 598 HB3 GLU 83 HB1 GLU 83 -1.227 -16.771 -4.322 599 HG2 GLU 83 HG2 GLU 83 -0.521 -16.326 -2.168 600 HG3 GLU 83 HG1 GLU 83 -0.109 -14.938 -3.154 601 H GLU 84 H GLU 84 -2.099 -16.990 -6.421 602 HA GLU 84 HA GLU 84 -3.739 -16.505 -8.468 603 HB2 GLU 84 HB2 GLU 84 -3.592 -19.161 -7.050 604 HB3 GLU 84 HB1 GLU 84 -4.079 -18.905 -8.721 605 HG2 GLU 84 HG2 GLU 84 -1.827 -17.982 -9.185 606 HG3 GLU 84 HG1 GLU 84 -1.361 -18.397 -7.536 607 H ASN 85 H ASN 85 -4.978 -17.993 -5.441 608 HA ASN 85 HA ASN 85 -7.666 -17.198 -6.357 609 HB2 ASN 85 HB2 ASN 85 -6.865 -19.781 -5.011 610 HB3 ASN 85 HB1 ASN 85 -8.532 -19.259 -5.209 611 HD21 ASN 85 HD21 ASN 85 -8.037 -18.098 -7.847 612 HD22 ASN 85 HD22 ASN 85 -7.896 -19.440 -8.927 613 H GLN 86 H GLN 86 -5.478 -16.355 -4.177 614 HA GLN 86 HA GLN 86 -7.465 -15.859 -2.122 615 HB2 GLN 86 HB2 GLN 86 -6.130 -16.781 -0.358 616 HB3 GLN 86 HB1 GLN 86 -6.358 -17.997 -1.603 617 HG2 GLN 86 HG2 GLN 86 -3.885 -16.357 -1.644 618 HG3 GLN 86 HG1 GLN 86 -4.038 -17.645 -0.457 619 HE21 GLN 86 HE21 GLN 86 -2.393 -18.837 -1.337 620 HE22 GLN 86 HE22 GLN 86 -2.539 -19.683 -2.832 621 H GLU 87 H GLU 87 -6.289 -14.567 -0.263 622 HA GLU 87 HA GLU 87 -4.417 -12.623 -1.421 623 HB2 GLU 87 HB2 GLU 87 -6.987 -11.969 0.033 624 HB3 GLU 87 HB1 GLU 87 -5.723 -10.796 -0.312 625 HG2 GLU 87 HG2 GLU 87 -6.076 -10.986 -2.651 626 HG3 GLU 87 HG1 GLU 87 -7.144 -12.373 -2.437 627 H SER 88 H SER 88 -2.784 -12.165 -0.060 628 HA SER 88 HA SER 88 -2.722 -13.460 2.495 629 HB2 SER 88 HB2 SER 88 -0.745 -11.612 1.152 630 HB3 SER 88 HB1 SER 88 -0.447 -12.464 2.667 631 HG SER 88 HG SER 88 -0.790 -13.514 0.061 632 H THR 89 H THR 89 -1.690 -12.110 4.354 633 HA THR 89 HA THR 89 -3.630 -10.346 5.322 634 HB THR 89 HB THR 89 -1.491 -9.772 6.878 635 HG1 THR 89 HG1 THR 89 0.083 -11.158 6.580 636 HG21 THR 89 HG21 THR 89 -3.589 -10.746 7.652 637 HG22 THR 89 HG22 THR 89 -2.216 -11.636 8.312 638 HG23 THR 89 HG23 THR 89 -3.136 -12.305 6.964 639 HA PRO 90 HA PRO 90 -2.329 -6.527 3.599 640 HB2 PRO 90 HB2 PRO 90 -3.616 -4.800 5.174 641 HB3 PRO 90 HB1 PRO 90 -4.491 -5.937 4.142 642 HG2 PRO 90 HG2 PRO 90 -3.972 -6.059 7.079 643 HG3 PRO 90 HG1 PRO 90 -5.423 -6.521 6.175 644 HD2 PRO 90 HD2 PRO 90 -3.466 -8.267 7.081 645 HD3 PRO 90 HD1 PRO 90 -4.653 -8.612 5.811 646 H VAL 91 H VAL 91 -0.666 -5.204 3.654 647 HA VAL 91 HA VAL 91 0.910 -4.589 6.009 648 HB VAL 91 HB VAL 91 0.874 -3.594 3.166 649 HG11 VAL 91 HG11 VAL 91 2.676 -2.097 3.677 650 HG12 VAL 91 HG12 VAL 91 2.721 -2.649 5.347 651 HG13 VAL 91 HG13 VAL 91 1.332 -1.741 4.754 652 HG21 VAL 91 HG21 VAL 91 3.033 -4.992 4.731 653 HG22 VAL 91 HG22 VAL 91 3.077 -4.545 3.022 654 HG23 VAL 91 HG23 VAL 91 1.939 -5.774 3.586 655 H VAL 92 H VAL 92 0.210 -2.971 7.424 656 HA VAL 92 HA VAL 92 -1.171 -0.722 6.119 657 HB VAL 92 HB VAL 92 -1.489 -1.424 9.035 658 HG11 VAL 92 HG11 VAL 92 -2.974 0.425 7.173 659 HG12 VAL 92 HG12 VAL 92 -1.913 0.896 8.503 660 HG13 VAL 92 HG13 VAL 92 -3.442 0.083 8.840 661 HG21 VAL 92 HG21 VAL 92 -2.395 -3.246 7.678 662 HG22 VAL 92 HG22 VAL 92 -3.341 -2.086 6.745 663 HG23 VAL 92 HG23 VAL 92 -3.686 -2.332 8.455 664 H ILE 93 H ILE 93 0.355 0.702 5.776 665 HA ILE 93 HA ILE 93 2.007 1.537 8.062 666 HB ILE 93 HB ILE 93 3.658 2.377 6.305 667 HG12 ILE 93 HG12 ILE 93 2.365 0.359 4.504 668 HG13 ILE 93 HG11 ILE 93 1.935 2.048 4.439 669 HG21 ILE 93 HG21 ILE 93 4.733 0.200 6.073 670 HG22 ILE 93 HG22 ILE 93 3.229 -0.596 6.539 671 HG23 ILE 93 HG23 ILE 93 4.084 0.423 7.697 672 HD11 ILE 93 HD11 ILE 93 4.320 2.585 4.071 673 HD12 ILE 93 HD12 ILE 93 3.566 1.641 2.775 674 HD13 ILE 93 HD13 ILE 93 4.628 0.851 3.944 675 H GLN 94 H GLN 94 1.273 3.418 8.786 676 HA GLN 94 HA GLN 94 -0.177 5.098 6.885 677 HB2 GLN 94 HB2 GLN 94 -1.274 6.110 8.821 678 HB3 GLN 94 HB1 GLN 94 -1.484 4.366 8.791 679 HG2 GLN 94 HG2 GLN 94 0.357 4.172 10.451 680 HG3 GLN 94 HG1 GLN 94 0.383 5.931 10.554 681 HE21 GLN 94 HE21 GLN 94 -1.379 3.042 11.287 682 HE22 GLN 94 HE22 GLN 94 -2.518 3.759 12.375 683 H GLN 95 H GLN 95 0.843 6.689 6.057 684 HA GLN 95 HA GLN 95 2.804 8.166 7.678 685 HB2 GLN 95 HB2 GLN 95 3.063 6.951 5.096 686 HB3 GLN 95 HB1 GLN 95 3.200 8.692 4.913 687 HG2 GLN 95 HG2 GLN 95 4.845 6.943 6.724 688 HG3 GLN 95 HG1 GLN 95 5.377 7.701 5.225 689 HE21 GLN 95 HE21 GLN 95 3.941 10.203 5.815 690 HE22 GLN 95 HE22 GLN 95 4.872 10.995 7.038 691 H GLU 96 H GLU 96 2.286 10.205 8.081 692 HA GLU 96 HA GLU 96 0.042 11.406 6.673 693 HB2 GLU 96 HB2 GLU 96 0.020 11.605 9.067 694 HB3 GLU 96 HB1 GLU 96 1.641 12.275 9.084 695 HG2 GLU 96 HG2 GLU 96 0.847 14.289 8.012 696 HG3 GLU 96 HG1 GLU 96 -0.773 13.605 7.875 697 H THR 97 H THR 97 0.213 12.937 5.196 698 HA THR 97 HA THR 97 2.678 13.386 3.910 699 HB THR 97 HB THR 97 1.388 15.063 2.571 700 HG1 THR 97 HG1 THR 97 -1.065 14.475 3.415 701 HG21 THR 97 HG21 THR 97 -0.041 12.435 2.990 702 HG22 THR 97 HG22 THR 97 1.406 12.648 2.007 703 HG23 THR 97 HG23 THR 97 -0.100 13.443 1.542 704 H THR 98 H THR 98 4.024 15.132 3.878 705 HA THR 98 HA THR 98 4.359 16.452 6.355 706 HB THR 98 HB THR 98 5.701 17.240 3.775 707 HG1 THR 98 HG1 THR 98 6.247 14.994 5.456 708 HG21 THR 98 HG21 THR 98 6.669 17.134 6.637 709 HG22 THR 98 HG22 THR 98 6.212 18.591 5.758 710 HG23 THR 98 HG23 THR 98 7.619 17.659 5.249 711 H GLY 99 H GLY 99 3.029 17.414 3.254 712 HA2 GLY 99 HA2 GLY 99 1.663 19.156 2.685 713 HA3 GLY 99 HA1 GLY 99 1.278 19.270 4.383 714 H THR 100 H THR 100 3.258 20.431 1.812 715 HA THR 100 HA THR 100 4.710 22.309 3.464 716 HB THR 100 HB THR 100 4.571 22.307 0.455 717 HG1 THR 100 HG1 THR 100 5.135 20.202 1.002 718 HG21 THR 100 HG21 THR 100 5.661 24.202 1.477 719 HG22 THR 100 HG22 THR 100 6.832 23.186 0.644 720 HG23 THR 100 HG23 THR 100 6.708 23.129 2.401 721 HA PRO 101 HA PRO 101 1.318 25.280 3.427 722 HB2 PRO 101 HB2 PRO 101 3.617 27.082 4.025 723 HB3 PRO 101 HB1 PRO 101 2.061 26.934 4.849 724 HG2 PRO 101 HG2 PRO 101 4.282 25.917 5.917 725 HG3 PRO 101 HG1 PRO 101 2.727 25.079 6.061 726 HD2 PRO 101 HD2 PRO 101 5.066 24.456 4.323 727 HD3 PRO 101 HD1 PRO 101 3.899 23.359 5.088 728 H ARG 102 H ARG 102 0.638 25.768 1.434 729 HA ARG 102 HA ARG 102 0.504 26.645 -0.648 730 HB2 ARG 102 HB2 ARG 102 2.802 28.345 0.332 731 HB3 ARG 102 HB1 ARG 102 2.035 28.560 -1.237 732 HG2 ARG 102 HG2 ARG 102 -0.056 29.114 -0.206 733 HG3 ARG 102 HG1 ARG 102 0.579 28.715 1.391 734 HD2 ARG 102 HD2 ARG 102 2.079 30.564 1.340 735 HD3 ARG 102 HD1 ARG 102 1.726 30.880 -0.359 736 HE ARG 102 HE ARG 102 -0.410 31.706 0.262 737 HH11 ARG 102 HH11 ARG 102 1.671 30.986 3.002 738 HH12 ARG 102 HH12 ARG 102 0.746 31.947 4.115 739 HH21 ARG 102 HH21 ARG 102 -1.620 32.968 1.737 740 HH22 ARG 102 HH22 ARG 102 -1.116 33.070 3.395 741 H SER 103 H SER 103 1.187 24.396 -1.080 742 HA SER 103 HA SER 103 3.795 23.613 -1.660 743 HB2 SER 103 HB2 SER 103 1.433 22.534 -3.177 744 HB3 SER 103 HB1 SER 103 2.835 21.668 -2.548 745 HG SER 103 HG SER 103 1.865 21.444 -0.677 746 H ASP 104 H ASP 104 1.272 24.880 -3.818 747 HA ASP 104 HA ASP 104 3.391 25.642 -5.709 748 HB2 ASP 104 HB2 ASP 104 2.218 23.675 -6.600 749 HB3 ASP 104 HB1 ASP 104 0.681 24.516 -6.441 750 H GLY 105 H GLY 105 3.463 27.770 -5.777 751 HA2 GLY 105 HA2 GLY 105 2.775 29.951 -6.050 752 HA3 GLY 105 HA1 GLY 105 1.157 29.346 -6.384 753 H THR 106 H THR 106 -0.352 29.816 -4.947 754 HA THR 106 HA THR 106 0.343 29.908 -2.125 755 HB THR 106 HB THR 106 0.543 32.238 -2.774 756 HG1 THR 106 HG1 THR 106 -1.796 32.698 -1.574 757 HG21 THR 106 HG21 THR 106 -0.803 32.279 -4.781 758 HG22 THR 106 HG22 THR 106 -1.402 33.493 -3.648 759 HG23 THR 106 HG23 THR 106 -2.265 31.968 -3.846 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 -10.174 -29.889 3.582 2 H2 GLY 1 HT2 GLY 1 -9.151 -30.579 2.425 3 H3 GLY 1 HT3 GLY 1 -8.535 -29.481 3.552 4 HA2 GLY 1 HA1 GLY 1 -8.978 -31.006 5.354 5 HA3 GLY 1 HA2 GLY 1 -9.661 -32.143 4.203 6 H SER 2 H SER 2 -7.989 -33.537 5.238 7 HA SER 2 HA SER 2 -5.231 -33.011 4.699 8 HB2 SER 2 HB2 SER 2 -6.574 -35.587 5.551 9 HB3 SER 2 HB1 SER 2 -4.849 -35.234 5.641 10 HG SER 2 HG SER 2 -6.627 -34.770 7.487 11 H HIS 3 H HIS 3 -7.776 -34.873 3.150 12 HA HIS 3 HA HIS 3 -6.064 -36.288 1.361 13 HB2 HIS 3 HB2 HIS 3 -8.280 -37.150 1.894 14 HB3 HIS 3 HB1 HIS 3 -9.034 -35.709 1.228 15 HD1 HIS 3 HD1 HIS 3 -7.369 -38.908 0.216 16 HD2 HIS 3 HD2 HIS 3 -9.281 -35.667 -1.552 17 HE1 HIS 3 HE1 HIS 3 -7.770 -39.579 -2.176 18 HE2 HIS 3 HE2 HIS 3 -8.918 -37.598 -3.231 19 H MET 4 H MET 4 -7.917 -33.299 1.177 20 HA MET 4 HA MET 4 -6.144 -32.361 -0.906 21 HB2 MET 4 HB2 MET 4 -7.897 -33.402 -2.235 22 HB3 MET 4 HB1 MET 4 -9.131 -32.526 -1.341 23 HG2 MET 4 HG2 MET 4 -8.668 -31.575 -3.569 24 HG3 MET 4 HG1 MET 4 -8.403 -30.437 -2.252 25 HE1 MET 4 HE1 MET 4 -5.994 -33.389 -3.278 26 HE2 MET 4 HE2 MET 4 -4.980 -32.592 -4.479 27 HE3 MET 4 HE3 MET 4 -6.688 -32.864 -4.811 28 H GLY 5 H GLY 5 -5.625 -30.340 -0.504 29 HA2 GLY 5 HA2 GLY 5 -7.538 -28.438 0.513 30 HA3 GLY 5 HA1 GLY 5 -6.281 -28.867 1.666 31 H THR 6 H THR 6 -6.762 -27.722 -1.649 32 HA THR 6 HA THR 6 -4.001 -26.833 -1.765 33 HB THR 6 HB THR 6 -5.097 -28.002 -3.687 34 HG1 THR 6 HG1 THR 6 -4.395 -25.482 -4.682 35 HG21 THR 6 HG21 THR 6 -6.557 -26.688 -5.174 36 HG22 THR 6 HG22 THR 6 -6.607 -25.402 -3.966 37 HG23 THR 6 HG23 THR 6 -7.299 -26.983 -3.602 38 H THR 7 H THR 7 -6.041 -25.544 0.002 39 HA THR 7 HA THR 7 -6.359 -22.879 -1.039 40 HB THR 7 HB THR 7 -6.674 -23.841 1.814 41 HG1 THR 7 HG1 THR 7 -8.303 -24.024 -0.446 42 HG21 THR 7 HG21 THR 7 -8.102 -21.865 2.073 43 HG22 THR 7 HG22 THR 7 -7.764 -21.399 0.406 44 HG23 THR 7 HG23 THR 7 -6.465 -21.406 1.599 45 H THR 8 H THR 8 -4.412 -21.974 -1.472 46 HA THR 8 HA THR 8 -2.104 -22.255 0.147 47 HB THR 8 HB THR 8 -2.677 -20.092 -1.888 48 HG1 THR 8 HG1 THR 8 -2.454 -21.585 -3.374 49 HG21 THR 8 HG21 THR 8 -0.081 -21.302 -0.924 50 HG22 THR 8 HG22 THR 8 -0.682 -19.694 -0.521 51 HG23 THR 8 HG23 THR 8 -0.243 -20.081 -2.186 52 H ALA 9 H ALA 9 -1.414 -21.093 1.858 53 HA ALA 9 HA ALA 9 -2.886 -18.630 2.526 54 HB1 ALA 9 HB1 ALA 9 -2.328 -19.025 4.850 55 HB2 ALA 9 HB2 ALA 9 -1.399 -20.457 4.409 56 HB3 ALA 9 HB3 ALA 9 -3.148 -20.435 4.180 57 HA PRO 10 HA PRO 10 1.343 -17.239 1.564 58 HB2 PRO 10 HB2 PRO 10 0.632 -15.004 0.223 59 HB3 PRO 10 HB1 PRO 10 0.658 -16.599 -0.533 60 HG2 PRO 10 HG2 PRO 10 -1.646 -14.968 0.376 61 HG3 PRO 10 HG1 PRO 10 -1.547 -16.138 -0.950 62 HD2 PRO 10 HD2 PRO 10 -2.643 -16.595 1.584 63 HD3 PRO 10 HD1 PRO 10 -2.263 -17.805 0.399 64 H ASP 11 H ASP 11 2.542 -15.374 2.255 65 HA ASP 11 HA ASP 11 1.258 -14.056 4.547 66 HB2 ASP 11 HB2 ASP 11 4.137 -14.749 3.984 67 HB3 ASP 11 HB1 ASP 11 3.671 -13.632 5.263 68 H ALA 12 H ALA 12 1.647 -11.864 4.950 69 HA ALA 12 HA ALA 12 1.926 -10.244 2.568 70 HB1 ALA 12 HB1 ALA 12 1.382 -8.387 4.064 71 HB2 ALA 12 HB2 ALA 12 1.523 -9.455 5.461 72 HB3 ALA 12 HB3 ALA 12 0.241 -9.714 4.278 73 HA PRO 13 HA PRO 13 6.200 -9.028 3.151 74 HB2 PRO 13 HB2 PRO 13 5.271 -6.263 2.629 75 HB3 PRO 13 HB1 PRO 13 6.495 -7.212 1.780 76 HG2 PRO 13 HG2 PRO 13 4.129 -6.740 0.664 77 HG3 PRO 13 HG1 PRO 13 4.921 -8.318 0.479 78 HD2 PRO 13 HD2 PRO 13 2.684 -7.515 2.299 79 HD3 PRO 13 HD1 PRO 13 2.877 -9.002 1.344 80 HA PRO 14 HA PRO 14 6.277 -7.563 7.443 81 HB2 PRO 14 HB2 PRO 14 9.047 -6.953 6.491 82 HB3 PRO 14 HB1 PRO 14 8.522 -7.719 7.995 83 HG2 PRO 14 HG2 PRO 14 9.519 -9.187 6.024 84 HG3 PRO 14 HG1 PRO 14 8.137 -9.766 6.971 85 HD2 PRO 14 HD2 PRO 14 8.209 -8.667 4.204 86 HD3 PRO 14 HD1 PRO 14 7.160 -9.918 4.896 87 H ASP 15 H ASP 15 6.301 -5.573 8.397 88 HA ASP 15 HA ASP 15 4.969 -3.608 7.205 89 HB2 ASP 15 HB2 ASP 15 7.033 -3.292 9.376 90 HB3 ASP 15 HB1 ASP 15 5.912 -2.016 8.911 91 HA PRO 16 HA PRO 16 7.870 -2.036 4.136 92 HB2 PRO 16 HB2 PRO 16 5.406 -0.607 3.317 93 HB3 PRO 16 HB1 PRO 16 6.472 -1.648 2.339 94 HG2 PRO 16 HG2 PRO 16 4.085 -2.523 3.089 95 HG3 PRO 16 HG1 PRO 16 5.486 -3.604 3.165 96 HD2 PRO 16 HD2 PRO 16 4.194 -2.053 5.394 97 HD3 PRO 16 HD1 PRO 16 4.638 -3.780 5.356 98 H THR 17 H THR 17 8.771 -0.056 3.749 99 HA THR 17 HA THR 17 8.102 2.023 5.739 100 HB THR 17 HB THR 17 10.803 1.596 4.453 101 HG1 THR 17 HG1 THR 17 10.539 0.834 7.085 102 HG21 THR 17 HG21 THR 17 10.417 3.802 5.440 103 HG22 THR 17 HG22 THR 17 11.598 2.891 6.381 104 HG23 THR 17 HG23 THR 17 9.940 3.044 6.960 105 H VAL 18 H VAL 18 7.574 3.885 5.092 106 HA VAL 18 HA VAL 18 7.455 4.586 2.304 107 HB VAL 18 HB VAL 18 6.864 6.205 4.786 108 HG11 VAL 18 HG11 VAL 18 5.757 7.802 3.268 109 HG12 VAL 18 HG12 VAL 18 6.387 6.908 1.878 110 HG13 VAL 18 HG13 VAL 18 7.495 7.713 2.995 111 HG21 VAL 18 HG21 VAL 18 5.368 4.275 4.350 112 HG22 VAL 18 HG22 VAL 18 4.989 4.974 2.775 113 HG23 VAL 18 HG23 VAL 18 4.548 5.835 4.248 114 H ASP 19 H ASP 19 9.001 5.427 1.152 115 HA ASP 19 HA ASP 19 11.473 6.271 2.468 116 HB2 ASP 19 HB2 ASP 19 11.611 4.532 0.743 117 HB3 ASP 19 HB1 ASP 19 10.880 5.618 -0.430 118 H GLN 20 H GLN 20 8.872 7.525 0.545 119 HA GLN 20 HA GLN 20 10.087 10.196 0.656 120 HB2 GLN 20 HB2 GLN 20 8.772 8.944 -1.758 121 HB3 GLN 20 HB1 GLN 20 9.133 10.656 -1.614 122 HG2 GLN 20 HG2 GLN 20 11.517 10.124 -1.436 123 HG3 GLN 20 HG1 GLN 20 11.137 8.412 -1.622 124 HE21 GLN 20 HE21 GLN 20 12.346 8.255 -3.510 125 HE22 GLN 20 HE22 GLN 20 11.829 8.926 -4.990 126 H VAL 21 H VAL 21 8.734 11.729 1.327 127 HA VAL 21 HA VAL 21 5.850 11.178 1.237 128 HB VAL 21 HB VAL 21 7.156 12.529 3.589 129 HG11 VAL 21 HG11 VAL 21 4.452 11.243 3.358 130 HG12 VAL 21 HG12 VAL 21 4.755 12.955 3.082 131 HG13 VAL 21 HG13 VAL 21 5.057 12.253 4.673 132 HG21 VAL 21 HG21 VAL 21 6.356 9.632 3.365 133 HG22 VAL 21 HG22 VAL 21 6.841 10.449 4.851 134 HG23 VAL 21 HG23 VAL 21 7.997 10.255 3.534 135 H ASP 22 H ASP 22 5.207 12.635 -0.252 136 HA ASP 22 HA ASP 22 6.033 15.443 0.119 137 HB2 ASP 22 HB2 ASP 22 5.060 13.985 -2.347 138 HB3 ASP 22 HB1 ASP 22 5.197 15.735 -2.261 139 H ASP 23 H ASP 23 4.006 16.628 -1.373 140 HA ASP 23 HA ASP 23 1.818 16.644 0.456 141 HB2 ASP 23 HB2 ASP 23 0.813 18.196 -1.304 142 HB3 ASP 23 HB1 ASP 23 2.332 18.702 -0.593 143 H THR 24 H THR 24 1.971 15.902 -2.995 144 HA THR 24 HA THR 24 -0.568 14.431 -2.754 145 HB THR 24 HB THR 24 -0.776 14.967 -5.209 146 HG1 THR 24 HG1 THR 24 1.257 16.901 -4.743 147 HG21 THR 24 HG21 THR 24 -1.367 17.329 -4.844 148 HG22 THR 24 HG22 THR 24 -0.475 17.311 -3.317 149 HG23 THR 24 HG23 THR 24 -1.917 16.311 -3.512 150 H SER 25 H SER 25 1.899 13.206 -2.150 151 HA SER 25 HA SER 25 2.119 11.022 -3.913 152 HB2 SER 25 HB2 SER 25 4.426 12.990 -4.029 153 HB3 SER 25 HB1 SER 25 4.372 11.411 -4.807 154 HG SER 25 HG SER 25 2.228 12.658 -5.625 155 H ILE 26 H ILE 26 2.881 9.372 -2.740 156 HA ILE 26 HA ILE 26 4.975 9.821 -0.740 157 HB ILE 26 HB ILE 26 2.254 8.699 -0.051 158 HG12 ILE 26 HG12 ILE 26 4.007 10.747 1.313 159 HG13 ILE 26 HG11 ILE 26 2.590 11.100 0.334 160 HG21 ILE 26 HG21 ILE 26 3.176 7.936 2.089 161 HG22 ILE 26 HG22 ILE 26 4.796 8.342 1.522 162 HG23 ILE 26 HG23 ILE 26 3.873 7.067 0.720 163 HD11 ILE 26 HD11 ILE 26 2.662 9.669 2.977 164 HD12 ILE 26 HD12 ILE 26 1.224 9.825 1.969 165 HD13 ILE 26 HD13 ILE 26 1.989 11.268 2.636 166 H VAL 27 H VAL 27 6.288 7.936 -0.461 167 HA VAL 27 HA VAL 27 5.560 5.803 -2.374 168 HB VAL 27 HB VAL 27 8.328 6.803 -1.718 169 HG11 VAL 27 HG11 VAL 27 7.311 4.335 -2.919 170 HG12 VAL 27 HG12 VAL 27 8.902 4.693 -2.234 171 HG13 VAL 27 HG13 VAL 27 8.538 5.155 -3.897 172 HG21 VAL 27 HG21 VAL 27 6.718 6.980 -4.261 173 HG22 VAL 27 HG22 VAL 27 8.394 7.490 -4.071 174 HG23 VAL 27 HG23 VAL 27 7.113 8.317 -3.184 175 H VAL 28 H VAL 28 5.510 3.781 -1.600 176 HA VAL 28 HA VAL 28 6.734 3.374 1.042 177 HB VAL 28 HB VAL 28 4.877 2.525 1.938 178 HG11 VAL 28 HG11 VAL 28 2.806 3.392 1.183 179 HG12 VAL 28 HG12 VAL 28 3.479 3.710 -0.414 180 HG13 VAL 28 HG13 VAL 28 4.068 4.600 0.989 181 HG21 VAL 28 HG21 VAL 28 4.992 0.487 0.691 182 HG22 VAL 28 HG22 VAL 28 4.190 1.262 -0.677 183 HG23 VAL 28 HG23 VAL 28 3.308 1.014 0.832 184 H ARG 29 H ARG 29 7.710 1.379 1.408 185 HA ARG 29 HA ARG 29 8.081 -0.286 -1.000 186 HB2 ARG 29 HB2 ARG 29 10.358 0.358 0.865 187 HB3 ARG 29 HB1 ARG 29 10.428 -0.290 -0.769 188 HG2 ARG 29 HG2 ARG 29 9.557 1.917 -1.580 189 HG3 ARG 29 HG1 ARG 29 9.768 2.524 0.062 190 HD2 ARG 29 HD2 ARG 29 11.717 3.160 -1.072 191 HD3 ARG 29 HD1 ARG 29 12.180 1.741 -0.136 192 HE ARG 29 HE ARG 29 11.344 1.019 -2.758 193 HH11 ARG 29 HH11 ARG 29 14.016 2.358 -0.943 194 HH12 ARG 29 HH12 ARG 29 15.215 1.892 -2.107 195 HH21 ARG 29 HH21 ARG 29 12.923 0.410 -4.316 196 HH22 ARG 29 HH22 ARG 29 14.591 0.792 -4.028 197 H TRP 30 H TRP 30 7.719 -2.309 -0.645 198 HA TRP 30 HA TRP 30 7.634 -3.262 2.139 199 HB2 TRP 30 HB2 TRP 30 5.907 -4.896 1.316 200 HB3 TRP 30 HB1 TRP 30 5.410 -3.213 1.247 201 HD1 TRP 30 HD1 TRP 30 6.425 -6.081 -1.022 202 HE1 TRP 30 HE1 TRP 30 5.571 -5.631 -3.396 203 HE3 TRP 30 HE3 TRP 30 4.618 -1.403 -0.289 204 HZ2 TRP 30 HZ2 TRP 30 4.232 -3.568 -4.756 205 HZ3 TRP 30 HZ3 TRP 30 3.527 -0.271 -2.177 206 HH2 TRP 30 HH2 TRP 30 3.334 -1.317 -4.343 207 H SER 31 H SER 31 8.245 -5.407 2.595 208 HA SER 31 HA SER 31 10.271 -6.454 0.770 209 HB2 SER 31 HB2 SER 31 9.675 -7.327 3.606 210 HB3 SER 31 HB1 SER 31 11.129 -7.665 2.667 211 HG SER 31 HG SER 31 10.885 -5.739 4.314 212 H ARG 32 H ARG 32 9.241 -7.648 -0.738 213 HA ARG 32 HA ARG 32 6.835 -8.913 -0.588 214 HB2 ARG 32 HB2 ARG 32 9.127 -9.888 -2.278 215 HB3 ARG 32 HB1 ARG 32 7.413 -10.044 -2.616 216 HG2 ARG 32 HG2 ARG 32 7.881 -8.274 -3.960 217 HG3 ARG 32 HG1 ARG 32 7.508 -7.416 -2.462 218 HD2 ARG 32 HD2 ARG 32 9.534 -6.546 -2.366 219 HD3 ARG 32 HD1 ARG 32 10.270 -8.150 -2.491 220 HE ARG 32 HE ARG 32 9.335 -7.061 -4.998 221 HH11 ARG 32 HH11 ARG 32 12.028 -7.351 -2.784 222 HH12 ARG 32 HH12 ARG 32 13.228 -7.036 -3.998 223 HH21 ARG 32 HH21 ARG 32 10.908 -6.659 -6.607 224 HH22 ARG 32 HH22 ARG 32 12.590 -6.648 -6.171 225 HA PRO 33 HA PRO 33 7.211 -12.622 1.664 226 HB2 PRO 33 HB2 PRO 33 5.154 -13.929 0.127 227 HB3 PRO 33 HB1 PRO 33 4.981 -13.055 1.654 228 HG2 PRO 33 HG2 PRO 33 3.908 -12.217 -0.728 229 HG3 PRO 33 HG1 PRO 33 4.331 -11.124 0.608 230 HD2 PRO 33 HD2 PRO 33 5.900 -11.797 -1.852 231 HD3 PRO 33 HD1 PRO 33 5.615 -10.211 -1.113 232 H GLN 34 H GLN 34 7.559 -14.895 1.637 233 HA GLN 34 HA GLN 34 9.129 -15.895 -0.547 234 HB2 GLN 34 HB2 GLN 34 9.670 -16.461 1.750 235 HB3 GLN 34 HB1 GLN 34 8.099 -17.209 1.971 236 HG2 GLN 34 HG2 GLN 34 8.697 -18.906 0.304 237 HG3 GLN 34 HG1 GLN 34 10.287 -18.163 0.140 238 HE21 GLN 34 HE21 GLN 34 11.775 -18.365 1.810 239 HE22 GLN 34 HE22 GLN 34 11.586 -19.523 3.078 240 H ALA 35 H ALA 35 5.849 -15.865 0.377 241 HA ALA 35 HA ALA 35 4.818 -18.123 -0.931 242 HB1 ALA 35 HB1 ALA 35 3.416 -15.463 -0.755 243 HB2 ALA 35 HB2 ALA 35 3.629 -16.512 0.653 244 HB3 ALA 35 HB3 ALA 35 2.706 -17.080 -0.739 245 HA PRO 36 HA PRO 36 5.042 -16.738 -5.188 246 HB2 PRO 36 HB2 PRO 36 3.341 -18.552 -6.264 247 HB3 PRO 36 HB1 PRO 36 4.997 -18.965 -5.808 248 HG2 PRO 36 HG2 PRO 36 2.441 -19.526 -4.376 249 HG3 PRO 36 HG1 PRO 36 3.890 -20.533 -4.525 250 HD2 PRO 36 HD2 PRO 36 3.258 -19.020 -2.310 251 HD3 PRO 36 HD1 PRO 36 4.900 -19.540 -2.731 252 H ILE 37 H ILE 37 4.026 -14.907 -5.611 253 HA ILE 37 HA ILE 37 1.122 -14.720 -5.135 254 HB ILE 37 HB ILE 37 1.501 -12.300 -4.707 255 HG12 ILE 37 HG12 ILE 37 4.308 -13.106 -5.300 256 HG13 ILE 37 HG11 ILE 37 3.414 -11.692 -5.821 257 HG21 ILE 37 HG21 ILE 37 2.312 -12.464 -2.459 258 HG22 ILE 37 HG22 ILE 37 3.256 -13.917 -2.834 259 HG23 ILE 37 HG23 ILE 37 1.490 -13.993 -2.818 260 HD11 ILE 37 HD11 ILE 37 3.551 -10.853 -3.480 261 HD12 ILE 37 HD12 ILE 37 5.093 -10.971 -4.330 262 HD13 ILE 37 HD13 ILE 37 4.642 -12.194 -3.142 263 H THR 38 H THR 38 -0.071 -13.424 -6.672 264 HA THR 38 HA THR 38 1.128 -13.485 -9.326 265 HB THR 38 HB THR 38 -1.245 -12.824 -10.026 266 HG1 THR 38 HG1 THR 38 -2.799 -12.951 -8.525 267 HG21 THR 38 HG21 THR 38 -0.775 -15.468 -8.687 268 HG22 THR 38 HG22 THR 38 -0.291 -15.032 -10.326 269 HG23 THR 38 HG23 THR 38 -1.998 -15.110 -9.907 270 H GLY 39 H GLY 39 0.032 -11.114 -6.991 271 HA2 GLY 39 HA2 GLY 39 1.320 -9.027 -8.426 272 HA3 GLY 39 HA1 GLY 39 -0.426 -8.930 -8.608 273 H TYR 40 H TYR 40 -0.041 -6.824 -7.505 274 HA TYR 40 HA TYR 40 -0.570 -7.272 -4.647 275 HB2 TYR 40 HB2 TYR 40 1.432 -5.368 -5.820 276 HB3 TYR 40 HB1 TYR 40 0.589 -4.954 -4.334 277 HD1 TYR 40 HD2 TYR 40 2.190 -8.059 -5.641 278 HD2 TYR 40 HD1 TYR 40 1.896 -5.250 -2.479 279 HE1 TYR 40 HE2 TYR 40 3.891 -9.295 -4.393 280 HE2 TYR 40 HE1 TYR 40 3.563 -6.507 -1.201 281 HH TYR 40 HH TYR 40 5.452 -8.987 -2.613 282 H ARG 41 H ARG 41 -2.397 -6.277 -4.010 283 HA ARG 41 HA ARG 41 -3.311 -3.939 -5.553 284 HB2 ARG 41 HB2 ARG 41 -4.787 -5.072 -3.214 285 HB3 ARG 41 HB1 ARG 41 -5.398 -4.206 -4.623 286 HG2 ARG 41 HG2 ARG 41 -4.191 -6.953 -4.737 287 HG3 ARG 41 HG1 ARG 41 -5.928 -6.665 -4.540 288 HD2 ARG 41 HD2 ARG 41 -4.191 -5.862 -6.873 289 HD3 ARG 41 HD1 ARG 41 -5.459 -7.088 -6.866 290 HE ARG 41 HE ARG 41 -6.435 -4.496 -6.128 291 HH11 ARG 41 HH11 ARG 41 -5.674 -6.576 -8.851 292 HH12 ARG 41 HH12 ARG 41 -6.664 -5.680 -9.957 293 HH21 ARG 41 HH21 ARG 41 -7.728 -3.344 -7.564 294 HH22 ARG 41 HH22 ARG 41 -7.846 -3.845 -9.226 295 H ILE 42 H ILE 42 -3.616 -1.954 -4.509 296 HA ILE 42 HA ILE 42 -2.480 -1.778 -1.793 297 HB ILE 42 HB ILE 42 -1.672 0.058 -4.025 298 HG12 ILE 42 HG12 ILE 42 -0.023 -2.116 -2.771 299 HG13 ILE 42 HG11 ILE 42 -0.894 -2.315 -4.284 300 HG21 ILE 42 HG21 ILE 42 -1.620 0.941 -1.682 301 HG22 ILE 42 HG22 ILE 42 -0.060 0.936 -2.498 302 HG23 ILE 42 HG23 ILE 42 -0.434 -0.307 -1.305 303 HD11 ILE 42 HD11 ILE 42 1.412 -1.832 -4.709 304 HD12 ILE 42 HD12 ILE 42 1.314 -0.372 -3.729 305 HD13 ILE 42 HD13 ILE 42 0.413 -0.479 -5.242 306 H VAL 43 H VAL 43 -4.061 -0.944 -0.571 307 HA VAL 43 HA VAL 43 -5.639 1.243 -1.779 308 HB VAL 43 HB VAL 43 -6.409 -0.583 0.501 309 HG11 VAL 43 HG11 VAL 43 -7.155 1.629 1.027 310 HG12 VAL 43 HG12 VAL 43 -8.530 0.650 0.531 311 HG13 VAL 43 HG13 VAL 43 -7.838 1.829 -0.585 312 HG21 VAL 43 HG21 VAL 43 -6.675 -1.527 -1.754 313 HG22 VAL 43 HG22 VAL 43 -7.670 -0.136 -2.194 314 HG23 VAL 43 HG23 VAL 43 -8.223 -1.259 -0.954 315 H TYR 44 H TYR 44 -4.843 3.108 -1.245 316 HA TYR 44 HA TYR 44 -4.090 3.552 1.541 317 HB2 TYR 44 HB2 TYR 44 -2.919 5.648 0.471 318 HB3 TYR 44 HB1 TYR 44 -2.125 4.080 0.456 319 HD1 TYR 44 HD1 TYR 44 -2.471 2.643 -1.665 320 HD2 TYR 44 HD2 TYR 44 -3.159 6.831 -1.531 321 HE1 TYR 44 HE1 TYR 44 -2.217 2.735 -4.092 322 HE2 TYR 44 HE2 TYR 44 -2.907 6.954 -3.967 323 HH TYR 44 HH TYR 44 -1.919 5.732 -5.769 324 H SER 45 H SER 45 -5.204 4.796 2.674 325 HA SER 45 HA SER 45 -7.089 6.658 1.427 326 HB2 SER 45 HB2 SER 45 -8.192 4.421 1.779 327 HB3 SER 45 HB1 SER 45 -7.924 4.627 3.509 328 HG SER 45 HG SER 45 -9.701 5.729 3.513 329 HA PRO 46 HA PRO 46 -5.736 9.239 4.831 330 HB2 PRO 46 HB2 PRO 46 -8.216 10.678 4.367 331 HB3 PRO 46 HB1 PRO 46 -6.560 11.250 4.247 332 HG2 PRO 46 HG2 PRO 46 -8.081 10.889 2.070 333 HG3 PRO 46 HG1 PRO 46 -6.336 10.568 2.062 334 HD2 PRO 46 HD2 PRO 46 -8.620 8.646 2.230 335 HD3 PRO 46 HD1 PRO 46 -7.090 8.517 1.334 336 H SER 47 H SER 47 -6.287 9.617 6.946 337 HA SER 47 HA SER 47 -8.077 7.740 8.105 338 HB2 SER 47 HB2 SER 47 -6.710 10.095 9.424 339 HB3 SER 47 HB1 SER 47 -7.380 8.678 10.232 340 HG SER 47 HG SER 47 -5.714 7.769 8.410 341 H VAL 48 H VAL 48 -8.273 11.195 7.393 342 HA VAL 48 HA VAL 48 -10.985 11.178 8.546 343 HB VAL 48 HB VAL 48 -9.071 13.495 8.273 344 HG11 VAL 48 HG11 VAL 48 -10.757 14.802 9.464 345 HG12 VAL 48 HG12 VAL 48 -11.859 13.427 9.414 346 HG13 VAL 48 HG13 VAL 48 -11.362 14.214 7.915 347 HG21 VAL 48 HG21 VAL 48 -10.122 12.087 10.725 348 HG22 VAL 48 HG22 VAL 48 -9.064 13.497 10.715 349 HG23 VAL 48 HG23 VAL 48 -8.487 11.957 10.080 350 H GLU 49 H GLU 49 -9.028 12.456 5.849 351 HA GLU 49 HA GLU 49 -11.204 12.335 4.034 352 HB2 GLU 49 HB2 GLU 49 -11.817 14.324 5.482 353 HB3 GLU 49 HB1 GLU 49 -10.397 15.133 4.835 354 HG2 GLU 49 HG2 GLU 49 -12.417 15.816 3.674 355 HG3 GLU 49 HG1 GLU 49 -11.310 14.976 2.588 356 H GLY 50 H GLY 50 -10.524 12.553 1.924 357 HA2 GLY 50 HA2 GLY 50 -8.658 14.012 0.723 358 HA3 GLY 50 HA1 GLY 50 -7.647 12.830 1.539 359 H SER 51 H SER 51 -6.893 12.068 -0.468 360 HA SER 51 HA SER 51 -8.843 10.860 -2.274 361 HB2 SER 51 HB2 SER 51 -5.849 11.223 -2.589 362 HB3 SER 51 HB1 SER 51 -6.971 10.676 -3.841 363 HG SER 51 HG SER 51 -6.302 13.039 -3.656 364 H SER 52 H SER 52 -9.326 8.738 -2.072 365 HA SER 52 HA SER 52 -7.254 6.946 -0.991 366 HB2 SER 52 HB2 SER 52 -10.172 6.249 -1.415 367 HB3 SER 52 HB1 SER 52 -8.986 5.384 -0.432 368 HG SER 52 HG SER 52 -9.505 6.632 1.172 369 H THR 53 H THR 53 -6.442 5.322 -2.215 370 HA THR 53 HA THR 53 -7.603 4.838 -4.851 371 HB THR 53 HB THR 53 -4.756 5.799 -4.505 372 HG1 THR 53 HG1 THR 53 -7.127 7.096 -4.989 373 HG21 THR 53 HG21 THR 53 -6.301 5.106 -7.006 374 HG22 THR 53 HG22 THR 53 -4.973 4.171 -6.310 375 HG23 THR 53 HG23 THR 53 -4.674 5.788 -6.950 376 H GLU 54 H GLU 54 -6.924 2.906 -5.812 377 HA GLU 54 HA GLU 54 -5.287 1.126 -4.164 378 HB2 GLU 54 HB2 GLU 54 -7.707 0.514 -4.228 379 HB3 GLU 54 HB1 GLU 54 -7.584 0.352 -5.973 380 HG2 GLU 54 HG2 GLU 54 -5.893 -1.420 -5.648 381 HG3 GLU 54 HG1 GLU 54 -6.143 -1.296 -3.908 382 H LEU 55 H LEU 55 -3.366 0.835 -5.151 383 HA LEU 55 HA LEU 55 -3.329 0.882 -8.083 384 HB2 LEU 55 HB2 LEU 55 -1.024 1.082 -6.108 385 HB3 LEU 55 HB1 LEU 55 -0.816 0.891 -7.847 386 HG LEU 55 HG LEU 55 -2.018 3.199 -6.375 387 HD11 LEU 55 HD11 LEU 55 0.300 3.430 -6.483 388 HD12 LEU 55 HD12 LEU 55 -0.325 4.434 -7.792 389 HD13 LEU 55 HD13 LEU 55 0.366 2.851 -8.148 390 HD21 LEU 55 HD21 LEU 55 -3.490 2.837 -8.227 391 HD22 LEU 55 HD22 LEU 55 -2.128 2.631 -9.329 392 HD23 LEU 55 HD23 LEU 55 -2.450 4.208 -8.607 393 H ASN 56 H ASN 56 -2.132 -0.714 -9.256 394 HA ASN 56 HA ASN 56 -2.057 -3.316 -7.884 395 HB2 ASN 56 HB2 ASN 56 -3.930 -3.250 -9.469 396 HB3 ASN 56 HB1 ASN 56 -2.835 -2.759 -10.760 397 HD21 ASN 56 HD21 ASN 56 -3.856 -5.360 -8.707 398 HD22 ASN 56 HD22 ASN 56 -3.102 -6.635 -9.598 399 H LEU 57 H LEU 57 -0.043 -3.992 -7.706 400 HA LEU 57 HA LEU 57 1.915 -3.061 -9.696 401 HB2 LEU 57 HB2 LEU 57 2.269 -3.724 -6.756 402 HB3 LEU 57 HB1 LEU 57 3.607 -3.526 -7.864 403 HG LEU 57 HG LEU 57 1.862 -1.511 -6.604 404 HD11 LEU 57 HD11 LEU 57 3.943 -0.276 -6.546 405 HD12 LEU 57 HD12 LEU 57 4.720 -1.511 -7.538 406 HD13 LEU 57 HD13 LEU 57 4.162 -1.907 -5.916 407 HD21 LEU 57 HD21 LEU 57 1.301 -1.160 -8.937 408 HD22 LEU 57 HD22 LEU 57 3.015 -1.094 -9.350 409 HD23 LEU 57 HD23 LEU 57 2.305 0.148 -8.317 410 HA PRO 58 HA PRO 58 2.682 -7.241 -10.805 411 HB2 PRO 58 HB2 PRO 58 5.449 -7.191 -10.975 412 HB3 PRO 58 HB1 PRO 58 4.345 -6.708 -12.263 413 HG2 PRO 58 HG2 PRO 58 5.899 -5.032 -10.376 414 HG3 PRO 58 HG1 PRO 58 5.409 -4.695 -12.042 415 HD2 PRO 58 HD2 PRO 58 4.208 -3.591 -9.852 416 HD3 PRO 58 HD1 PRO 58 3.380 -3.838 -11.398 417 H GLU 59 H GLU 59 3.188 -9.126 -9.880 418 HA GLU 59 HA GLU 59 3.271 -9.590 -7.217 419 HB2 GLU 59 HB2 GLU 59 4.226 -11.821 -7.766 420 HB3 GLU 59 HB1 GLU 59 2.878 -11.353 -8.795 421 HG2 GLU 59 HG2 GLU 59 4.362 -10.799 -10.589 422 HG3 GLU 59 HG1 GLU 59 5.770 -11.039 -9.561 423 H THR 60 H THR 60 5.970 -8.591 -9.102 424 HA THR 60 HA THR 60 7.845 -9.375 -6.989 425 HB THR 60 HB THR 60 8.389 -10.312 -9.164 426 HG1 THR 60 HG1 THR 60 10.079 -9.264 -7.691 427 HG21 THR 60 HG21 THR 60 8.468 -7.459 -10.140 428 HG22 THR 60 HG22 THR 60 7.298 -8.698 -10.602 429 HG23 THR 60 HG23 THR 60 8.993 -8.868 -11.062 430 H ALA 61 H ALA 61 6.035 -6.834 -7.536 431 HA ALA 61 HA ALA 61 7.958 -4.691 -7.633 432 HB1 ALA 61 HB1 ALA 61 6.027 -3.233 -7.189 433 HB2 ALA 61 HB2 ALA 61 5.027 -4.660 -6.913 434 HB3 ALA 61 HB3 ALA 61 5.710 -4.358 -8.509 435 H ASN 62 H ASN 62 8.278 -3.145 -5.875 436 HA ASN 62 HA ASN 62 7.693 -4.227 -3.223 437 HB2 ASN 62 HB2 ASN 62 9.943 -4.066 -2.448 438 HB3 ASN 62 HB1 ASN 62 9.958 -5.033 -3.916 439 HD21 ASN 62 HD21 ASN 62 12.090 -3.529 -2.626 440 HD22 ASN 62 HD22 ASN 62 12.683 -2.423 -3.818 441 H SER 63 H SER 63 7.123 -1.705 -5.025 442 HA SER 63 HA SER 63 7.032 0.089 -2.772 443 HB2 SER 63 HB2 SER 63 8.725 0.925 -5.161 444 HB3 SER 63 HB1 SER 63 8.401 1.873 -3.713 445 HG SER 63 HG SER 63 9.439 -0.498 -3.014 446 H VAL 64 H VAL 64 5.287 1.414 -3.020 447 HA VAL 64 HA VAL 64 4.309 1.862 -5.768 448 HB VAL 64 HB VAL 64 2.562 0.676 -4.590 449 HG11 VAL 64 HG11 VAL 64 1.912 0.997 -2.491 450 HG12 VAL 64 HG12 VAL 64 2.120 2.746 -2.571 451 HG13 VAL 64 HG13 VAL 64 3.516 1.697 -2.320 452 HG21 VAL 64 HG21 VAL 64 1.858 2.381 -6.074 453 HG22 VAL 64 HG22 VAL 64 1.918 3.573 -4.776 454 HG23 VAL 64 HG23 VAL 64 0.761 2.243 -4.706 455 H THR 65 H THR 65 4.210 3.896 -6.488 456 HA THR 65 HA THR 65 4.644 6.101 -4.647 457 HB THR 65 HB THR 65 4.530 5.856 -7.642 458 HG1 THR 65 HG1 THR 65 6.429 5.198 -6.167 459 HG21 THR 65 HG21 THR 65 5.276 8.209 -7.737 460 HG22 THR 65 HG22 THR 65 5.109 8.326 -5.986 461 HG23 THR 65 HG23 THR 65 3.684 8.069 -6.993 462 H LEU 66 H LEU 66 2.768 6.477 -3.619 463 HA LEU 66 HA LEU 66 0.185 6.458 -4.876 464 HB2 LEU 66 HB2 LEU 66 0.499 7.926 -2.366 465 HB3 LEU 66 HB1 LEU 66 -0.635 6.662 -2.786 466 HG LEU 66 HG LEU 66 2.227 6.048 -2.135 467 HD11 LEU 66 HD11 LEU 66 1.727 5.772 0.085 468 HD12 LEU 66 HD12 LEU 66 -0.013 5.875 -0.189 469 HD13 LEU 66 HD13 LEU 66 0.992 7.316 -0.332 470 HD21 LEU 66 HD21 LEU 66 1.211 3.850 -1.584 471 HD22 LEU 66 HD22 LEU 66 1.049 4.296 -3.286 472 HD23 LEU 66 HD23 LEU 66 -0.327 4.469 -2.194 473 H SER 67 H SER 67 -1.052 8.286 -5.431 474 HA SER 67 HA SER 67 0.399 10.826 -5.459 475 HB2 SER 67 HB2 SER 67 0.859 9.543 -7.587 476 HB3 SER 67 HB1 SER 67 -0.859 9.671 -7.954 477 HG SER 67 HG SER 67 -0.210 11.463 -8.874 478 H ASP 68 H ASP 68 -1.008 12.590 -6.334 479 HA ASP 68 HA ASP 68 -2.822 13.917 -6.142 480 HB2 ASP 68 HB2 ASP 68 -4.241 11.287 -6.513 481 HB3 ASP 68 HB1 ASP 68 -5.109 12.808 -6.335 482 H LEU 69 H LEU 69 -1.572 12.639 -3.759 483 HA LEU 69 HA LEU 69 -3.592 12.304 -1.785 484 HB2 LEU 69 HB2 LEU 69 -0.835 13.281 -1.109 485 HB3 LEU 69 HB1 LEU 69 -1.908 12.249 -0.184 486 HG LEU 69 HG LEU 69 -0.426 11.387 -2.658 487 HD11 LEU 69 HD11 LEU 69 1.054 11.827 -0.790 488 HD12 LEU 69 HD12 LEU 69 0.912 10.094 -1.086 489 HD13 LEU 69 HD13 LEU 69 0.045 10.834 0.261 490 HD21 LEU 69 HD21 LEU 69 -2.337 10.031 -2.517 491 HD22 LEU 69 HD22 LEU 69 -2.358 10.119 -0.756 492 HD23 LEU 69 HD23 LEU 69 -1.148 9.118 -1.571 493 H GLN 70 H GLN 70 -3.170 13.887 0.293 494 HA GLN 70 HA GLN 70 -3.312 16.649 -0.681 495 HB2 GLN 70 HB2 GLN 70 -5.600 15.879 -0.228 496 HB3 GLN 70 HB1 GLN 70 -5.125 15.382 1.391 497 HG2 GLN 70 HG2 GLN 70 -4.598 17.731 1.922 498 HG3 GLN 70 HG1 GLN 70 -5.174 18.197 0.324 499 HE21 GLN 70 HE21 GLN 70 -7.326 16.220 0.360 500 HE22 GLN 70 HE22 GLN 70 -8.532 16.852 1.425 501 HA PRO 71 HA PRO 71 -0.066 17.010 2.333 502 HB2 PRO 71 HB2 PRO 71 0.023 19.734 2.436 503 HB3 PRO 71 HB1 PRO 71 0.761 18.753 1.168 504 HG2 PRO 71 HG2 PRO 71 -1.843 20.223 1.146 505 HG3 PRO 71 HG1 PRO 71 -0.622 20.089 -0.133 506 HD2 PRO 71 HD2 PRO 71 -2.890 18.625 -0.140 507 HD3 PRO 71 HD1 PRO 71 -1.358 18.001 -0.790 508 H GLY 72 H GLY 72 -0.048 16.995 4.499 509 HA2 GLY 72 HA2 GLY 72 -0.611 17.594 6.680 510 HA3 GLY 72 HA1 GLY 72 -1.824 18.695 6.038 511 H VAL 73 H VAL 73 -1.574 15.346 5.093 512 HA VAL 73 HA VAL 73 -3.998 14.700 6.637 513 HB VAL 73 HB VAL 73 -3.563 14.136 3.695 514 HG11 VAL 73 HG11 VAL 73 -4.676 12.234 4.384 515 HG12 VAL 73 HG12 VAL 73 -5.992 13.334 3.934 516 HG13 VAL 73 HG13 VAL 73 -5.575 13.100 5.632 517 HG21 VAL 73 HG21 VAL 73 -5.857 15.286 3.634 518 HG22 VAL 73 HG22 VAL 73 -4.392 16.274 3.739 519 HG23 VAL 73 HG23 VAL 73 -5.365 15.977 5.183 520 H GLN 74 H GLN 74 -4.138 12.609 7.358 521 HA GLN 74 HA GLN 74 -1.663 11.110 7.308 522 HB2 GLN 74 HB2 GLN 74 -3.670 11.565 9.182 523 HB3 GLN 74 HB1 GLN 74 -3.846 9.870 8.741 524 HG2 GLN 74 HG2 GLN 74 -1.254 11.121 9.580 525 HG3 GLN 74 HG1 GLN 74 -2.340 10.284 10.686 526 HE21 GLN 74 HE21 GLN 74 0.436 9.702 9.877 527 HE22 GLN 74 HE22 GLN 74 0.401 8.085 9.273 528 H TYR 75 H TYR 75 -1.317 9.458 6.022 529 HA TYR 75 HA TYR 75 -3.624 8.391 4.543 530 HB2 TYR 75 HB2 TYR 75 -0.900 9.204 3.671 531 HB3 TYR 75 HB1 TYR 75 -1.630 7.809 2.868 532 HD1 TYR 75 HD2 TYR 75 -3.621 8.046 1.517 533 HD2 TYR 75 HD1 TYR 75 -1.863 11.434 3.392 534 HE1 TYR 75 HE2 TYR 75 -4.986 9.523 0.112 535 HE2 TYR 75 HE1 TYR 75 -3.230 12.922 1.987 536 HH TYR 75 HH TYR 75 -4.444 12.862 -0.153 537 H ASN 76 H ASN 76 -4.154 6.466 5.162 538 HA ASN 76 HA ASN 76 -2.218 4.608 6.257 539 HB2 ASN 76 HB2 ASN 76 -5.174 4.245 5.700 540 HB3 ASN 76 HB1 ASN 76 -4.160 3.159 6.641 541 HD21 ASN 76 HD21 ASN 76 -3.604 3.710 8.733 542 HD22 ASN 76 HD22 ASN 76 -4.345 5.025 9.578 543 H ILE 77 H ILE 77 -0.922 3.685 4.759 544 HA ILE 77 HA ILE 77 -2.035 2.810 2.201 545 HB ILE 77 HB ILE 77 0.812 2.635 3.216 546 HG12 ILE 77 HG12 ILE 77 1.033 4.301 1.201 547 HG13 ILE 77 HG11 ILE 77 -0.622 4.693 1.595 548 HG21 ILE 77 HG21 ILE 77 1.099 2.448 0.595 549 HG22 ILE 77 HG22 ILE 77 -0.491 1.690 0.735 550 HG23 ILE 77 HG23 ILE 77 0.888 1.020 1.620 551 HD11 ILE 77 HD11 ILE 77 0.052 5.252 3.876 552 HD12 ILE 77 HD12 ILE 77 0.911 6.220 2.677 553 HD13 ILE 77 HD13 ILE 77 1.724 4.869 3.468 554 H THR 78 H THR 78 -2.872 0.892 2.023 555 HA THR 78 HA THR 78 -1.914 -1.234 3.791 556 HB THR 78 HB THR 78 -4.520 -0.984 2.310 557 HG1 THR 78 HG1 THR 78 -3.714 0.114 4.586 558 HG21 THR 78 HG21 THR 78 -5.215 -2.927 3.633 559 HG22 THR 78 HG22 THR 78 -3.616 -3.003 4.371 560 HG23 THR 78 HG23 THR 78 -3.807 -3.318 2.647 561 H ILE 79 H ILE 79 -0.648 -2.703 2.845 562 HA ILE 79 HA ILE 79 -0.730 -2.948 -0.101 563 HB ILE 79 HB ILE 79 1.302 -4.348 1.648 564 HG12 ILE 79 HG12 ILE 79 1.814 -2.078 2.128 565 HG13 ILE 79 HG11 ILE 79 2.925 -2.601 0.861 566 HG21 ILE 79 HG21 ILE 79 1.250 -5.259 -0.500 567 HG22 ILE 79 HG22 ILE 79 2.635 -4.155 -0.466 568 HG23 ILE 79 HG23 ILE 79 1.134 -3.666 -1.250 569 HD11 ILE 79 HD11 ILE 79 1.801 -0.290 0.743 570 HD12 ILE 79 HD12 ILE 79 0.420 -1.194 0.120 571 HD13 ILE 79 HD13 ILE 79 1.979 -1.276 -0.715 572 H TYR 80 H TYR 80 -1.279 -4.817 -1.111 573 HA TYR 80 HA TYR 80 -2.018 -7.135 0.562 574 HB2 TYR 80 HB2 TYR 80 -3.453 -6.177 -1.932 575 HB3 TYR 80 HB1 TYR 80 -3.901 -7.554 -0.940 576 HD1 TYR 80 HD2 TYR 80 -4.987 -7.228 1.214 577 HD2 TYR 80 HD1 TYR 80 -4.033 -3.893 -1.278 578 HE1 TYR 80 HE2 TYR 80 -6.542 -5.827 2.500 579 HE2 TYR 80 HE1 TYR 80 -5.591 -2.497 0.008 580 HH TYR 80 HH TYR 80 -7.707 -2.934 1.461 581 H ALA 81 H ALA 81 -0.484 -8.654 0.036 582 HA ALA 81 HA ALA 81 0.552 -8.902 -2.658 583 HB1 ALA 81 HB1 ALA 81 0.908 -10.575 -0.159 584 HB2 ALA 81 HB2 ALA 81 2.087 -9.524 -0.943 585 HB3 ALA 81 HB3 ALA 81 1.602 -11.039 -1.725 586 H VAL 82 H VAL 82 -0.681 -9.743 -4.224 587 HA VAL 82 HA VAL 82 -2.898 -11.501 -3.351 588 HB VAL 82 HB VAL 82 -3.655 -9.531 -4.596 589 HG11 VAL 82 HG11 VAL 82 -3.215 -9.271 -6.963 590 HG12 VAL 82 HG12 VAL 82 -2.098 -10.634 -6.908 591 HG13 VAL 82 HG13 VAL 82 -1.732 -9.156 -6.016 592 HG21 VAL 82 HG21 VAL 82 -4.005 -12.065 -6.181 593 HG22 VAL 82 HG22 VAL 82 -5.075 -10.658 -6.204 594 HG23 VAL 82 HG23 VAL 82 -4.925 -11.626 -4.737 595 H GLU 83 H GLU 83 -3.303 -13.449 -4.249 596 HA GLU 83 HA GLU 83 -1.109 -14.650 -5.796 597 HB2 GLU 83 HB2 GLU 83 -1.293 -15.215 -3.381 598 HB3 GLU 83 HB1 GLU 83 -2.859 -15.935 -3.679 599 HG2 GLU 83 HG2 GLU 83 -0.281 -16.840 -4.904 600 HG3 GLU 83 HG1 GLU 83 -0.929 -17.491 -3.410 601 H GLU 84 H GLU 84 -1.991 -16.677 -7.023 602 HA GLU 84 HA GLU 84 -3.793 -15.954 -8.935 603 HB2 GLU 84 HB2 GLU 84 -3.392 -18.771 -7.927 604 HB3 GLU 84 HB1 GLU 84 -4.057 -18.322 -9.488 605 HG2 GLU 84 HG2 GLU 84 -1.895 -17.238 -10.031 606 HG3 GLU 84 HG1 GLU 84 -1.250 -17.875 -8.520 607 H ASN 85 H ASN 85 -4.559 -17.736 -5.953 608 HA ASN 85 HA ASN 85 -7.411 -17.254 -6.546 609 HB2 ASN 85 HB2 ASN 85 -6.740 -19.616 -6.970 610 HB3 ASN 85 HB1 ASN 85 -6.249 -19.748 -5.286 611 HD21 ASN 85 HD21 ASN 85 -7.691 -21.374 -4.835 612 HD22 ASN 85 HD22 ASN 85 -9.399 -21.108 -4.739 613 H GLN 86 H GLN 86 -5.011 -16.390 -4.525 614 HA GLN 86 HA GLN 86 -6.798 -16.284 -2.197 615 HB2 GLN 86 HB2 GLN 86 -3.898 -17.134 -2.125 616 HB3 GLN 86 HB1 GLN 86 -4.910 -16.856 -0.714 617 HG2 GLN 86 HG2 GLN 86 -5.393 -18.953 -2.819 618 HG3 GLN 86 HG1 GLN 86 -4.662 -19.234 -1.240 619 HE21 GLN 86 HE21 GLN 86 -7.067 -20.375 -2.386 620 HE22 GLN 86 HE22 GLN 86 -8.355 -19.979 -1.312 621 H GLU 87 H GLU 87 -5.778 -14.846 -0.458 622 HA GLU 87 HA GLU 87 -4.143 -12.696 -1.597 623 HB2 GLU 87 HB2 GLU 87 -6.727 -12.345 -0.067 624 HB3 GLU 87 HB1 GLU 87 -5.564 -11.050 -0.315 625 HG2 GLU 87 HG2 GLU 87 -5.883 -11.139 -2.688 626 HG3 GLU 87 HG1 GLU 87 -6.904 -12.568 -2.540 627 H SER 88 H SER 88 -2.580 -12.014 -0.251 628 HA SER 88 HA SER 88 -2.125 -13.515 2.145 629 HB2 SER 88 HB2 SER 88 -0.582 -11.098 1.196 630 HB3 SER 88 HB1 SER 88 -0.007 -12.415 2.219 631 HG SER 88 HG SER 88 -0.577 -12.434 -0.548 632 H THR 89 H THR 89 -1.327 -12.201 4.134 633 HA THR 89 HA THR 89 -3.458 -10.765 5.237 634 HB THR 89 HB THR 89 -1.293 -10.002 6.743 635 HG1 THR 89 HG1 THR 89 -0.310 -12.407 6.603 636 HG21 THR 89 HG21 THR 89 -2.773 -12.634 6.849 637 HG22 THR 89 HG22 THR 89 -3.303 -11.115 7.572 638 HG23 THR 89 HG23 THR 89 -1.854 -11.919 8.174 639 HA PRO 90 HA PRO 90 -2.607 -6.687 3.777 640 HB2 PRO 90 HB2 PRO 90 -3.937 -5.190 5.565 641 HB3 PRO 90 HB1 PRO 90 -4.765 -6.304 4.474 642 HG2 PRO 90 HG2 PRO 90 -4.201 -6.569 7.374 643 HG3 PRO 90 HG1 PRO 90 -5.549 -7.215 6.426 644 HD2 PRO 90 HD2 PRO 90 -3.224 -8.588 7.260 645 HD3 PRO 90 HD1 PRO 90 -4.469 -9.176 6.145 646 H VAL 91 H VAL 91 -0.922 -5.391 3.797 647 HA VAL 91 HA VAL 91 0.674 -4.747 6.132 648 HB VAL 91 HB VAL 91 0.615 -3.778 3.286 649 HG11 VAL 91 HG11 VAL 91 2.331 -2.746 5.536 650 HG12 VAL 91 HG12 VAL 91 1.054 -1.859 4.708 651 HG13 VAL 91 HG13 VAL 91 2.508 -2.323 3.839 652 HG21 VAL 91 HG21 VAL 91 2.778 -5.147 4.870 653 HG22 VAL 91 HG22 VAL 91 2.851 -4.682 3.168 654 HG23 VAL 91 HG23 VAL 91 1.714 -5.927 3.695 655 H VAL 92 H VAL 92 0.095 -3.088 7.522 656 HA VAL 92 HA VAL 92 -1.426 -0.879 6.307 657 HB VAL 92 HB VAL 92 -1.697 -1.576 9.219 658 HG11 VAL 92 HG11 VAL 92 -3.772 -0.272 8.989 659 HG12 VAL 92 HG12 VAL 92 -3.379 0.019 7.293 660 HG13 VAL 92 HG13 VAL 92 -2.341 0.664 8.563 661 HG21 VAL 92 HG21 VAL 92 -2.433 -3.542 7.980 662 HG22 VAL 92 HG22 VAL 92 -3.467 -2.534 6.968 663 HG23 VAL 92 HG23 VAL 92 -3.811 -2.703 8.689 664 H ILE 93 H ILE 93 0.019 0.658 6.036 665 HA ILE 93 HA ILE 93 1.669 1.469 8.331 666 HB ILE 93 HB ILE 93 3.352 2.306 6.606 667 HG12 ILE 93 HG12 ILE 93 2.151 0.260 4.777 668 HG13 ILE 93 HG11 ILE 93 1.636 1.928 4.710 669 HG21 ILE 93 HG21 ILE 93 4.416 0.100 6.370 670 HG22 ILE 93 HG22 ILE 93 2.917 -0.662 6.903 671 HG23 ILE 93 HG23 ILE 93 3.812 0.387 8.002 672 HD11 ILE 93 HD11 ILE 93 4.397 0.873 4.262 673 HD12 ILE 93 HD12 ILE 93 3.997 2.589 4.380 674 HD13 ILE 93 HD13 ILE 93 3.314 1.604 3.072 675 H GLN 94 H GLN 94 1.034 3.415 9.008 676 HA GLN 94 HA GLN 94 -0.358 5.137 7.101 677 HB2 GLN 94 HB2 GLN 94 -1.285 6.288 9.022 678 HB3 GLN 94 HB1 GLN 94 -1.553 4.558 9.165 679 HG2 GLN 94 HG2 GLN 94 0.348 4.409 10.716 680 HG3 GLN 94 HG1 GLN 94 0.560 6.154 10.600 681 HE21 GLN 94 HE21 GLN 94 -2.518 4.490 10.682 682 HE22 GLN 94 HE22 GLN 94 -3.019 5.095 12.219 683 H GLN 95 H GLN 95 0.440 6.990 6.418 684 HA GLN 95 HA GLN 95 2.608 8.294 7.878 685 HB2 GLN 95 HB2 GLN 95 2.888 6.889 5.390 686 HB3 GLN 95 HB1 GLN 95 3.160 8.602 5.115 687 HG2 GLN 95 HG2 GLN 95 4.597 6.840 7.083 688 HG3 GLN 95 HG1 GLN 95 5.241 7.485 5.579 689 HE21 GLN 95 HE21 GLN 95 3.886 10.101 6.071 690 HE22 GLN 95 HE22 GLN 95 4.879 10.883 7.253 691 H GLU 96 H GLU 96 2.253 10.415 8.050 692 HA GLU 96 HA GLU 96 0.066 11.611 6.571 693 HB2 GLU 96 HB2 GLU 96 0.211 12.105 8.931 694 HB3 GLU 96 HB1 GLU 96 1.854 12.699 8.753 695 HG2 GLU 96 HG2 GLU 96 1.033 14.543 7.386 696 HG3 GLU 96 HG1 GLU 96 -0.615 13.938 7.553 697 H THR 97 H THR 97 0.219 13.180 5.101 698 HA THR 97 HA THR 97 2.593 13.348 3.554 699 HB THR 97 HB THR 97 1.234 15.117 2.321 700 HG1 THR 97 HG1 THR 97 -1.139 14.658 3.143 701 HG21 THR 97 HG21 THR 97 1.280 12.704 1.702 702 HG22 THR 97 HG22 THR 97 -0.262 13.481 1.341 703 HG23 THR 97 HG23 THR 97 -0.107 12.444 2.758 704 H THR 98 H THR 98 4.286 14.604 3.937 705 HA THR 98 HA THR 98 4.300 16.635 5.927 706 HB THR 98 HB THR 98 6.387 16.114 3.806 707 HG1 THR 98 HG1 THR 98 5.832 14.801 6.267 708 HG21 THR 98 HG21 THR 98 6.580 17.272 6.591 709 HG22 THR 98 HG22 THR 98 6.725 18.172 5.082 710 HG23 THR 98 HG23 THR 98 7.941 16.969 5.512 711 H GLY 99 H GLY 99 4.043 16.563 2.443 712 HA2 GLY 99 HA2 GLY 99 2.785 18.365 1.392 713 HA3 GLY 99 HA1 GLY 99 3.576 19.472 2.489 714 H THR 100 H THR 100 3.856 20.431 0.206 715 HA THR 100 HA THR 100 5.940 19.333 -1.416 716 HB THR 100 HB THR 100 4.923 22.177 -1.409 717 HG1 THR 100 HG1 THR 100 3.881 19.797 -2.546 718 HG21 THR 100 HG21 THR 100 6.963 21.832 -2.674 719 HG22 THR 100 HG22 THR 100 5.600 22.177 -3.733 720 HG23 THR 100 HG23 THR 100 6.194 20.523 -3.574 721 HA PRO 101 HA PRO 101 9.315 20.912 1.117 722 HB2 PRO 101 HB2 PRO 101 10.974 20.211 -1.208 723 HB3 PRO 101 HB1 PRO 101 11.049 19.603 0.447 724 HG2 PRO 101 HG2 PRO 101 10.158 18.075 -1.569 725 HG3 PRO 101 HG1 PRO 101 9.472 17.968 0.062 726 HD2 PRO 101 HD2 PRO 101 8.390 19.365 -2.356 727 HD3 PRO 101 HD1 PRO 101 7.539 18.374 -1.151 728 H ARG 102 H ARG 102 8.070 22.999 0.338 729 HA ARG 102 HA ARG 102 9.310 24.550 -1.718 730 HB2 ARG 102 HB2 ARG 102 7.021 24.988 -1.053 731 HB3 ARG 102 HB1 ARG 102 7.523 25.307 0.600 732 HG2 ARG 102 HG2 ARG 102 8.785 27.273 -0.200 733 HG3 ARG 102 HG1 ARG 102 8.164 26.971 -1.826 734 HD2 ARG 102 HD2 ARG 102 6.870 28.687 -0.593 735 HD3 ARG 102 HD1 ARG 102 5.901 27.295 -1.075 736 HE ARG 102 HE ARG 102 7.019 27.388 1.637 737 HH11 ARG 102 HH11 ARG 102 4.234 27.535 -0.475 738 HH12 ARG 102 HH12 ARG 102 3.095 27.221 0.795 739 HH21 ARG 102 HH21 ARG 102 5.519 26.984 3.316 740 HH22 ARG 102 HH22 ARG 102 3.823 26.921 2.948 741 H SER 103 H SER 103 9.434 24.618 1.831 742 HA SER 103 HA SER 103 10.973 25.384 3.304 743 HB2 SER 103 HB2 SER 103 12.917 24.888 1.037 744 HB3 SER 103 HB1 SER 103 13.310 24.984 2.754 745 HG SER 103 HG SER 103 13.117 22.843 2.326 746 H ASP 104 H ASP 104 9.663 27.419 2.535 747 HA ASP 104 HA ASP 104 11.397 29.467 1.402 748 HB2 ASP 104 HB2 ASP 104 9.101 29.447 0.625 749 HB3 ASP 104 HB1 ASP 104 8.502 29.520 2.278 750 H GLY 105 H GLY 105 9.677 28.726 4.396 751 HA2 GLY 105 HA2 GLY 105 11.684 30.148 5.912 752 HA3 GLY 105 HA1 GLY 105 10.081 30.865 5.969 753 H THR 106 H THR 106 12.008 29.166 7.792 754 HA THR 106 HA THR 106 10.354 26.972 8.582 755 HB THR 106 HB THR 106 11.923 27.043 10.644 756 HG1 THR 106 HG1 THR 106 12.876 28.993 10.572 757 HG21 THR 106 HG21 THR 106 12.140 25.439 8.797 758 HG22 THR 106 HG22 THR 106 13.718 25.960 9.390 759 HG23 THR 106 HG23 THR 106 13.080 26.620 7.885 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 14.142 -31.860 4.468 2 H2 GLY 1 HT2 GLY 1 13.656 -33.338 3.809 3 H3 GLY 1 HT3 GLY 1 13.350 -32.997 5.438 4 HA2 GLY 1 HA1 GLY 1 11.344 -32.765 4.113 5 HA3 GLY 1 HA2 GLY 1 11.834 -31.238 4.835 6 H SER 2 H SER 2 10.187 -30.969 2.805 7 HA SER 2 HA SER 2 11.883 -30.349 0.479 8 HB2 SER 2 HB2 SER 2 10.022 -32.004 0.108 9 HB3 SER 2 HB1 SER 2 8.877 -30.726 0.508 10 HG SER 2 HG SER 2 10.662 -30.868 -1.687 11 H HIS 3 H HIS 3 12.170 -28.267 0.007 12 HA HIS 3 HA HIS 3 11.059 -26.257 1.719 13 HB2 HIS 3 HB2 HIS 3 13.407 -26.260 0.750 14 HB3 HIS 3 HB1 HIS 3 12.686 -25.815 -0.791 15 HD1 HIS 3 HD1 HIS 3 13.811 -24.427 2.421 16 HD2 HIS 3 HD2 HIS 3 11.505 -23.188 -0.804 17 HE1 HIS 3 HE1 HIS 3 13.629 -21.931 2.642 18 HE2 HIS 3 HE2 HIS 3 12.134 -21.216 0.748 19 H MET 4 H MET 4 10.362 -27.526 -1.419 20 HA MET 4 HA MET 4 8.536 -25.337 -2.045 21 HB2 MET 4 HB2 MET 4 9.339 -27.797 -3.605 22 HB3 MET 4 HB1 MET 4 8.164 -26.618 -4.168 23 HG2 MET 4 HG2 MET 4 9.877 -24.886 -4.132 24 HG3 MET 4 HG1 MET 4 11.056 -26.062 -3.555 25 HE1 MET 4 HE1 MET 4 8.214 -26.639 -6.263 26 HE2 MET 4 HE2 MET 4 9.089 -26.206 -7.733 27 HE3 MET 4 HE3 MET 4 8.741 -24.976 -6.518 28 H GLY 5 H GLY 5 6.405 -26.236 -3.127 29 HA2 GLY 5 HA2 GLY 5 4.966 -28.369 -2.716 30 HA3 GLY 5 HA1 GLY 5 5.119 -27.845 -1.045 31 H THR 6 H THR 6 2.633 -28.065 -2.066 32 HA THR 6 HA THR 6 1.561 -25.805 -3.316 33 HB THR 6 HB THR 6 0.194 -27.607 -1.302 34 HG1 THR 6 HG1 THR 6 0.403 -27.820 -4.146 35 HG21 THR 6 HG21 THR 6 -1.063 -25.556 -1.795 36 HG22 THR 6 HG22 THR 6 -1.865 -26.974 -2.471 37 HG23 THR 6 HG23 THR 6 -0.945 -25.897 -3.522 38 H THR 7 H THR 7 2.069 -23.830 -2.556 39 HA THR 7 HA THR 7 2.127 -23.299 0.279 40 HB THR 7 HB THR 7 2.429 -21.323 -1.987 41 HG1 THR 7 HG1 THR 7 3.946 -23.334 -1.638 42 HG21 THR 7 HG21 THR 7 3.372 -21.250 0.885 43 HG22 THR 7 HG22 THR 7 2.022 -20.327 0.225 44 HG23 THR 7 HG23 THR 7 3.665 -20.007 -0.332 45 H THR 8 H THR 8 -0.057 -23.737 0.793 46 HA THR 8 HA THR 8 -2.151 -22.144 -0.363 47 HB THR 8 HB THR 8 -2.184 -23.921 2.087 48 HG1 THR 8 HG1 THR 8 -2.629 -24.360 -0.672 49 HG21 THR 8 HG21 THR 8 -4.463 -22.777 0.465 50 HG22 THR 8 HG22 THR 8 -4.007 -22.281 2.094 51 HG23 THR 8 HG23 THR 8 -4.617 -23.910 1.807 52 H ALA 9 H ALA 9 -2.860 -20.235 0.297 53 HA ALA 9 HA ALA 9 -3.126 -18.306 1.451 54 HB1 ALA 9 HB1 ALA 9 -3.962 -19.727 3.262 55 HB2 ALA 9 HB2 ALA 9 -3.091 -18.323 3.881 56 HB3 ALA 9 HB3 ALA 9 -2.318 -19.909 3.874 57 HA PRO 10 HA PRO 10 1.355 -17.453 0.981 58 HB2 PRO 10 HB2 PRO 10 0.964 -15.037 -0.230 59 HB3 PRO 10 HB1 PRO 10 0.988 -16.575 -1.102 60 HG2 PRO 10 HG2 PRO 10 -1.352 -14.954 -0.168 61 HG3 PRO 10 HG1 PRO 10 -1.122 -15.804 -1.708 62 HD2 PRO 10 HD2 PRO 10 -2.618 -16.827 0.271 63 HD3 PRO 10 HD1 PRO 10 -1.688 -17.840 -0.792 64 H ASP 11 H ASP 11 2.719 -15.908 1.956 65 HA ASP 11 HA ASP 11 1.580 -14.633 4.297 66 HB2 ASP 11 HB2 ASP 11 4.420 -14.894 3.299 67 HB3 ASP 11 HB1 ASP 11 3.991 -13.988 4.745 68 H ALA 12 H ALA 12 2.066 -12.409 4.833 69 HA ALA 12 HA ALA 12 1.937 -10.638 2.501 70 HB1 ALA 12 HB1 ALA 12 1.520 -10.085 5.442 71 HB2 ALA 12 HB2 ALA 12 0.248 -10.361 4.252 72 HB3 ALA 12 HB3 ALA 12 1.273 -8.930 4.131 73 HA PRO 13 HA PRO 13 6.097 -9.143 3.253 74 HB2 PRO 13 HB2 PRO 13 5.197 -6.417 2.620 75 HB3 PRO 13 HB1 PRO 13 6.331 -7.445 1.741 76 HG2 PRO 13 HG2 PRO 13 3.907 -6.875 0.754 77 HG3 PRO 13 HG1 PRO 13 4.655 -8.466 0.514 78 HD2 PRO 13 HD2 PRO 13 2.588 -7.630 2.515 79 HD3 PRO 13 HD1 PRO 13 2.618 -9.079 1.481 80 HA PRO 14 HA PRO 14 5.830 -7.528 7.415 81 HB2 PRO 14 HB2 PRO 14 8.478 -6.756 7.580 82 HB3 PRO 14 HB1 PRO 14 7.894 -8.390 7.906 83 HG2 PRO 14 HG2 PRO 14 9.171 -7.286 5.448 84 HG3 PRO 14 HG1 PRO 14 9.369 -8.880 6.196 85 HD2 PRO 14 HD2 PRO 14 7.850 -8.495 4.004 86 HD3 PRO 14 HD1 PRO 14 7.440 -9.709 5.231 87 H ASP 15 H ASP 15 6.203 -5.445 8.490 88 HA ASP 15 HA ASP 15 4.846 -3.478 7.221 89 HB2 ASP 15 HB2 ASP 15 5.571 -1.921 8.936 90 HB3 ASP 15 HB1 ASP 15 5.268 -3.501 9.643 91 HA PRO 16 HA PRO 16 7.844 -2.110 4.153 92 HB2 PRO 16 HB2 PRO 16 5.490 -0.559 3.255 93 HB3 PRO 16 HB1 PRO 16 6.487 -1.710 2.333 94 HG2 PRO 16 HG2 PRO 16 4.027 -2.369 3.086 95 HG3 PRO 16 HG1 PRO 16 5.339 -3.553 3.188 96 HD2 PRO 16 HD2 PRO 16 4.162 -1.867 5.379 97 HD3 PRO 16 HD1 PRO 16 4.482 -3.620 5.381 98 H THR 17 H THR 17 8.833 -0.168 3.714 99 HA THR 17 HA THR 17 8.256 1.968 5.671 100 HB THR 17 HB THR 17 10.898 1.286 4.363 101 HG1 THR 17 HG1 THR 17 10.068 0.923 7.071 102 HG21 THR 17 HG21 THR 17 10.232 3.255 6.556 103 HG22 THR 17 HG22 THR 17 10.700 3.664 4.905 104 HG23 THR 17 HG23 THR 17 11.853 2.869 5.978 105 H VAL 18 H VAL 18 7.749 3.819 5.029 106 HA VAL 18 HA VAL 18 7.636 4.516 2.226 107 HB VAL 18 HB VAL 18 6.967 6.122 4.697 108 HG11 VAL 18 HG11 VAL 18 5.874 7.705 3.169 109 HG12 VAL 18 HG12 VAL 18 6.495 6.799 1.783 110 HG13 VAL 18 HG13 VAL 18 7.611 7.613 2.884 111 HG21 VAL 18 HG21 VAL 18 4.655 5.729 4.066 112 HG22 VAL 18 HG22 VAL 18 5.497 4.198 4.305 113 HG23 VAL 18 HG23 VAL 18 5.179 4.786 2.674 114 H ASP 19 H ASP 19 9.124 5.534 1.123 115 HA ASP 19 HA ASP 19 11.619 6.240 2.400 116 HB2 ASP 19 HB2 ASP 19 11.684 4.966 0.337 117 HB3 ASP 19 HB1 ASP 19 10.761 6.210 -0.498 118 H GLN 20 H GLN 20 9.188 7.878 0.400 119 HA GLN 20 HA GLN 20 10.068 10.437 1.521 120 HB2 GLN 20 HB2 GLN 20 9.801 9.755 -1.398 121 HB3 GLN 20 HB1 GLN 20 9.708 11.412 -0.819 122 HG2 GLN 20 HG2 GLN 20 11.938 11.339 -0.004 123 HG3 GLN 20 HG1 GLN 20 12.040 9.600 -0.269 124 HE21 GLN 20 HE21 GLN 20 12.392 8.823 -2.311 125 HE22 GLN 20 HE22 GLN 20 12.861 9.816 -3.624 126 H VAL 21 H VAL 21 8.505 11.913 1.841 127 HA VAL 21 HA VAL 21 5.785 11.208 0.992 128 HB VAL 21 HB VAL 21 4.904 12.035 3.156 129 HG11 VAL 21 HG11 VAL 21 5.534 10.085 4.501 130 HG12 VAL 21 HG12 VAL 21 6.862 9.756 3.389 131 HG13 VAL 21 HG13 VAL 21 5.196 9.647 2.828 132 HG21 VAL 21 HG21 VAL 21 6.399 12.289 5.072 133 HG22 VAL 21 HG22 VAL 21 6.770 13.468 3.814 134 HG23 VAL 21 HG23 VAL 21 7.793 12.047 4.022 135 H ASP 22 H ASP 22 4.811 12.772 -0.079 136 HA ASP 22 HA ASP 22 5.573 15.563 0.481 137 HB2 ASP 22 HB2 ASP 22 5.104 14.211 -2.165 138 HB3 ASP 22 HB1 ASP 22 4.862 15.944 -1.984 139 H ASP 23 H ASP 23 3.683 16.835 -1.020 140 HA ASP 23 HA ASP 23 1.389 16.718 0.585 141 HB2 ASP 23 HB2 ASP 23 0.403 18.143 -1.326 142 HB3 ASP 23 HB1 ASP 23 1.796 18.769 -0.467 143 H THR 24 H THR 24 1.658 15.914 -2.849 144 HA THR 24 HA THR 24 -0.813 14.309 -2.615 145 HB THR 24 HB THR 24 -0.995 14.795 -5.088 146 HG1 THR 24 HG1 THR 24 0.862 16.890 -4.664 147 HG21 THR 24 HG21 THR 24 -1.733 17.121 -4.764 148 HG22 THR 24 HG22 THR 24 -0.859 17.181 -3.228 149 HG23 THR 24 HG23 THR 24 -2.240 16.094 -3.422 150 H SER 25 H SER 25 1.752 13.187 -1.976 151 HA SER 25 HA SER 25 1.887 10.946 -3.670 152 HB2 SER 25 HB2 SER 25 4.198 11.316 -4.566 153 HB3 SER 25 HB1 SER 25 2.984 12.392 -5.254 154 HG SER 25 HG SER 25 3.908 14.059 -4.327 155 H ILE 26 H ILE 26 2.919 9.285 -2.715 156 HA ILE 26 HA ILE 26 4.931 9.731 -0.638 157 HB ILE 26 HB ILE 26 2.230 8.526 -0.068 158 HG12 ILE 26 HG12 ILE 26 4.038 10.379 1.489 159 HG13 ILE 26 HG11 ILE 26 2.579 10.831 0.620 160 HG21 ILE 26 HG21 ILE 26 3.776 6.755 0.492 161 HG22 ILE 26 HG22 ILE 26 3.120 7.475 1.963 162 HG23 ILE 26 HG23 ILE 26 4.754 7.877 1.437 163 HD11 ILE 26 HD11 ILE 26 2.761 9.102 3.080 164 HD12 ILE 26 HD12 ILE 26 1.280 9.389 2.163 165 HD13 ILE 26 HD13 ILE 26 2.095 10.736 2.959 166 H VAL 27 H VAL 27 6.373 7.916 -0.502 167 HA VAL 27 HA VAL 27 5.699 5.795 -2.450 168 HB VAL 27 HB VAL 27 8.463 6.740 -1.718 169 HG11 VAL 27 HG11 VAL 27 9.283 5.094 -3.074 170 HG12 VAL 27 HG12 VAL 27 7.872 5.120 -4.131 171 HG13 VAL 27 HG13 VAL 27 7.781 4.301 -2.567 172 HG21 VAL 27 HG21 VAL 27 8.545 7.707 -3.963 173 HG22 VAL 27 HG22 VAL 27 7.277 8.449 -2.988 174 HG23 VAL 27 HG23 VAL 27 6.859 7.257 -4.218 175 H VAL 28 H VAL 28 5.712 3.736 -1.712 176 HA VAL 28 HA VAL 28 6.895 3.317 0.944 177 HB VAL 28 HB VAL 28 5.028 2.467 1.832 178 HG11 VAL 28 HG11 VAL 28 4.294 4.601 0.894 179 HG12 VAL 28 HG12 VAL 28 3.000 3.440 1.154 180 HG13 VAL 28 HG13 VAL 28 3.614 3.722 -0.475 181 HG21 VAL 28 HG21 VAL 28 5.087 0.464 0.505 182 HG22 VAL 28 HG22 VAL 28 4.265 1.306 -0.811 183 HG23 VAL 28 HG23 VAL 28 3.421 1.022 0.712 184 H ARG 29 H ARG 29 7.773 1.267 1.343 185 HA ARG 29 HA ARG 29 8.169 -0.426 -1.047 186 HB2 ARG 29 HB2 ARG 29 10.364 0.274 0.904 187 HB3 ARG 29 HB1 ARG 29 10.522 -0.562 -0.634 188 HG2 ARG 29 HG2 ARG 29 9.987 1.470 -1.832 189 HG3 ARG 29 HG1 ARG 29 9.704 2.318 -0.312 190 HD2 ARG 29 HD2 ARG 29 12.315 1.160 -1.270 191 HD3 ARG 29 HD1 ARG 29 11.895 2.869 -1.173 192 HE ARG 29 HE ARG 29 11.830 1.300 1.294 193 HH11 ARG 29 HH11 ARG 29 13.504 3.633 -0.705 194 HH12 ARG 29 HH12 ARG 29 14.448 4.265 0.602 195 HH21 ARG 29 HH21 ARG 29 13.092 2.102 3.006 196 HH22 ARG 29 HH22 ARG 29 14.227 3.381 2.713 197 H TRP 30 H TRP 30 7.756 -2.451 -0.684 198 HA TRP 30 HA TRP 30 7.638 -3.410 2.107 199 HB2 TRP 30 HB2 TRP 30 5.811 -4.953 1.336 200 HB3 TRP 30 HB1 TRP 30 5.392 -3.250 1.212 201 HD1 TRP 30 HD1 TRP 30 6.277 -6.234 -0.970 202 HE1 TRP 30 HE1 TRP 30 5.452 -5.798 -3.360 203 HE3 TRP 30 HE3 TRP 30 4.696 -1.449 -0.366 204 HZ2 TRP 30 HZ2 TRP 30 4.219 -3.705 -4.779 205 HZ3 TRP 30 HZ3 TRP 30 3.671 -0.312 -2.287 206 HH2 TRP 30 HH2 TRP 30 3.432 -1.402 -4.429 207 H SER 31 H SER 31 8.468 -5.406 2.605 208 HA SER 31 HA SER 31 10.234 -6.594 0.628 209 HB2 SER 31 HB2 SER 31 10.964 -6.185 3.007 210 HB3 SER 31 HB1 SER 31 9.818 -7.423 3.513 211 HG SER 31 HG SER 31 12.289 -7.678 2.356 212 H ARG 32 H ARG 32 9.116 -7.754 -0.787 213 HA ARG 32 HA ARG 32 6.680 -8.968 -0.523 214 HB2 ARG 32 HB2 ARG 32 8.835 -10.010 -2.340 215 HB3 ARG 32 HB1 ARG 32 7.103 -10.018 -2.609 216 HG2 ARG 32 HG2 ARG 32 7.714 -8.277 -3.952 217 HG3 ARG 32 HG1 ARG 32 7.384 -7.421 -2.443 218 HD2 ARG 32 HD2 ARG 32 9.442 -6.621 -2.423 219 HD3 ARG 32 HD1 ARG 32 10.081 -8.269 -2.373 220 HE ARG 32 HE ARG 32 9.327 -7.362 -5.010 221 HH11 ARG 32 HH11 ARG 32 11.913 -7.570 -2.655 222 HH12 ARG 32 HH12 ARG 32 13.171 -7.414 -3.837 223 HH21 ARG 32 HH21 ARG 32 10.976 -7.155 -6.565 224 HH22 ARG 32 HH22 ARG 32 12.639 -7.168 -6.060 225 HA PRO 33 HA PRO 33 7.198 -12.802 1.565 226 HB2 PRO 33 HB2 PRO 33 5.135 -14.095 0.020 227 HB3 PRO 33 HB1 PRO 33 4.990 -13.337 1.609 228 HG2 PRO 33 HG2 PRO 33 3.794 -12.386 -0.674 229 HG3 PRO 33 HG1 PRO 33 4.215 -11.374 0.726 230 HD2 PRO 33 HD2 PRO 33 5.701 -11.777 -1.838 231 HD3 PRO 33 HD1 PRO 33 5.396 -10.278 -0.950 232 H GLN 34 H GLN 34 7.574 -15.110 1.340 233 HA GLN 34 HA GLN 34 9.148 -15.745 -1.018 234 HB2 GLN 34 HB2 GLN 34 8.619 -17.455 1.412 235 HB3 GLN 34 HB1 GLN 34 9.876 -17.679 0.204 236 HG2 GLN 34 HG2 GLN 34 10.928 -15.594 0.898 237 HG3 GLN 34 HG1 GLN 34 9.672 -15.367 2.114 238 HE21 GLN 34 HE21 GLN 34 9.640 -16.697 3.930 239 HE22 GLN 34 HE22 GLN 34 11.020 -17.624 4.408 240 H ALA 35 H ALA 35 5.994 -15.955 -0.060 241 HA ALA 35 HA ALA 35 5.162 -18.396 -1.239 242 HB1 ALA 35 HB1 ALA 35 3.869 -16.971 0.404 243 HB2 ALA 35 HB2 ALA 35 2.951 -17.564 -0.981 244 HB3 ALA 35 HB3 ALA 35 3.514 -15.889 -0.952 245 HA PRO 36 HA PRO 36 4.992 -17.048 -5.543 246 HB2 PRO 36 HB2 PRO 36 2.876 -19.029 -5.927 247 HB3 PRO 36 HB1 PRO 36 4.497 -18.992 -6.622 248 HG2 PRO 36 HG2 PRO 36 3.749 -20.816 -4.772 249 HG3 PRO 36 HG1 PRO 36 5.407 -20.205 -4.896 250 HD2 PRO 36 HD2 PRO 36 3.242 -19.433 -2.976 251 HD3 PRO 36 HD1 PRO 36 4.976 -19.683 -2.681 252 H ILE 37 H ILE 37 3.961 -15.211 -5.925 253 HA ILE 37 HA ILE 37 1.093 -14.994 -5.290 254 HB ILE 37 HB ILE 37 1.487 -12.621 -4.709 255 HG12 ILE 37 HG12 ILE 37 4.303 -13.354 -5.394 256 HG13 ILE 37 HG11 ILE 37 3.365 -11.955 -5.878 257 HG21 ILE 37 HG21 ILE 37 3.194 -14.528 -3.079 258 HG22 ILE 37 HG22 ILE 37 1.462 -14.248 -2.881 259 HG23 ILE 37 HG23 ILE 37 2.610 -12.947 -2.531 260 HD11 ILE 37 HD11 ILE 37 5.005 -11.186 -4.375 261 HD12 ILE 37 HD12 ILE 37 4.656 -12.483 -3.234 262 HD13 ILE 37 HD13 ILE 37 3.479 -11.197 -3.485 263 H THR 38 H THR 38 -0.090 -13.502 -6.704 264 HA THR 38 HA THR 38 1.015 -13.602 -9.403 265 HB THR 38 HB THR 38 -1.350 -12.978 -10.078 266 HG1 THR 38 HG1 THR 38 -2.479 -12.344 -8.384 267 HG21 THR 38 HG21 THR 38 -2.176 -15.259 -9.725 268 HG22 THR 38 HG22 THR 38 -0.838 -15.549 -8.613 269 HG23 THR 38 HG23 THR 38 -0.519 -15.208 -10.313 270 H GLY 39 H GLY 39 -0.048 -11.210 -7.053 271 HA2 GLY 39 HA2 GLY 39 1.237 -9.133 -8.507 272 HA3 GLY 39 HA1 GLY 39 -0.512 -9.032 -8.654 273 H TYR 40 H TYR 40 -0.088 -6.924 -7.574 274 HA TYR 40 HA TYR 40 -0.565 -7.325 -4.706 275 HB2 TYR 40 HB2 TYR 40 1.520 -5.570 -5.939 276 HB3 TYR 40 HB1 TYR 40 0.673 -5.002 -4.504 277 HD1 TYR 40 HD1 TYR 40 2.176 -8.245 -5.593 278 HD2 TYR 40 HD2 TYR 40 1.853 -5.287 -2.562 279 HE1 TYR 40 HE1 TYR 40 3.759 -9.495 -4.207 280 HE2 TYR 40 HE2 TYR 40 3.397 -6.558 -1.156 281 HH TYR 40 HH TYR 40 5.263 -9.129 -2.367 282 H ARG 41 H ARG 41 -2.316 -6.252 -4.015 283 HA ARG 41 HA ARG 41 -3.287 -3.957 -5.585 284 HB2 ARG 41 HB2 ARG 41 -4.606 -4.956 -3.098 285 HB3 ARG 41 HB1 ARG 41 -5.302 -4.148 -4.500 286 HG2 ARG 41 HG2 ARG 41 -4.119 -6.898 -4.641 287 HG3 ARG 41 HG1 ARG 41 -5.811 -6.625 -4.195 288 HD2 ARG 41 HD2 ARG 41 -4.480 -5.783 -6.768 289 HD3 ARG 41 HD1 ARG 41 -5.614 -7.118 -6.570 290 HE ARG 41 HE ARG 41 -6.589 -4.496 -5.771 291 HH11 ARG 41 HH11 ARG 41 -6.469 -6.968 -8.256 292 HH12 ARG 41 HH12 ARG 41 -7.803 -6.308 -9.146 293 HH21 ARG 41 HH21 ARG 41 -8.342 -3.631 -6.942 294 HH22 ARG 41 HH22 ARG 41 -8.868 -4.420 -8.402 295 H ILE 42 H ILE 42 -3.471 -1.908 -4.631 296 HA ILE 42 HA ILE 42 -2.326 -1.664 -1.921 297 HB ILE 42 HB ILE 42 -1.501 0.111 -4.201 298 HG12 ILE 42 HG12 ILE 42 0.139 -2.039 -2.897 299 HG13 ILE 42 HG11 ILE 42 -0.763 -2.293 -4.382 300 HG21 ILE 42 HG21 ILE 42 -1.431 1.025 -1.857 301 HG22 ILE 42 HG22 ILE 42 0.117 1.007 -2.696 302 HG23 ILE 42 HG23 ILE 42 -0.241 -0.223 -1.482 303 HD11 ILE 42 HD11 ILE 42 1.548 -1.847 -4.848 304 HD12 ILE 42 HD12 ILE 42 1.452 -0.330 -3.961 305 HD13 ILE 42 HD13 ILE 42 0.538 -0.533 -5.454 306 H VAL 43 H VAL 43 -3.926 -0.811 -0.742 307 HA VAL 43 HA VAL 43 -5.500 1.359 -1.977 308 HB VAL 43 HB VAL 43 -6.287 -0.481 0.287 309 HG11 VAL 43 HG11 VAL 43 -7.787 1.825 -0.916 310 HG12 VAL 43 HG12 VAL 43 -7.132 1.723 0.717 311 HG13 VAL 43 HG13 VAL 43 -8.444 0.656 0.229 312 HG21 VAL 43 HG21 VAL 43 -6.408 -1.469 -1.973 313 HG22 VAL 43 HG22 VAL 43 -7.472 -0.148 -2.459 314 HG23 VAL 43 HG23 VAL 43 -7.993 -1.288 -1.220 315 H TYR 44 H TYR 44 -4.776 3.253 -1.380 316 HA TYR 44 HA TYR 44 -4.024 3.662 1.414 317 HB2 TYR 44 HB2 TYR 44 -2.786 5.730 0.361 318 HB3 TYR 44 HB1 TYR 44 -2.035 4.141 0.358 319 HD1 TYR 44 HD2 TYR 44 -2.284 2.727 -1.750 320 HD2 TYR 44 HD1 TYR 44 -3.086 6.897 -1.656 321 HE1 TYR 44 HE2 TYR 44 -2.018 2.803 -4.178 322 HE2 TYR 44 HE1 TYR 44 -2.814 7.005 -4.093 323 HH TYR 44 HH TYR 44 -1.920 5.857 -5.894 324 H SER 45 H SER 45 -5.035 5.023 2.554 325 HA SER 45 HA SER 45 -6.887 6.931 1.311 326 HB2 SER 45 HB2 SER 45 -8.707 6.098 2.847 327 HB3 SER 45 HB1 SER 45 -8.261 4.989 1.551 328 HG SER 45 HG SER 45 -8.275 4.533 4.153 329 HA PRO 46 HA PRO 46 -5.742 9.372 4.917 330 HB2 PRO 46 HB2 PRO 46 -7.853 11.182 4.389 331 HB3 PRO 46 HB1 PRO 46 -6.157 11.369 3.976 332 HG2 PRO 46 HG2 PRO 46 -8.202 11.097 2.150 333 HG3 PRO 46 HG1 PRO 46 -6.498 10.743 1.821 334 HD2 PRO 46 HD2 PRO 46 -8.733 8.881 2.476 335 HD3 PRO 46 HD1 PRO 46 -7.382 8.675 1.342 336 H SER 47 H SER 47 -6.559 9.886 6.976 337 HA SER 47 HA SER 47 -8.865 8.321 7.750 338 HB2 SER 47 HB2 SER 47 -6.776 8.359 9.120 339 HB3 SER 47 HB1 SER 47 -7.081 10.055 9.476 340 HG SER 47 HG SER 47 -8.849 7.920 10.092 341 H VAL 48 H VAL 48 -8.032 11.707 7.309 342 HA VAL 48 HA VAL 48 -10.744 12.418 8.203 343 HB VAL 48 HB VAL 48 -9.996 14.683 8.577 344 HG11 VAL 48 HG11 VAL 48 -9.736 13.103 10.400 345 HG12 VAL 48 HG12 VAL 48 -8.447 14.305 10.432 346 HG13 VAL 48 HG13 VAL 48 -8.125 12.679 9.828 347 HG21 VAL 48 HG21 VAL 48 -7.306 13.747 7.595 348 HG22 VAL 48 HG22 VAL 48 -7.612 15.294 8.383 349 HG23 VAL 48 HG23 VAL 48 -8.361 14.934 6.829 350 H GLU 49 H GLU 49 -8.484 12.723 5.524 351 HA GLU 49 HA GLU 49 -10.372 14.334 4.027 352 HB2 GLU 49 HB2 GLU 49 -7.585 13.392 3.360 353 HB3 GLU 49 HB1 GLU 49 -8.581 14.355 2.279 354 HG2 GLU 49 HG2 GLU 49 -7.544 15.165 4.982 355 HG3 GLU 49 HG1 GLU 49 -7.035 15.784 3.414 356 H GLY 50 H GLY 50 -9.867 13.404 1.406 357 HA2 GLY 50 HA2 GLY 50 -11.549 10.997 1.642 358 HA3 GLY 50 HA1 GLY 50 -11.851 12.285 0.498 359 H SER 51 H SER 51 -8.836 12.349 -0.195 360 HA SER 51 HA SER 51 -9.293 10.780 -2.505 361 HB2 SER 51 HB2 SER 51 -7.815 12.827 -2.384 362 HB3 SER 51 HB1 SER 51 -6.578 11.830 -1.610 363 HG SER 51 HG SER 51 -6.066 11.633 -3.678 364 H SER 52 H SER 52 -9.313 8.671 -2.581 365 HA SER 52 HA SER 52 -7.184 7.168 -1.210 366 HB2 SER 52 HB2 SER 52 -9.984 6.147 -1.758 367 HB3 SER 52 HB1 SER 52 -8.726 5.352 -0.808 368 HG SER 52 HG SER 52 -9.728 7.913 -0.124 369 H THR 53 H THR 53 -6.239 5.464 -2.394 370 HA THR 53 HA THR 53 -7.348 4.966 -5.053 371 HB THR 53 HB THR 53 -4.456 5.790 -4.757 372 HG1 THR 53 HG1 THR 53 -6.700 7.300 -4.963 373 HG21 THR 53 HG21 THR 53 -4.501 5.881 -7.204 374 HG22 THR 53 HG22 THR 53 -6.172 5.320 -7.198 375 HG23 THR 53 HG23 THR 53 -4.883 4.264 -6.615 376 H GLU 54 H GLU 54 -6.814 2.980 -5.921 377 HA GLU 54 HA GLU 54 -5.065 1.246 -4.349 378 HB2 GLU 54 HB2 GLU 54 -7.367 0.427 -4.341 379 HB3 GLU 54 HB1 GLU 54 -7.418 0.496 -6.096 380 HG2 GLU 54 HG2 GLU 54 -5.633 -1.200 -6.192 381 HG3 GLU 54 HG1 GLU 54 -5.664 -1.301 -4.434 382 H LEU 55 H LEU 55 -3.164 0.927 -5.320 383 HA LEU 55 HA LEU 55 -3.103 0.963 -8.251 384 HB2 LEU 55 HB2 LEU 55 -0.808 1.123 -6.261 385 HB3 LEU 55 HB1 LEU 55 -0.597 0.934 -8.001 386 HG LEU 55 HG LEU 55 -1.739 3.264 -6.513 387 HD11 LEU 55 HD11 LEU 55 0.579 2.888 -8.376 388 HD12 LEU 55 HD12 LEU 55 0.592 3.428 -6.694 389 HD13 LEU 55 HD13 LEU 55 -0.061 4.474 -7.952 390 HD21 LEU 55 HD21 LEU 55 -3.264 2.925 -8.327 391 HD22 LEU 55 HD22 LEU 55 -1.935 2.699 -9.464 392 HD23 LEU 55 HD23 LEU 55 -2.213 4.281 -8.734 393 H ASN 56 H ASN 56 -1.957 -0.686 -9.399 394 HA ASN 56 HA ASN 56 -2.024 -3.279 -8.002 395 HB2 ASN 56 HB2 ASN 56 -3.830 -2.940 -9.736 396 HB3 ASN 56 HB1 ASN 56 -2.559 -2.821 -10.946 397 HD21 ASN 56 HD21 ASN 56 -4.320 -4.899 -8.840 398 HD22 ASN 56 HD22 ASN 56 -3.714 -6.397 -9.457 399 H LEU 57 H LEU 57 -0.029 -4.080 -7.785 400 HA LEU 57 HA LEU 57 1.994 -3.201 -9.730 401 HB2 LEU 57 HB2 LEU 57 2.264 -3.808 -6.774 402 HB3 LEU 57 HB1 LEU 57 3.638 -3.715 -7.851 403 HG LEU 57 HG LEU 57 1.975 -1.581 -6.694 404 HD11 LEU 57 HD11 LEU 57 4.269 -2.058 -5.990 405 HD12 LEU 57 HD12 LEU 57 4.090 -0.429 -6.634 406 HD13 LEU 57 HD13 LEU 57 4.832 -1.691 -7.618 407 HD21 LEU 57 HD21 LEU 57 3.155 -1.315 -9.445 408 HD22 LEU 57 HD22 LEU 57 2.505 -0.002 -8.461 409 HD23 LEU 57 HD23 LEU 57 1.439 -1.285 -9.037 410 HA PRO 58 HA PRO 58 2.691 -7.427 -10.715 411 HB2 PRO 58 HB2 PRO 58 5.434 -7.459 -10.947 412 HB3 PRO 58 HB1 PRO 58 4.331 -6.901 -12.205 413 HG2 PRO 58 HG2 PRO 58 5.963 -5.333 -10.282 414 HG3 PRO 58 HG1 PRO 58 5.519 -4.955 -11.953 415 HD2 PRO 58 HD2 PRO 58 4.332 -3.819 -9.773 416 HD3 PRO 58 HD1 PRO 58 3.521 -4.015 -11.335 417 H GLU 59 H GLU 59 3.221 -9.303 -9.802 418 HA GLU 59 HA GLU 59 3.345 -9.828 -7.164 419 HB2 GLU 59 HB2 GLU 59 4.358 -12.012 -7.754 420 HB3 GLU 59 HB1 GLU 59 3.040 -11.559 -8.831 421 HG2 GLU 59 HG2 GLU 59 4.538 -10.973 -10.567 422 HG3 GLU 59 HG1 GLU 59 5.927 -11.060 -9.489 423 H THR 60 H THR 60 6.023 -8.743 -9.058 424 HA THR 60 HA THR 60 7.934 -9.541 -6.984 425 HB THR 60 HB THR 60 8.491 -10.425 -9.153 426 HG1 THR 60 HG1 THR 60 10.421 -9.973 -8.386 427 HG21 THR 60 HG21 THR 60 7.262 -8.891 -10.563 428 HG22 THR 60 HG22 THR 60 8.946 -8.964 -11.083 429 HG23 THR 60 HG23 THR 60 8.369 -7.581 -10.152 430 H ALA 61 H ALA 61 6.100 -6.965 -7.553 431 HA ALA 61 HA ALA 61 8.050 -4.847 -7.612 432 HB1 ALA 61 HB1 ALA 61 5.106 -4.784 -6.957 433 HB2 ALA 61 HB2 ALA 61 5.833 -4.480 -8.535 434 HB3 ALA 61 HB3 ALA 61 6.129 -3.368 -7.200 435 H ASN 62 H ASN 62 8.486 -3.377 -5.870 436 HA ASN 62 HA ASN 62 7.823 -4.429 -3.213 437 HB2 ASN 62 HB2 ASN 62 10.085 -4.215 -2.429 438 HB3 ASN 62 HB1 ASN 62 10.088 -5.231 -3.864 439 HD21 ASN 62 HD21 ASN 62 12.193 -3.609 -2.594 440 HD22 ASN 62 HD22 ASN 62 12.789 -2.568 -3.841 441 H SER 63 H SER 63 7.161 -1.951 -4.989 442 HA SER 63 HA SER 63 7.016 -0.141 -2.802 443 HB2 SER 63 HB2 SER 63 8.501 1.633 -3.878 444 HB3 SER 63 HB1 SER 63 9.335 0.264 -3.148 445 HG SER 63 HG SER 63 8.797 -0.329 -5.692 446 H VAL 64 H VAL 64 5.480 1.375 -3.152 447 HA VAL 64 HA VAL 64 4.571 1.803 -5.928 448 HB VAL 64 HB VAL 64 2.780 0.623 -4.815 449 HG11 VAL 64 HG11 VAL 64 2.078 0.927 -2.728 450 HG12 VAL 64 HG12 VAL 64 2.319 2.671 -2.779 451 HG13 VAL 64 HG13 VAL 64 3.690 1.595 -2.516 452 HG21 VAL 64 HG21 VAL 64 0.992 2.212 -4.946 453 HG22 VAL 64 HG22 VAL 64 2.117 2.344 -6.294 454 HG23 VAL 64 HG23 VAL 64 2.166 3.528 -4.987 455 H THR 65 H THR 65 4.433 3.879 -6.620 456 HA THR 65 HA THR 65 4.839 6.036 -4.708 457 HB THR 65 HB THR 65 4.837 5.870 -7.707 458 HG1 THR 65 HG1 THR 65 6.679 5.218 -6.130 459 HG21 THR 65 HG21 THR 65 3.935 8.058 -7.074 460 HG22 THR 65 HG22 THR 65 5.577 8.242 -7.697 461 HG23 THR 65 HG23 THR 65 5.282 8.308 -5.961 462 H LEU 66 H LEU 66 2.947 6.414 -3.732 463 HA LEU 66 HA LEU 66 0.402 6.387 -5.076 464 HB2 LEU 66 HB2 LEU 66 0.541 7.768 -2.518 465 HB3 LEU 66 HB1 LEU 66 -0.496 6.453 -3.024 466 HG LEU 66 HG LEU 66 2.358 5.969 -2.265 467 HD11 LEU 66 HD11 LEU 66 0.080 5.663 -0.384 468 HD12 LEU 66 HD12 LEU 66 0.968 7.176 -0.509 469 HD13 LEU 66 HD13 LEU 66 1.815 5.699 -0.066 470 HD21 LEU 66 HD21 LEU 66 -0.133 4.302 -2.429 471 HD22 LEU 66 HD22 LEU 66 1.401 3.732 -1.762 472 HD23 LEU 66 HD23 LEU 66 1.290 4.188 -3.465 473 H SER 67 H SER 67 -0.878 8.200 -5.522 474 HA SER 67 HA SER 67 0.400 10.809 -5.248 475 HB2 SER 67 HB2 SER 67 1.005 9.847 -7.492 476 HB3 SER 67 HB1 SER 67 -0.715 9.808 -7.882 477 HG SER 67 HG SER 67 -0.404 11.778 -8.534 478 H ASP 68 H ASP 68 -1.301 12.481 -6.255 479 HA ASP 68 HA ASP 68 -3.288 13.537 -5.972 480 HB2 ASP 68 HB2 ASP 68 -4.155 10.723 -6.337 481 HB3 ASP 68 HB1 ASP 68 -5.333 11.833 -5.647 482 H LEU 69 H LEU 69 -1.670 12.481 -3.607 483 HA LEU 69 HA LEU 69 -3.585 12.061 -1.530 484 HB2 LEU 69 HB2 LEU 69 -0.835 13.136 -0.993 485 HB3 LEU 69 HB1 LEU 69 -1.848 12.119 0.012 486 HG LEU 69 HG LEU 69 -0.389 11.228 -2.455 487 HD11 LEU 69 HD11 LEU 69 1.054 11.661 -0.550 488 HD12 LEU 69 HD12 LEU 69 0.907 9.927 -0.842 489 HD13 LEU 69 HD13 LEU 69 0.012 10.681 0.479 490 HD21 LEU 69 HD21 LEU 69 -2.340 9.954 -0.579 491 HD22 LEU 69 HD22 LEU 69 -1.139 8.968 -1.424 492 HD23 LEU 69 HD23 LEU 69 -2.326 9.903 -2.345 493 H GLN 70 H GLN 70 -3.089 13.684 0.505 494 HA GLN 70 HA GLN 70 -3.507 16.414 -0.486 495 HB2 GLN 70 HB2 GLN 70 -5.667 15.358 0.160 496 HB3 GLN 70 HB1 GLN 70 -5.028 15.089 1.776 497 HG2 GLN 70 HG2 GLN 70 -6.459 17.014 1.785 498 HG3 GLN 70 HG1 GLN 70 -4.795 17.526 2.055 499 HE21 GLN 70 HE21 GLN 70 -5.250 19.618 1.372 500 HE22 GLN 70 HE22 GLN 70 -5.504 20.008 -0.292 501 HA PRO 71 HA PRO 71 -0.051 17.136 2.219 502 HB2 PRO 71 HB2 PRO 71 -0.402 19.852 2.468 503 HB3 PRO 71 HB1 PRO 71 0.434 19.045 1.141 504 HG2 PRO 71 HG2 PRO 71 -2.357 20.093 1.264 505 HG3 PRO 71 HG1 PRO 71 -1.198 20.143 -0.076 506 HD2 PRO 71 HD2 PRO 71 -3.228 18.379 -0.008 507 HD3 PRO 71 HD1 PRO 71 -1.650 17.967 -0.712 508 H GLY 72 H GLY 72 0.189 16.988 4.352 509 HA2 GLY 72 HA2 GLY 72 -0.095 17.465 6.598 510 HA3 GLY 72 HA1 GLY 72 -1.403 18.559 6.173 511 H VAL 73 H VAL 73 -1.142 15.150 5.282 512 HA VAL 73 HA VAL 73 -3.452 14.578 7.017 513 HB VAL 73 HB VAL 73 -3.241 13.766 4.118 514 HG11 VAL 73 HG11 VAL 73 -5.252 13.240 6.254 515 HG12 VAL 73 HG12 VAL 73 -4.515 12.109 5.113 516 HG13 VAL 73 HG13 VAL 73 -5.714 13.290 4.555 517 HG21 VAL 73 HG21 VAL 73 -5.355 15.176 3.991 518 HG22 VAL 73 HG22 VAL 73 -3.795 16.006 3.986 519 HG23 VAL 73 HG23 VAL 73 -4.765 15.948 5.462 520 H GLN 74 H GLN 74 -3.719 12.418 7.617 521 HA GLN 74 HA GLN 74 -1.273 10.856 7.604 522 HB2 GLN 74 HB2 GLN 74 -2.385 11.242 9.720 523 HB3 GLN 74 HB1 GLN 74 -3.895 10.637 9.057 524 HG2 GLN 74 HG2 GLN 74 -3.176 8.812 10.248 525 HG3 GLN 74 HG1 GLN 74 -2.488 8.463 8.664 526 HE21 GLN 74 HE21 GLN 74 -0.232 8.792 8.343 527 HE22 GLN 74 HE22 GLN 74 0.856 8.836 9.685 528 H TYR 75 H TYR 75 -1.086 9.681 5.797 529 HA TYR 75 HA TYR 75 -3.457 8.464 4.622 530 HB2 TYR 75 HB2 TYR 75 -0.795 9.292 3.605 531 HB3 TYR 75 HB1 TYR 75 -1.529 7.868 2.852 532 HD1 TYR 75 HD2 TYR 75 -1.982 11.478 3.493 533 HD2 TYR 75 HD1 TYR 75 -3.457 8.043 1.463 534 HE1 TYR 75 HE2 TYR 75 -3.470 12.908 2.156 535 HE2 TYR 75 HE1 TYR 75 -4.951 9.464 0.128 536 HH TYR 75 HH TYR 75 -4.690 12.861 0.038 537 H ASN 76 H ASN 76 -3.949 6.473 5.019 538 HA ASN 76 HA ASN 76 -1.966 4.632 6.095 539 HB2 ASN 76 HB2 ASN 76 -4.931 4.201 5.629 540 HB3 ASN 76 HB1 ASN 76 -3.855 3.141 6.531 541 HD21 ASN 76 HD21 ASN 76 -6.274 4.360 7.444 542 HD22 ASN 76 HD22 ASN 76 -5.859 5.372 8.785 543 H ILE 77 H ILE 77 -0.767 3.622 4.647 544 HA ILE 77 HA ILE 77 -1.878 2.876 2.047 545 HB ILE 77 HB ILE 77 0.945 2.622 3.097 546 HG12 ILE 77 HG12 ILE 77 1.228 4.281 1.101 547 HG13 ILE 77 HG11 ILE 77 -0.429 4.688 1.456 548 HG21 ILE 77 HG21 ILE 77 -0.317 1.763 0.553 549 HG22 ILE 77 HG22 ILE 77 0.960 0.985 1.501 550 HG23 ILE 77 HG23 ILE 77 1.320 2.415 0.519 551 HD11 ILE 77 HD11 ILE 77 0.202 5.246 3.754 552 HD12 ILE 77 HD12 ILE 77 1.087 6.207 2.567 553 HD13 ILE 77 HD13 ILE 77 1.879 4.854 3.375 554 H THR 78 H THR 78 -2.779 1.004 1.823 555 HA THR 78 HA THR 78 -2.006 -1.162 3.617 556 HB THR 78 HB THR 78 -4.480 -0.851 1.937 557 HG1 THR 78 HG1 THR 78 -4.748 0.643 3.488 558 HG21 THR 78 HG21 THR 78 -3.830 -2.747 4.199 559 HG22 THR 78 HG22 THR 78 -3.909 -3.180 2.491 560 HG23 THR 78 HG23 THR 78 -5.365 -2.658 3.337 561 H ILE 79 H ILE 79 -0.664 -2.619 2.738 562 HA ILE 79 HA ILE 79 -0.645 -2.939 -0.199 563 HB ILE 79 HB ILE 79 1.307 -4.297 1.668 564 HG12 ILE 79 HG12 ILE 79 1.849 -2.026 2.064 565 HG13 ILE 79 HG11 ILE 79 2.968 -2.604 0.831 566 HG21 ILE 79 HG21 ILE 79 1.236 -3.751 -1.264 567 HG22 ILE 79 HG22 ILE 79 1.320 -5.309 -0.432 568 HG23 ILE 79 HG23 ILE 79 2.706 -4.210 -0.409 569 HD11 ILE 79 HD11 ILE 79 1.891 -0.285 0.609 570 HD12 ILE 79 HD12 ILE 79 0.491 -1.180 0.015 571 HD13 ILE 79 HD13 ILE 79 2.050 -1.327 -0.812 572 H TYR 80 H TYR 80 -1.239 -4.778 -1.187 573 HA TYR 80 HA TYR 80 -2.049 -7.072 0.485 574 HB2 TYR 80 HB2 TYR 80 -3.359 -6.098 -2.065 575 HB3 TYR 80 HB1 TYR 80 -3.860 -7.483 -1.113 576 HD1 TYR 80 HD1 TYR 80 -5.081 -7.194 0.950 577 HD2 TYR 80 HD2 TYR 80 -3.905 -3.806 -1.370 578 HE1 TYR 80 HE1 TYR 80 -6.689 -5.803 2.175 579 HE2 TYR 80 HE2 TYR 80 -5.510 -2.415 -0.137 580 HH TYR 80 HH TYR 80 -7.713 -2.838 1.149 581 H ALA 81 H ALA 81 -0.517 -8.619 0.041 582 HA ALA 81 HA ALA 81 0.561 -8.970 -2.624 583 HB1 ALA 81 HB1 ALA 81 0.785 -10.686 -0.135 584 HB2 ALA 81 HB2 ALA 81 1.987 -9.554 -0.753 585 HB3 ALA 81 HB3 ALA 81 1.613 -11.024 -1.661 586 H VAL 82 H VAL 82 -0.646 -9.856 -4.196 587 HA VAL 82 HA VAL 82 -2.868 -11.595 -3.304 588 HB VAL 82 HB VAL 82 -3.662 -9.633 -4.535 589 HG11 VAL 82 HG11 VAL 82 -3.267 -9.387 -6.922 590 HG12 VAL 82 HG12 VAL 82 -2.086 -10.695 -6.848 591 HG13 VAL 82 HG13 VAL 82 -1.793 -9.190 -5.972 592 HG21 VAL 82 HG21 VAL 82 -5.107 -10.751 -6.102 593 HG22 VAL 82 HG22 VAL 82 -4.890 -11.772 -4.678 594 HG23 VAL 82 HG23 VAL 82 -4.011 -12.134 -6.167 595 H GLU 83 H GLU 83 -3.114 -13.599 -3.992 596 HA GLU 83 HA GLU 83 -1.137 -14.690 -5.880 597 HB2 GLU 83 HB2 GLU 83 -0.792 -15.484 -3.638 598 HB3 GLU 83 HB1 GLU 83 -2.478 -15.954 -3.490 599 HG2 GLU 83 HG2 GLU 83 -1.664 -17.326 -5.705 600 HG3 GLU 83 HG1 GLU 83 -0.222 -17.336 -4.703 601 H GLU 84 H GLU 84 -2.063 -16.653 -7.038 602 HA GLU 84 HA GLU 84 -4.250 -16.210 -8.553 603 HB2 GLU 84 HB2 GLU 84 -3.508 -18.956 -7.551 604 HB3 GLU 84 HB1 GLU 84 -4.281 -18.551 -9.076 605 HG2 GLU 84 HG2 GLU 84 -2.264 -17.465 -9.848 606 HG3 GLU 84 HG1 GLU 84 -1.491 -17.759 -8.292 607 H ASN 85 H ASN 85 -4.289 -17.921 -5.414 608 HA ASN 85 HA ASN 85 -7.170 -18.321 -5.736 609 HB2 ASN 85 HB2 ASN 85 -5.336 -19.510 -3.655 610 HB3 ASN 85 HB1 ASN 85 -6.992 -19.990 -3.994 611 HD21 ASN 85 HD21 ASN 85 -3.697 -20.105 -5.040 612 HD22 ASN 85 HD22 ASN 85 -3.905 -21.351 -6.231 613 H GLN 86 H GLN 86 -4.906 -16.571 -3.702 614 HA GLN 86 HA GLN 86 -7.117 -15.612 -2.059 615 HB2 GLN 86 HB2 GLN 86 -4.839 -17.271 -1.007 616 HB3 GLN 86 HB1 GLN 86 -5.692 -16.122 0.016 617 HG2 GLN 86 HG2 GLN 86 -7.038 -18.364 -1.468 618 HG3 GLN 86 HG1 GLN 86 -6.473 -18.477 0.199 619 HE21 GLN 86 HE21 GLN 86 -7.494 -17.255 1.794 620 HE22 GLN 86 HE22 GLN 86 -9.071 -16.600 1.566 621 H GLU 87 H GLU 87 -6.346 -14.003 -0.443 622 HA GLU 87 HA GLU 87 -4.010 -12.525 -1.464 623 HB2 GLU 87 HB2 GLU 87 -6.453 -11.460 -0.031 624 HB3 GLU 87 HB1 GLU 87 -5.071 -10.497 -0.528 625 HG2 GLU 87 HG2 GLU 87 -5.551 -11.083 -2.873 626 HG3 GLU 87 HG1 GLU 87 -6.989 -11.949 -2.334 627 H SER 88 H SER 88 -2.539 -11.751 0.024 628 HA SER 88 HA SER 88 -2.366 -13.195 2.485 629 HB2 SER 88 HB2 SER 88 -0.677 -10.887 1.500 630 HB3 SER 88 HB1 SER 88 -0.246 -12.048 2.756 631 HG SER 88 HG SER 88 0.711 -12.829 0.967 632 H THR 89 H THR 89 -1.859 -12.004 4.552 633 HA THR 89 HA THR 89 -3.910 -10.291 5.357 634 HB THR 89 HB THR 89 -2.199 -9.723 7.247 635 HG1 THR 89 HG1 THR 89 -0.951 -12.069 6.238 636 HG21 THR 89 HG21 THR 89 -3.185 -12.539 6.776 637 HG22 THR 89 HG22 THR 89 -4.087 -11.230 7.540 638 HG23 THR 89 HG23 THR 89 -2.654 -11.891 8.328 639 HA PRO 90 HA PRO 90 -2.661 -6.493 3.639 640 HB2 PRO 90 HB2 PRO 90 -4.056 -4.756 5.148 641 HB3 PRO 90 HB1 PRO 90 -4.843 -5.885 4.040 642 HG2 PRO 90 HG2 PRO 90 -4.506 -6.070 7.007 643 HG3 PRO 90 HG1 PRO 90 -5.917 -6.469 6.011 644 HD2 PRO 90 HD2 PRO 90 -4.147 -8.317 6.975 645 HD3 PRO 90 HD1 PRO 90 -5.130 -8.538 5.518 646 H VAL 91 H VAL 91 -0.986 -5.201 3.746 647 HA VAL 91 HA VAL 91 0.460 -4.520 6.162 648 HB VAL 91 HB VAL 91 0.601 -3.630 3.291 649 HG11 VAL 91 HG11 VAL 91 2.452 -2.178 3.890 650 HG12 VAL 91 HG12 VAL 91 2.250 -2.592 5.587 651 HG13 VAL 91 HG13 VAL 91 0.990 -1.697 4.740 652 HG21 VAL 91 HG21 VAL 91 2.632 -5.005 5.040 653 HG22 VAL 91 HG22 VAL 91 2.815 -4.588 3.333 654 HG23 VAL 91 HG23 VAL 91 1.622 -5.796 3.825 655 H VAL 92 H VAL 92 -0.259 -2.827 7.480 656 HA VAL 92 HA VAL 92 -1.466 -0.573 6.021 657 HB VAL 92 HB VAL 92 -2.070 -1.190 8.915 658 HG11 VAL 92 HG11 VAL 92 -3.915 0.411 8.520 659 HG12 VAL 92 HG12 VAL 92 -3.288 0.688 6.895 660 HG13 VAL 92 HG13 VAL 92 -2.322 1.132 8.301 661 HG21 VAL 92 HG21 VAL 92 -4.260 -1.994 8.166 662 HG22 VAL 92 HG22 VAL 92 -2.961 -2.996 7.516 663 HG23 VAL 92 HG23 VAL 92 -3.758 -1.808 6.486 664 H ILE 93 H ILE 93 0.122 0.819 5.808 665 HA ILE 93 HA ILE 93 1.683 1.541 8.197 666 HB ILE 93 HB ILE 93 3.417 2.383 6.488 667 HG12 ILE 93 HG12 ILE 93 2.174 0.333 4.688 668 HG13 ILE 93 HG11 ILE 93 1.743 2.020 4.576 669 HG21 ILE 93 HG21 ILE 93 4.465 0.175 6.336 670 HG22 ILE 93 HG22 ILE 93 2.942 -0.576 6.815 671 HG23 ILE 93 HG23 ILE 93 3.800 0.476 7.942 672 HD11 ILE 93 HD11 ILE 93 4.123 2.565 4.257 673 HD12 ILE 93 HD12 ILE 93 3.428 1.560 2.971 674 HD13 ILE 93 HD13 ILE 93 4.459 0.832 4.208 675 H GLN 94 H GLN 94 1.143 3.480 8.934 676 HA GLN 94 HA GLN 94 -0.198 5.312 7.093 677 HB2 GLN 94 HB2 GLN 94 -0.993 6.453 9.160 678 HB3 GLN 94 HB1 GLN 94 -1.531 4.790 8.998 679 HG2 GLN 94 HG2 GLN 94 0.314 4.129 10.540 680 HG3 GLN 94 HG1 GLN 94 0.628 5.845 10.801 681 HE21 GLN 94 HE21 GLN 94 -1.557 3.213 11.345 682 HE22 GLN 94 HE22 GLN 94 -2.533 3.998 12.538 683 H GLN 95 H GLN 95 0.739 7.046 6.377 684 HA GLN 95 HA GLN 95 2.969 8.230 7.890 685 HB2 GLN 95 HB2 GLN 95 3.023 7.064 5.269 686 HB3 GLN 95 HB1 GLN 95 3.302 8.790 5.130 687 HG2 GLN 95 HG2 GLN 95 4.852 6.913 6.896 688 HG3 GLN 95 HG1 GLN 95 5.384 7.539 5.336 689 HE21 GLN 95 HE21 GLN 95 4.098 10.154 5.931 690 HE22 GLN 95 HE22 GLN 95 5.206 10.952 7.003 691 H GLU 96 H GLU 96 2.754 10.380 8.248 692 HA GLU 96 HA GLU 96 0.489 11.756 7.069 693 HB2 GLU 96 HB2 GLU 96 2.568 12.722 9.041 694 HB3 GLU 96 HB1 GLU 96 1.176 13.653 8.502 695 HG2 GLU 96 HG2 GLU 96 -0.324 12.033 9.493 696 HG3 GLU 96 HG1 GLU 96 1.050 11.048 9.996 697 H THR 97 H THR 97 0.563 13.045 5.394 698 HA THR 97 HA THR 97 2.933 13.339 3.856 699 HB THR 97 HB THR 97 1.486 14.780 2.407 700 HG1 THR 97 HG1 THR 97 -0.810 14.776 3.078 701 HG21 THR 97 HG21 THR 97 1.535 12.306 2.172 702 HG22 THR 97 HG22 THR 97 -0.017 13.007 1.712 703 HG23 THR 97 HG23 THR 97 0.162 12.205 3.273 704 H THR 98 H THR 98 4.495 14.792 4.138 705 HA THR 98 HA THR 98 4.329 16.868 6.068 706 HB THR 98 HB THR 98 6.402 16.628 3.888 707 HG1 THR 98 HG1 THR 98 6.163 15.212 6.357 708 HG21 THR 98 HG21 THR 98 6.515 18.660 5.255 709 HG22 THR 98 HG22 THR 98 7.888 17.603 5.582 710 HG23 THR 98 HG23 THR 98 6.543 17.679 6.720 711 H GLY 99 H GLY 99 3.968 16.720 2.596 712 HA2 GLY 99 HA2 GLY 99 2.430 18.281 1.571 713 HA3 GLY 99 HA1 GLY 99 3.018 19.500 2.676 714 H THR 100 H THR 100 3.269 20.763 0.708 715 HA THR 100 HA THR 100 5.413 19.993 -1.084 716 HB THR 100 HB THR 100 3.863 22.588 -0.985 717 HG1 THR 100 HG1 THR 100 3.340 20.084 -2.213 718 HG21 THR 100 HG21 THR 100 5.927 22.747 -2.225 719 HG22 THR 100 HG22 THR 100 4.541 22.802 -3.310 720 HG23 THR 100 HG23 THR 100 5.493 21.324 -3.170 721 HA PRO 101 HA PRO 101 8.615 21.746 1.529 722 HB2 PRO 101 HB2 PRO 101 9.919 21.939 -1.150 723 HB3 PRO 101 HB1 PRO 101 10.556 21.288 0.364 724 HG2 PRO 101 HG2 PRO 101 9.751 19.653 -1.567 725 HG3 PRO 101 HG1 PRO 101 9.412 19.280 0.133 726 HD2 PRO 101 HD2 PRO 101 7.580 20.312 -1.984 727 HD3 PRO 101 HD1 PRO 101 7.246 19.197 -0.643 728 H ARG 102 H ARG 102 8.018 23.746 2.165 729 HA ARG 102 HA ARG 102 7.415 25.821 0.262 730 HB2 ARG 102 HB2 ARG 102 6.915 27.193 2.237 731 HB3 ARG 102 HB1 ARG 102 6.096 25.638 2.300 732 HG2 ARG 102 HG2 ARG 102 7.723 24.800 3.874 733 HG3 ARG 102 HG1 ARG 102 8.647 26.299 3.756 734 HD2 ARG 102 HD2 ARG 102 6.736 27.537 4.658 735 HD3 ARG 102 HD1 ARG 102 5.827 26.031 4.786 736 HE ARG 102 HE ARG 102 8.012 25.476 6.225 737 HH11 ARG 102 HH11 ARG 102 5.878 28.250 6.258 738 HH12 ARG 102 HH12 ARG 102 6.104 28.564 7.951 739 HH21 ARG 102 HH21 ARG 102 8.311 25.878 8.435 740 HH22 ARG 102 HH22 ARG 102 7.482 27.199 9.194 741 H SER 103 H SER 103 8.468 27.796 0.039 742 HA SER 103 HA SER 103 11.299 27.750 0.841 743 HB2 SER 103 HB2 SER 103 10.039 29.220 -1.486 744 HB3 SER 103 HB1 SER 103 11.762 29.077 -1.139 745 HG SER 103 HG SER 103 11.132 26.660 -1.222 746 H ASP 104 H ASP 104 8.764 28.837 2.162 747 HA ASP 104 HA ASP 104 9.886 31.467 2.811 748 HB2 ASP 104 HB2 ASP 104 7.954 31.710 1.219 749 HB3 ASP 104 HB1 ASP 104 6.928 30.959 2.436 750 H GLY 105 H GLY 105 9.384 32.197 4.949 751 HA2 GLY 105 HA2 GLY 105 8.653 31.912 7.155 752 HA3 GLY 105 HA1 GLY 105 8.067 30.308 6.732 753 H THR 106 H THR 106 9.456 28.560 6.809 754 HA THR 106 HA THR 106 12.145 29.113 7.869 755 HB THR 106 HB THR 106 10.579 26.597 8.449 756 HG1 THR 106 HG1 THR 106 10.386 29.115 9.583 757 HG21 THR 106 HG21 THR 106 12.204 26.348 10.264 758 HG22 THR 106 HG22 THR 106 12.979 27.857 9.784 759 HG23 THR 106 HG23 THR 106 13.017 26.463 8.704 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 -0.315 -38.684 -6.390 2 H2 GLY 1 HT2 GLY 1 -0.440 -38.880 -8.063 3 H3 GLY 1 HT3 GLY 1 0.042 -40.180 -7.094 4 HA2 GLY 1 HA1 GLY 1 -2.245 -40.466 -7.764 5 HA3 GLY 1 HA2 GLY 1 -2.126 -40.224 -6.025 6 H SER 2 H SER 2 -4.220 -39.418 -5.816 7 HA SER 2 HA SER 2 -5.282 -37.315 -7.359 8 HB2 SER 2 HB2 SER 2 -6.836 -37.048 -5.352 9 HB3 SER 2 HB1 SER 2 -6.801 -38.645 -6.098 10 HG SER 2 HG SER 2 -6.669 -38.775 -3.826 11 H HIS 3 H HIS 3 -5.401 -35.091 -6.974 12 HA HIS 3 HA HIS 3 -3.080 -34.060 -5.569 13 HB2 HIS 3 HB2 HIS 3 -3.819 -33.313 -7.898 14 HB3 HIS 3 HB1 HIS 3 -5.126 -32.449 -7.097 15 HD1 HIS 3 HD1 HIS 3 -1.447 -32.355 -7.682 16 HD2 HIS 3 HD2 HIS 3 -4.336 -30.135 -5.685 17 HE1 HIS 3 HE1 HIS 3 -0.326 -30.195 -7.060 18 HE2 HIS 3 HE2 HIS 3 -2.146 -28.803 -6.019 19 H MET 4 H MET 4 -4.466 -35.004 -3.621 20 HA MET 4 HA MET 4 -6.150 -32.865 -2.535 21 HB2 MET 4 HB2 MET 4 -7.049 -35.156 -2.396 22 HB3 MET 4 HB1 MET 4 -5.637 -35.653 -1.471 23 HG2 MET 4 HG2 MET 4 -7.577 -35.265 -0.042 24 HG3 MET 4 HG1 MET 4 -6.255 -34.160 0.332 25 HE1 MET 4 HE1 MET 4 -9.133 -33.608 1.427 26 HE2 MET 4 HE2 MET 4 -9.342 -31.898 1.058 27 HE3 MET 4 HE3 MET 4 -7.792 -32.488 1.658 28 H GLY 5 H GLY 5 -4.783 -31.316 -1.839 29 HA2 GLY 5 HA2 GLY 5 -3.600 -31.256 0.562 30 HA3 GLY 5 HA1 GLY 5 -2.361 -32.030 -0.414 31 H THR 6 H THR 6 -1.075 -30.165 0.162 32 HA THR 6 HA THR 6 -0.068 -28.188 -0.301 33 HB THR 6 HB THR 6 -1.730 -28.078 -2.821 34 HG1 THR 6 HG1 THR 6 -0.783 -30.021 -3.032 35 HG21 THR 6 HG21 THR 6 1.037 -27.055 -2.161 36 HG22 THR 6 HG22 THR 6 -0.418 -26.068 -2.306 37 HG23 THR 6 HG23 THR 6 0.226 -26.902 -3.720 38 H THR 7 H THR 7 -1.580 -27.669 1.565 39 HA THR 7 HA THR 7 -3.838 -25.999 1.056 40 HB THR 7 HB THR 7 -2.236 -26.303 3.607 41 HG1 THR 7 HG1 THR 7 -3.920 -27.861 4.096 42 HG21 THR 7 HG21 THR 7 -3.722 -24.353 3.609 43 HG22 THR 7 HG22 THR 7 -4.310 -25.596 4.712 44 HG23 THR 7 HG23 THR 7 -5.076 -25.379 3.139 45 H THR 8 H THR 8 -3.513 -24.130 0.036 46 HA THR 8 HA THR 8 -1.107 -22.660 0.099 47 HB THR 8 HB THR 8 -3.833 -21.635 -0.707 48 HG1 THR 8 HG1 THR 8 -1.886 -22.905 -2.363 49 HG21 THR 8 HG21 THR 8 -2.036 -19.945 -0.492 50 HG22 THR 8 HG22 THR 8 -2.594 -20.135 -2.154 51 HG23 THR 8 HG23 THR 8 -1.069 -20.860 -1.646 52 H ALA 9 H ALA 9 -0.358 -21.346 1.596 53 HA ALA 9 HA ALA 9 -2.177 -19.654 3.111 54 HB1 ALA 9 HB1 ALA 9 -1.932 -21.620 4.531 55 HB2 ALA 9 HB2 ALA 9 -1.150 -20.213 5.253 56 HB3 ALA 9 HB3 ALA 9 -0.177 -21.456 4.467 57 HA PRO 10 HA PRO 10 1.574 -17.471 1.711 58 HB2 PRO 10 HB2 PRO 10 0.337 -15.265 0.827 59 HB3 PRO 10 HB1 PRO 10 0.362 -16.754 -0.124 60 HG2 PRO 10 HG2 PRO 10 -1.811 -15.622 1.587 61 HG3 PRO 10 HG1 PRO 10 -1.930 -16.424 0.012 62 HD2 PRO 10 HD2 PRO 10 -2.428 -17.652 2.410 63 HD3 PRO 10 HD1 PRO 10 -1.969 -18.491 0.961 64 H ASP 11 H ASP 11 2.102 -15.017 2.074 65 HA ASP 11 HA ASP 11 1.095 -14.026 4.617 66 HB2 ASP 11 HB2 ASP 11 3.440 -13.669 5.436 67 HB3 ASP 11 HB1 ASP 11 2.961 -15.359 5.351 68 H ALA 12 H ALA 12 1.616 -11.797 4.962 69 HA ALA 12 HA ALA 12 1.810 -10.341 2.436 70 HB1 ALA 12 HB1 ALA 12 1.094 -8.414 3.774 71 HB2 ALA 12 HB2 ALA 12 1.198 -9.388 5.240 72 HB3 ALA 12 HB3 ALA 12 0.011 -9.788 4.000 73 HA PRO 13 HA PRO 13 5.991 -8.970 3.043 74 HB2 PRO 13 HB2 PRO 13 5.129 -6.259 2.245 75 HB3 PRO 13 HB1 PRO 13 6.306 -7.330 1.479 76 HG2 PRO 13 HG2 PRO 13 3.937 -6.881 0.351 77 HG3 PRO 13 HG1 PRO 13 4.671 -8.496 0.307 78 HD2 PRO 13 HD2 PRO 13 2.526 -7.436 2.103 79 HD3 PRO 13 HD1 PRO 13 2.603 -8.996 1.252 80 HA PRO 14 HA PRO 14 5.848 -7.211 7.193 81 HB2 PRO 14 HB2 PRO 14 8.745 -6.876 6.560 82 HB3 PRO 14 HB1 PRO 14 7.988 -7.581 7.993 83 HG2 PRO 14 HG2 PRO 14 9.101 -9.144 6.157 84 HG3 PRO 14 HG1 PRO 14 7.580 -9.611 6.940 85 HD2 PRO 14 HD2 PRO 14 8.044 -8.510 4.202 86 HD3 PRO 14 HD1 PRO 14 6.877 -9.731 4.747 87 H ASP 15 H ASP 15 5.986 -5.193 8.072 88 HA ASP 15 HA ASP 15 4.754 -3.335 6.611 89 HB2 ASP 15 HB2 ASP 15 6.655 -2.756 8.879 90 HB3 ASP 15 HB1 ASP 15 5.444 -1.634 8.271 91 HA PRO 16 HA PRO 16 7.873 -1.881 3.601 92 HB2 PRO 16 HB2 PRO 16 5.799 -0.163 2.723 93 HB3 PRO 16 HB1 PRO 16 6.360 -1.636 1.925 94 HG2 PRO 16 HG2 PRO 16 4.084 -1.200 3.808 95 HG3 PRO 16 HG1 PRO 16 4.212 -2.311 2.429 96 HD2 PRO 16 HD2 PRO 16 4.373 -3.300 4.885 97 HD3 PRO 16 HD1 PRO 16 5.527 -3.817 3.628 98 H THR 17 H THR 17 8.972 -0.027 3.503 99 HA THR 17 HA THR 17 8.324 2.048 5.500 100 HB THR 17 HB THR 17 10.994 1.565 4.156 101 HG1 THR 17 HG1 THR 17 9.969 0.580 6.632 102 HG21 THR 17 HG21 THR 17 11.866 2.908 6.013 103 HG22 THR 17 HG22 THR 17 10.229 3.110 6.637 104 HG23 THR 17 HG23 THR 17 10.672 3.809 5.080 105 H VAL 18 H VAL 18 7.824 3.935 4.884 106 HA VAL 18 HA VAL 18 7.625 4.622 2.096 107 HB VAL 18 HB VAL 18 7.119 6.272 4.574 108 HG11 VAL 18 HG11 VAL 18 7.691 7.750 2.747 109 HG12 VAL 18 HG12 VAL 18 5.957 7.832 3.049 110 HG13 VAL 18 HG13 VAL 18 6.569 6.917 1.666 111 HG21 VAL 18 HG21 VAL 18 5.613 4.329 4.204 112 HG22 VAL 18 HG22 VAL 18 5.172 5.024 2.644 113 HG23 VAL 18 HG23 VAL 18 4.790 5.888 4.132 114 H ASP 19 H ASP 19 9.110 5.481 0.892 115 HA ASP 19 HA ASP 19 11.663 6.239 2.038 116 HB2 ASP 19 HB2 ASP 19 11.733 4.756 0.156 117 HB3 ASP 19 HB1 ASP 19 10.706 5.822 -0.795 118 H GLN 20 H GLN 20 9.041 7.741 0.212 119 HA GLN 20 HA GLN 20 10.219 10.361 0.806 120 HB2 GLN 20 HB2 GLN 20 9.189 9.459 -1.884 121 HB3 GLN 20 HB1 GLN 20 9.428 11.147 -1.463 122 HG2 GLN 20 HG2 GLN 20 11.823 10.633 -1.036 123 HG3 GLN 20 HG1 GLN 20 11.530 9.007 -1.650 124 HE21 GLN 20 HE21 GLN 20 11.118 8.721 -3.849 125 HE22 GLN 20 HE22 GLN 20 11.471 9.926 -5.005 126 H VAL 21 H VAL 21 8.836 11.689 1.707 127 HA VAL 21 HA VAL 21 5.956 11.227 1.316 128 HB VAL 21 HB VAL 21 7.316 12.287 3.795 129 HG11 VAL 21 HG11 VAL 21 5.168 13.366 3.427 130 HG12 VAL 21 HG12 VAL 21 5.090 12.271 4.806 131 HG13 VAL 21 HG13 VAL 21 4.393 11.791 3.259 132 HG21 VAL 21 HG21 VAL 21 7.589 9.878 3.528 133 HG22 VAL 21 HG22 VAL 21 5.842 9.702 3.359 134 HG23 VAL 21 HG23 VAL 21 6.527 10.264 4.883 135 H ASP 22 H ASP 22 5.106 12.796 0.127 136 HA ASP 22 HA ASP 22 6.008 15.555 0.604 137 HB2 ASP 22 HB2 ASP 22 5.461 14.185 -2.023 138 HB3 ASP 22 HB1 ASP 22 5.406 15.937 -1.867 139 H ASP 23 H ASP 23 4.158 16.782 -1.084 140 HA ASP 23 HA ASP 23 1.899 16.888 0.617 141 HB2 ASP 23 HB2 ASP 23 1.002 18.432 -1.187 142 HB3 ASP 23 HB1 ASP 23 2.539 18.891 -0.484 143 H THR 24 H THR 24 2.102 16.001 -2.812 144 HA THR 24 HA THR 24 -0.462 14.576 -2.504 145 HB THR 24 HB THR 24 -0.836 15.196 -4.913 146 HG1 THR 24 HG1 THR 24 1.249 17.097 -4.497 147 HG21 THR 24 HG21 THR 24 -0.419 17.517 -3.014 148 HG22 THR 24 HG22 THR 24 -1.839 16.467 -3.038 149 HG23 THR 24 HG23 THR 24 -1.483 17.501 -4.425 150 H SER 25 H SER 25 2.013 13.327 -2.066 151 HA SER 25 HA SER 25 2.059 11.161 -3.836 152 HB2 SER 25 HB2 SER 25 4.324 11.544 -4.844 153 HB3 SER 25 HB1 SER 25 3.089 12.658 -5.433 154 HG SER 25 HG SER 25 5.077 13.171 -3.471 155 H ILE 26 H ILE 26 2.961 9.469 -2.812 156 HA ILE 26 HA ILE 26 5.107 9.880 -0.859 157 HB ILE 26 HB ILE 26 2.412 8.712 -0.145 158 HG12 ILE 26 HG12 ILE 26 4.191 10.721 1.242 159 HG13 ILE 26 HG11 ILE 26 2.732 11.089 0.335 160 HG21 ILE 26 HG21 ILE 26 4.064 7.059 0.510 161 HG22 ILE 26 HG22 ILE 26 3.377 7.853 1.929 162 HG23 ILE 26 HG23 ILE 26 4.985 8.303 1.359 163 HD11 ILE 26 HD11 ILE 26 2.233 11.161 2.669 164 HD12 ILE 26 HD12 ILE 26 2.929 9.555 2.913 165 HD13 ILE 26 HD13 ILE 26 1.447 9.741 1.973 166 H VAL 27 H VAL 27 6.453 7.993 -0.678 167 HA VAL 27 HA VAL 27 5.686 5.895 -2.617 168 HB VAL 27 HB VAL 27 8.493 6.762 -1.945 169 HG11 VAL 27 HG11 VAL 27 7.698 5.148 -4.332 170 HG12 VAL 27 HG12 VAL 27 7.832 4.361 -2.759 171 HG13 VAL 27 HG13 VAL 27 9.235 5.180 -3.462 172 HG21 VAL 27 HG21 VAL 27 6.854 7.385 -4.399 173 HG22 VAL 27 HG22 VAL 27 8.560 7.773 -4.174 174 HG23 VAL 27 HG23 VAL 27 7.340 8.534 -3.154 175 H VAL 28 H VAL 28 5.798 3.800 -1.906 176 HA VAL 28 HA VAL 28 7.029 3.418 0.726 177 HB VAL 28 HB VAL 28 5.222 2.494 1.658 178 HG11 VAL 28 HG11 VAL 28 3.720 3.806 -0.558 179 HG12 VAL 28 HG12 VAL 28 4.440 4.644 0.814 180 HG13 VAL 28 HG13 VAL 28 3.160 3.468 1.079 181 HG21 VAL 28 HG21 VAL 28 3.580 1.070 0.559 182 HG22 VAL 28 HG22 VAL 28 5.245 0.529 0.288 183 HG23 VAL 28 HG23 VAL 28 4.375 1.390 -0.983 184 H ARG 29 H ARG 29 7.940 1.403 1.131 185 HA ARG 29 HA ARG 29 8.337 -0.328 -1.235 186 HB2 ARG 29 HB2 ARG 29 10.458 0.524 0.757 187 HB3 ARG 29 HB1 ARG 29 10.696 -0.580 -0.587 188 HG2 ARG 29 HG2 ARG 29 10.310 1.199 -2.169 189 HG3 ARG 29 HG1 ARG 29 9.934 2.320 -0.858 190 HD2 ARG 29 HD2 ARG 29 12.236 2.572 -1.744 191 HD3 ARG 29 HD1 ARG 29 12.184 2.187 -0.025 192 HE ARG 29 HE ARG 29 12.541 -0.225 -0.940 193 HH11 ARG 29 HH11 ARG 29 13.986 2.711 -2.192 194 HH12 ARG 29 HH12 ARG 29 15.420 1.911 -2.747 195 HH21 ARG 29 HH21 ARG 29 14.450 -1.266 -1.657 196 HH22 ARG 29 HH22 ARG 29 15.692 -0.332 -2.430 197 H TRP 30 H TRP 30 7.764 -2.314 -0.827 198 HA TRP 30 HA TRP 30 7.652 -3.232 1.976 199 HB2 TRP 30 HB2 TRP 30 5.856 -4.815 1.194 200 HB3 TRP 30 HB1 TRP 30 5.417 -3.120 1.062 201 HD1 TRP 30 HD1 TRP 30 6.391 -6.086 -1.114 202 HE1 TRP 30 HE1 TRP 30 5.569 -5.669 -3.505 203 HE3 TRP 30 HE3 TRP 30 4.685 -1.347 -0.509 204 HZ2 TRP 30 HZ2 TRP 30 4.288 -3.609 -4.924 205 HZ3 TRP 30 HZ3 TRP 30 3.641 -0.234 -2.430 206 HH2 TRP 30 HH2 TRP 30 3.441 -1.326 -4.576 207 H SER 31 H SER 31 8.383 -5.269 2.513 208 HA SER 31 HA SER 31 10.244 -6.462 0.620 209 HB2 SER 31 HB2 SER 31 9.742 -7.131 3.534 210 HB3 SER 31 HB1 SER 31 11.086 -7.703 2.547 211 HG SER 31 HG SER 31 12.078 -5.969 3.166 212 H ARG 32 H ARG 32 9.184 -7.693 -0.795 213 HA ARG 32 HA ARG 32 6.770 -8.902 -0.644 214 HB2 ARG 32 HB2 ARG 32 9.110 -10.059 -2.145 215 HB3 ARG 32 HB1 ARG 32 7.411 -10.222 -2.544 216 HG2 ARG 32 HG2 ARG 32 7.992 -8.591 -4.019 217 HG3 ARG 32 HG1 ARG 32 7.532 -7.602 -2.631 218 HD2 ARG 32 HD2 ARG 32 9.591 -6.825 -2.325 219 HD3 ARG 32 HD1 ARG 32 10.325 -8.416 -2.583 220 HE ARG 32 HE ARG 32 9.352 -7.105 -4.973 221 HH11 ARG 32 HH11 ARG 32 12.083 -7.638 -2.846 222 HH12 ARG 32 HH12 ARG 32 13.264 -7.253 -4.061 223 HH21 ARG 32 HH21 ARG 32 10.905 -6.612 -6.574 224 HH22 ARG 32 HH22 ARG 32 12.594 -6.670 -6.175 225 HA PRO 33 HA PRO 33 6.925 -12.421 1.901 226 HB2 PRO 33 HB2 PRO 33 4.948 -13.823 0.345 227 HB3 PRO 33 HB1 PRO 33 4.697 -12.832 1.786 228 HG2 PRO 33 HG2 PRO 33 3.782 -12.175 -0.714 229 HG3 PRO 33 HG1 PRO 33 4.144 -10.984 0.557 230 HD2 PRO 33 HD2 PRO 33 5.838 -11.869 -1.747 231 HD3 PRO 33 HD1 PRO 33 5.542 -10.227 -1.147 232 H GLN 34 H GLN 34 7.117 -14.753 2.038 233 HA GLN 34 HA GLN 34 8.778 -15.894 -0.056 234 HB2 GLN 34 HB2 GLN 34 7.860 -17.106 2.556 235 HB3 GLN 34 HB1 GLN 34 9.092 -17.749 1.480 236 HG2 GLN 34 HG2 GLN 34 10.488 -15.803 1.881 237 HG3 GLN 34 HG1 GLN 34 9.253 -15.123 2.934 238 HE21 GLN 34 HE21 GLN 34 8.610 -17.738 4.097 239 HE22 GLN 34 HE22 GLN 34 9.909 -18.103 5.177 240 H ALA 35 H ALA 35 5.586 -15.535 0.564 241 HA ALA 35 HA ALA 35 4.532 -18.017 -0.382 242 HB1 ALA 35 HB1 ALA 35 3.167 -15.332 -0.463 243 HB2 ALA 35 HB2 ALA 35 3.341 -16.266 1.029 244 HB3 ALA 35 HB3 ALA 35 2.429 -16.933 -0.327 245 HA PRO 36 HA PRO 36 4.775 -16.995 -4.751 246 HB2 PRO 36 HB2 PRO 36 3.049 -18.858 -5.686 247 HB3 PRO 36 HB1 PRO 36 4.689 -19.266 -5.176 248 HG2 PRO 36 HG2 PRO 36 2.104 -19.666 -3.750 249 HG3 PRO 36 HG1 PRO 36 3.545 -20.695 -3.774 250 HD2 PRO 36 HD2 PRO 36 2.868 -18.959 -1.726 251 HD3 PRO 36 HD1 PRO 36 4.502 -19.577 -2.032 252 H ILE 37 H ILE 37 3.793 -15.180 -5.341 253 HA ILE 37 HA ILE 37 0.895 -14.902 -4.908 254 HB ILE 37 HB ILE 37 1.285 -12.485 -4.576 255 HG12 ILE 37 HG12 ILE 37 4.046 -13.295 -5.284 256 HG13 ILE 37 HG11 ILE 37 3.177 -11.817 -5.651 257 HG21 ILE 37 HG21 ILE 37 3.173 -13.682 -2.592 258 HG22 ILE 37 HG22 ILE 37 1.540 -14.350 -2.674 259 HG23 ILE 37 HG23 ILE 37 1.771 -12.617 -2.338 260 HD11 ILE 37 HD11 ILE 37 4.656 -12.541 -3.163 261 HD12 ILE 37 HD12 ILE 37 3.477 -11.233 -3.196 262 HD13 ILE 37 HD13 ILE 37 4.902 -11.164 -4.240 263 H THR 38 H THR 38 -0.223 -13.571 -6.493 264 HA THR 38 HA THR 38 0.988 -13.848 -9.137 265 HB THR 38 HB THR 38 -1.416 -13.282 -9.880 266 HG1 THR 38 HG1 THR 38 -2.982 -13.554 -8.348 267 HG21 THR 38 HG21 THR 38 -2.081 -15.607 -9.642 268 HG22 THR 38 HG22 THR 38 -0.800 -15.856 -8.457 269 HG23 THR 38 HG23 THR 38 -0.397 -15.458 -10.127 270 H GLY 39 H GLY 39 -0.339 -11.325 -7.026 271 HA2 GLY 39 HA2 GLY 39 1.066 -9.353 -8.543 272 HA3 GLY 39 HA1 GLY 39 -0.673 -9.239 -8.756 273 H TYR 40 H TYR 40 -0.074 -7.036 -7.783 274 HA TYR 40 HA TYR 40 -0.604 -7.248 -4.898 275 HB2 TYR 40 HB2 TYR 40 1.525 -5.610 -6.226 276 HB3 TYR 40 HB1 TYR 40 0.716 -4.987 -4.792 277 HD1 TYR 40 HD2 TYR 40 1.835 -8.435 -5.659 278 HD2 TYR 40 HD1 TYR 40 2.188 -5.125 -3.009 279 HE1 TYR 40 HE2 TYR 40 3.373 -9.717 -4.264 280 HE2 TYR 40 HE1 TYR 40 3.700 -6.429 -1.593 281 HH TYR 40 HH TYR 40 5.083 -9.369 -2.628 282 H ARG 41 H ARG 41 -2.331 -6.172 -4.319 283 HA ARG 41 HA ARG 41 -3.203 -3.842 -5.886 284 HB2 ARG 41 HB2 ARG 41 -4.639 -5.047 -3.550 285 HB3 ARG 41 HB1 ARG 41 -5.285 -4.109 -4.886 286 HG2 ARG 41 HG2 ARG 41 -5.030 -5.918 -6.397 287 HG3 ARG 41 HG1 ARG 41 -4.040 -6.810 -5.227 288 HD2 ARG 41 HD2 ARG 41 -6.935 -6.092 -4.860 289 HD3 ARG 41 HD1 ARG 41 -6.356 -7.667 -5.380 290 HE ARG 41 HE ARG 41 -5.030 -7.331 -3.107 291 HH11 ARG 41 HH11 ARG 41 -8.396 -6.674 -3.786 292 HH12 ARG 41 HH12 ARG 41 -8.941 -7.187 -2.220 293 HH21 ARG 41 HH21 ARG 41 -5.764 -8.039 -1.037 294 HH22 ARG 41 HH22 ARG 41 -7.455 -7.931 -0.663 295 H ILE 42 H ILE 42 -3.482 -1.837 -4.838 296 HA ILE 42 HA ILE 42 -2.339 -1.660 -2.128 297 HB ILE 42 HB ILE 42 -1.500 0.162 -4.357 298 HG12 ILE 42 HG12 ILE 42 0.125 -2.041 -3.119 299 HG13 ILE 42 HG11 ILE 42 -0.761 -2.227 -4.626 300 HG21 ILE 42 HG21 ILE 42 0.161 0.967 -2.815 301 HG22 ILE 42 HG22 ILE 42 -0.300 -0.245 -1.620 302 HG23 ILE 42 HG23 ILE 42 -1.416 1.056 -2.033 303 HD11 ILE 42 HD11 ILE 42 1.546 -1.772 -5.071 304 HD12 ILE 42 HD12 ILE 42 1.479 -0.313 -4.087 305 HD13 ILE 42 HD13 ILE 42 0.563 -0.404 -5.592 306 H VAL 43 H VAL 43 -3.910 -0.790 -0.912 307 HA VAL 43 HA VAL 43 -5.377 1.463 -2.127 308 HB VAL 43 HB VAL 43 -6.320 -0.331 0.112 309 HG11 VAL 43 HG11 VAL 43 -8.412 0.932 -0.057 310 HG12 VAL 43 HG12 VAL 43 -7.620 2.057 -1.159 311 HG13 VAL 43 HG13 VAL 43 -7.058 1.904 0.506 312 HG21 VAL 43 HG21 VAL 43 -8.009 -1.075 -1.442 313 HG22 VAL 43 HG22 VAL 43 -6.416 -1.330 -2.155 314 HG23 VAL 43 HG23 VAL 43 -7.407 0.035 -2.671 315 H TYR 44 H TYR 44 -4.544 3.274 -1.518 316 HA TYR 44 HA TYR 44 -3.806 3.631 1.283 317 HB2 TYR 44 HB2 TYR 44 -2.718 5.802 0.245 318 HB3 TYR 44 HB1 TYR 44 -1.879 4.258 0.191 319 HD1 TYR 44 HD2 TYR 44 -2.231 2.842 -1.951 320 HD2 TYR 44 HD1 TYR 44 -3.016 7.013 -1.731 321 HE1 TYR 44 HE2 TYR 44 -2.042 2.981 -4.385 322 HE2 TYR 44 HE1 TYR 44 -2.825 7.180 -4.173 323 HH TYR 44 HH TYR 44 -1.887 6.024 -6.028 324 H SER 45 H SER 45 -4.931 4.803 2.485 325 HA SER 45 HA SER 45 -6.865 6.701 1.393 326 HB2 SER 45 HB2 SER 45 -8.605 5.588 2.931 327 HB3 SER 45 HB1 SER 45 -8.219 4.776 1.415 328 HG SER 45 HG SER 45 -7.015 4.163 3.918 329 HA PRO 46 HA PRO 46 -5.727 9.012 5.076 330 HB2 PRO 46 HB2 PRO 46 -8.276 10.349 4.667 331 HB3 PRO 46 HB1 PRO 46 -6.654 11.024 4.664 332 HG2 PRO 46 HG2 PRO 46 -8.069 10.800 2.406 333 HG3 PRO 46 HG1 PRO 46 -6.314 10.545 2.433 334 HD2 PRO 46 HD2 PRO 46 -8.524 8.530 2.365 335 HD3 PRO 46 HD1 PRO 46 -6.979 8.549 1.485 336 H SER 47 H SER 47 -6.303 9.068 7.202 337 HA SER 47 HA SER 47 -7.992 6.988 8.118 338 HB2 SER 47 HB2 SER 47 -6.845 9.254 9.752 339 HB3 SER 47 HB1 SER 47 -7.310 7.650 10.320 340 HG SER 47 HG SER 47 -5.625 7.087 8.499 341 H VAL 48 H VAL 48 -8.470 10.433 7.683 342 HA VAL 48 HA VAL 48 -11.065 10.201 9.036 343 HB VAL 48 HB VAL 48 -9.729 11.865 10.097 344 HG11 VAL 48 HG11 VAL 48 -8.768 13.768 8.916 345 HG12 VAL 48 HG12 VAL 48 -9.362 13.124 7.386 346 HG13 VAL 48 HG13 VAL 48 -8.133 12.246 8.293 347 HG21 VAL 48 HG21 VAL 48 -12.064 12.454 9.883 348 HG22 VAL 48 HG22 VAL 48 -11.765 13.171 8.299 349 HG23 VAL 48 HG23 VAL 48 -11.071 13.904 9.745 350 H GLU 49 H GLU 49 -9.516 11.512 6.131 351 HA GLU 49 HA GLU 49 -11.404 10.759 4.296 352 HB2 GLU 49 HB2 GLU 49 -12.951 12.290 5.563 353 HB3 GLU 49 HB1 GLU 49 -11.904 13.631 5.115 354 HG2 GLU 49 HG2 GLU 49 -12.336 13.152 2.746 355 HG3 GLU 49 HG1 GLU 49 -13.426 11.852 3.223 356 H GLY 50 H GLY 50 -10.833 11.428 2.203 357 HA2 GLY 50 HA2 GLY 50 -9.542 13.632 1.335 358 HA3 GLY 50 HA1 GLY 50 -8.228 12.658 1.973 359 H SER 51 H SER 51 -7.216 12.106 0.084 360 HA SER 51 HA SER 51 -8.820 10.993 -2.081 361 HB2 SER 51 HB2 SER 51 -5.843 11.562 -1.983 362 HB3 SER 51 HB1 SER 51 -6.807 11.200 -3.419 363 HG SER 51 HG SER 51 -8.052 13.183 -2.390 364 H SER 52 H SER 52 -9.151 8.861 -2.180 365 HA SER 52 HA SER 52 -7.062 7.087 -1.087 366 HB2 SER 52 HB2 SER 52 -9.996 6.418 -1.475 367 HB3 SER 52 HB1 SER 52 -8.784 5.435 -0.651 368 HG SER 52 HG SER 52 -10.015 7.831 0.186 369 H THR 53 H THR 53 -6.248 5.493 -2.378 370 HA THR 53 HA THR 53 -7.443 5.104 -5.016 371 HB THR 53 HB THR 53 -4.586 6.055 -4.717 372 HG1 THR 53 HG1 THR 53 -6.938 7.399 -4.907 373 HG21 THR 53 HG21 THR 53 -4.934 4.553 -6.630 374 HG22 THR 53 HG22 THR 53 -4.595 6.204 -7.147 375 HG23 THR 53 HG23 THR 53 -6.245 5.588 -7.195 376 H GLU 54 H GLU 54 -6.591 3.279 -6.151 377 HA GLU 54 HA GLU 54 -5.095 1.372 -4.522 378 HB2 GLU 54 HB2 GLU 54 -7.495 0.792 -4.646 379 HB3 GLU 54 HB1 GLU 54 -7.398 0.802 -6.401 380 HG2 GLU 54 HG2 GLU 54 -5.718 -1.031 -6.248 381 HG3 GLU 54 HG1 GLU 54 -6.032 -1.102 -4.514 382 H LEU 55 H LEU 55 -3.165 1.032 -5.475 383 HA LEU 55 HA LEU 55 -3.060 1.127 -8.409 384 HB2 LEU 55 HB2 LEU 55 -0.773 1.278 -6.403 385 HB3 LEU 55 HB1 LEU 55 -0.567 1.142 -8.148 386 HG LEU 55 HG LEU 55 -1.726 3.419 -6.595 387 HD11 LEU 55 HD11 LEU 55 0.614 3.585 -6.785 388 HD12 LEU 55 HD12 LEU 55 -0.063 4.691 -7.980 389 HD13 LEU 55 HD13 LEU 55 0.579 3.130 -8.488 390 HD21 LEU 55 HD21 LEU 55 -2.223 4.495 -8.775 391 HD22 LEU 55 HD22 LEU 55 -3.249 3.105 -8.425 392 HD23 LEU 55 HD23 LEU 55 -1.911 2.949 -9.564 393 H ASN 56 H ASN 56 -1.760 -0.524 -9.508 394 HA ASN 56 HA ASN 56 -1.816 -3.072 -8.046 395 HB2 ASN 56 HB2 ASN 56 -2.738 -2.534 -10.869 396 HB3 ASN 56 HB1 ASN 56 -2.366 -4.149 -10.282 397 HD21 ASN 56 HD21 ASN 56 -3.684 -5.094 -8.719 398 HD22 ASN 56 HD22 ASN 56 -5.276 -4.496 -8.399 399 H LEU 57 H LEU 57 0.059 -4.043 -7.977 400 HA LEU 57 HA LEU 57 2.121 -3.225 -9.915 401 HB2 LEU 57 HB2 LEU 57 2.391 -3.768 -6.943 402 HB3 LEU 57 HB1 LEU 57 3.754 -3.693 -8.033 403 HG LEU 57 HG LEU 57 2.062 -1.521 -6.948 404 HD11 LEU 57 HD11 LEU 57 4.299 -2.033 -6.092 405 HD12 LEU 57 HD12 LEU 57 4.189 -0.410 -6.768 406 HD13 LEU 57 HD13 LEU 57 4.969 -1.699 -7.687 407 HD21 LEU 57 HD21 LEU 57 3.426 -1.340 -9.617 408 HD22 LEU 57 HD22 LEU 57 2.747 0.009 -8.705 409 HD23 LEU 57 HD23 LEU 57 1.689 -1.261 -9.322 410 HA PRO 58 HA PRO 58 2.704 -7.510 -10.738 411 HB2 PRO 58 HB2 PRO 58 5.466 -7.640 -10.817 412 HB3 PRO 58 HB1 PRO 58 4.439 -7.145 -12.161 413 HG2 PRO 58 HG2 PRO 58 6.036 -5.491 -10.292 414 HG3 PRO 58 HG1 PRO 58 5.641 -5.206 -11.994 415 HD2 PRO 58 HD2 PRO 58 4.427 -3.915 -9.912 416 HD3 PRO 58 HD1 PRO 58 3.652 -4.181 -11.480 417 H GLU 59 H GLU 59 3.142 -9.385 -9.718 418 HA GLU 59 HA GLU 59 3.115 -9.718 -7.022 419 HB2 GLU 59 HB2 GLU 59 3.974 -12.005 -7.443 420 HB3 GLU 59 HB1 GLU 59 2.722 -11.527 -8.585 421 HG2 GLU 59 HG2 GLU 59 4.448 -10.995 -10.239 422 HG3 GLU 59 HG1 GLU 59 5.689 -11.501 -9.095 423 H THR 60 H THR 60 5.862 -8.941 -8.925 424 HA THR 60 HA THR 60 7.726 -9.655 -6.779 425 HB THR 60 HB THR 60 8.234 -10.680 -8.915 426 HG1 THR 60 HG1 THR 60 10.136 -10.267 -7.989 427 HG21 THR 60 HG21 THR 60 8.327 -7.873 -10.015 428 HG22 THR 60 HG22 THR 60 7.132 -9.112 -10.402 429 HG23 THR 60 HG23 THR 60 8.814 -9.325 -10.887 430 H ALA 61 H ALA 61 5.981 -7.069 -7.436 431 HA ALA 61 HA ALA 61 7.987 -5.018 -7.677 432 HB1 ALA 61 HB1 ALA 61 5.084 -4.807 -6.891 433 HB2 ALA 61 HB2 ALA 61 5.731 -4.647 -8.523 434 HB3 ALA 61 HB3 ALA 61 6.142 -3.455 -7.291 435 H ASN 62 H ASN 62 8.312 -3.344 -5.998 436 HA ASN 62 HA ASN 62 7.794 -4.299 -3.287 437 HB2 ASN 62 HB2 ASN 62 10.059 -4.091 -2.565 438 HB3 ASN 62 HB1 ASN 62 10.045 -5.141 -3.974 439 HD21 ASN 62 HD21 ASN 62 12.145 -3.416 -2.743 440 HD22 ASN 62 HD22 ASN 62 12.724 -2.427 -4.042 441 H SER 63 H SER 63 7.259 -1.832 -5.234 442 HA SER 63 HA SER 63 7.244 0.068 -3.068 443 HB2 SER 63 HB2 SER 63 8.957 0.744 -5.485 444 HB3 SER 63 HB1 SER 63 8.700 1.735 -4.052 445 HG SER 63 HG SER 63 9.608 -0.628 -3.257 446 H VAL 64 H VAL 64 5.583 1.470 -3.344 447 HA VAL 64 HA VAL 64 4.606 1.905 -6.102 448 HB VAL 64 HB VAL 64 2.825 0.723 -4.961 449 HG11 VAL 64 HG11 VAL 64 3.761 1.657 -2.672 450 HG12 VAL 64 HG12 VAL 64 2.129 1.042 -2.875 451 HG13 VAL 64 HG13 VAL 64 2.424 2.781 -2.911 452 HG21 VAL 64 HG21 VAL 64 2.186 2.492 -6.430 453 HG22 VAL 64 HG22 VAL 64 2.186 3.627 -5.078 454 HG23 VAL 64 HG23 VAL 64 1.043 2.282 -5.110 455 H THR 65 H THR 65 4.491 3.987 -6.792 456 HA THR 65 HA THR 65 4.913 6.127 -4.868 457 HB THR 65 HB THR 65 4.879 5.988 -7.869 458 HG1 THR 65 HG1 THR 65 6.747 5.376 -6.286 459 HG21 THR 65 HG21 THR 65 3.953 8.156 -7.164 460 HG22 THR 65 HG22 THR 65 5.552 8.357 -7.881 461 HG23 THR 65 HG23 THR 65 5.355 8.423 -6.129 462 H LEU 66 H LEU 66 3.037 6.477 -3.861 463 HA LEU 66 HA LEU 66 0.471 6.486 -5.161 464 HB2 LEU 66 HB2 LEU 66 0.681 7.861 -2.603 465 HB3 LEU 66 HB1 LEU 66 -0.385 6.562 -3.089 466 HG LEU 66 HG LEU 66 2.475 6.008 -2.420 467 HD11 LEU 66 HD11 LEU 66 2.021 5.780 -0.196 468 HD12 LEU 66 HD12 LEU 66 0.274 5.803 -0.439 469 HD13 LEU 66 HD13 LEU 66 1.211 7.284 -0.618 470 HD21 LEU 66 HD21 LEU 66 -0.074 4.423 -2.438 471 HD22 LEU 66 HD22 LEU 66 1.481 3.808 -1.864 472 HD23 LEU 66 HD23 LEU 66 1.276 4.262 -3.561 473 H SER 67 H SER 67 -0.800 8.338 -5.550 474 HA SER 67 HA SER 67 0.569 10.901 -5.378 475 HB2 SER 67 HB2 SER 67 1.191 9.871 -7.583 476 HB3 SER 67 HB1 SER 67 -0.519 9.856 -8.006 477 HG SER 67 HG SER 67 -0.109 11.782 -8.731 478 H ASP 68 H ASP 68 -0.973 12.630 -6.311 479 HA ASP 68 HA ASP 68 -2.931 13.757 -6.186 480 HB2 ASP 68 HB2 ASP 68 -4.130 10.984 -6.331 481 HB3 ASP 68 HB1 ASP 68 -5.081 12.464 -6.360 482 H LEU 69 H LEU 69 -1.499 12.647 -3.771 483 HA LEU 69 HA LEU 69 -3.506 12.233 -1.777 484 HB2 LEU 69 HB2 LEU 69 -0.796 13.303 -1.080 485 HB3 LEU 69 HB1 LEU 69 -1.833 12.218 -0.181 486 HG LEU 69 HG LEU 69 -0.260 11.454 -2.627 487 HD11 LEU 69 HD11 LEU 69 1.137 11.920 -0.696 488 HD12 LEU 69 HD12 LEU 69 1.079 10.190 -1.034 489 HD13 LEU 69 HD13 LEU 69 0.135 10.861 0.298 490 HD21 LEU 69 HD21 LEU 69 -2.124 10.028 -2.572 491 HD22 LEU 69 HD22 LEU 69 -2.201 10.079 -0.810 492 HD23 LEU 69 HD23 LEU 69 -0.931 9.141 -1.608 493 H GLN 70 H GLN 70 -3.115 13.853 0.278 494 HA GLN 70 HA GLN 70 -3.410 16.596 -0.742 495 HB2 GLN 70 HB2 GLN 70 -4.914 15.381 1.584 496 HB3 GLN 70 HB1 GLN 70 -5.072 17.019 0.972 497 HG2 GLN 70 HG2 GLN 70 -5.685 14.635 -0.725 498 HG3 GLN 70 HG1 GLN 70 -6.874 15.353 0.359 499 HE21 GLN 70 HE21 GLN 70 -4.973 15.805 -2.526 500 HE22 GLN 70 HE22 GLN 70 -5.853 17.171 -3.125 501 HA PRO 71 HA PRO 71 -0.053 17.311 2.089 502 HB2 PRO 71 HB2 PRO 71 -0.291 20.020 2.289 503 HB3 PRO 71 HB1 PRO 71 0.474 19.179 0.940 504 HG2 PRO 71 HG2 PRO 71 -2.281 20.324 1.140 505 HG3 PRO 71 HG1 PRO 71 -1.147 20.367 -0.223 506 HD2 PRO 71 HD2 PRO 71 -3.224 18.643 -0.118 507 HD3 PRO 71 HD1 PRO 71 -1.686 18.233 -0.903 508 H GLY 72 H GLY 72 -0.083 16.943 4.215 509 HA2 GLY 72 HA2 GLY 72 -0.432 17.485 6.456 510 HA3 GLY 72 HA1 GLY 72 -1.646 18.656 5.963 511 H VAL 73 H VAL 73 -1.611 15.306 4.920 512 HA VAL 73 HA VAL 73 -3.956 14.783 6.622 513 HB VAL 73 HB VAL 73 -3.733 14.117 3.670 514 HG11 VAL 73 HG11 VAL 73 -4.915 12.318 4.514 515 HG12 VAL 73 HG12 VAL 73 -6.183 13.482 4.085 516 HG13 VAL 73 HG13 VAL 73 -5.685 13.294 5.767 517 HG21 VAL 73 HG21 VAL 73 -4.409 16.320 3.709 518 HG22 VAL 73 HG22 VAL 73 -5.319 16.114 5.207 519 HG23 VAL 73 HG23 VAL 73 -5.936 15.426 3.704 520 H GLN 74 H GLN 74 -4.229 12.684 7.315 521 HA GLN 74 HA GLN 74 -1.828 11.112 7.481 522 HB2 GLN 74 HB2 GLN 74 -3.885 11.582 9.159 523 HB3 GLN 74 HB1 GLN 74 -4.426 10.069 8.452 524 HG2 GLN 74 HG2 GLN 74 -1.839 10.530 9.904 525 HG3 GLN 74 HG1 GLN 74 -3.232 9.638 10.501 526 HE21 GLN 74 HE21 GLN 74 -0.455 9.602 8.440 527 HE22 GLN 74 HE22 GLN 74 -0.511 7.917 8.060 528 H TYR 75 H TYR 75 -1.328 9.465 6.159 529 HA TYR 75 HA TYR 75 -3.504 8.383 4.501 530 HB2 TYR 75 HB2 TYR 75 -0.799 9.361 3.736 531 HB3 TYR 75 HB1 TYR 75 -1.461 7.978 2.856 532 HD1 TYR 75 HD1 TYR 75 -3.639 8.189 1.694 533 HD2 TYR 75 HD2 TYR 75 -1.656 11.565 3.350 534 HE1 TYR 75 HE1 TYR 75 -5.066 9.672 0.362 535 HE2 TYR 75 HE2 TYR 75 -3.078 13.060 2.007 536 HH TYR 75 HH TYR 75 -4.457 12.910 -0.124 537 H ASN 76 H ASN 76 -3.941 6.397 5.034 538 HA ASN 76 HA ASN 76 -1.859 4.636 6.064 539 HB2 ASN 76 HB2 ASN 76 -4.787 4.040 5.574 540 HB3 ASN 76 HB1 ASN 76 -3.661 3.063 6.507 541 HD21 ASN 76 HD21 ASN 76 -3.134 3.683 8.586 542 HD22 ASN 76 HD22 ASN 76 -3.992 4.920 9.437 543 H ILE 77 H ILE 77 -0.598 3.722 4.555 544 HA ILE 77 HA ILE 77 -1.724 2.982 1.966 545 HB ILE 77 HB ILE 77 1.112 2.745 2.983 546 HG12 ILE 77 HG12 ILE 77 1.379 4.428 1.019 547 HG13 ILE 77 HG11 ILE 77 -0.294 4.805 1.340 548 HG21 ILE 77 HG21 ILE 77 1.108 1.113 1.372 549 HG22 ILE 77 HG22 ILE 77 1.472 2.555 0.404 550 HG23 ILE 77 HG23 ILE 77 -0.168 1.908 0.439 551 HD11 ILE 77 HD11 ILE 77 0.278 5.375 3.647 552 HD12 ILE 77 HD12 ILE 77 1.176 6.347 2.481 553 HD13 ILE 77 HD13 ILE 77 1.970 5.009 3.309 554 H THR 78 H THR 78 -2.636 1.124 1.741 555 HA THR 78 HA THR 78 -1.874 -1.053 3.528 556 HB THR 78 HB THR 78 -4.383 -0.723 1.906 557 HG1 THR 78 HG1 THR 78 -4.441 0.927 3.351 558 HG21 THR 78 HG21 THR 78 -3.900 -3.027 2.625 559 HG22 THR 78 HG22 THR 78 -5.300 -2.381 3.481 560 HG23 THR 78 HG23 THR 78 -3.735 -2.471 4.291 561 H ILE 79 H ILE 79 -0.560 -2.510 2.579 562 HA ILE 79 HA ILE 79 -0.663 -2.818 -0.356 563 HB ILE 79 HB ILE 79 1.320 -4.268 1.396 564 HG12 ILE 79 HG12 ILE 79 1.884 -2.023 1.911 565 HG13 ILE 79 HG11 ILE 79 2.994 -2.559 0.653 566 HG21 ILE 79 HG21 ILE 79 1.267 -5.157 -0.764 567 HG22 ILE 79 HG22 ILE 79 2.675 -4.084 -0.713 568 HG23 ILE 79 HG23 ILE 79 1.188 -3.554 -1.500 569 HD11 ILE 79 HD11 ILE 79 0.540 -1.037 -0.068 570 HD12 ILE 79 HD12 ILE 79 2.072 -1.207 -0.944 571 HD13 ILE 79 HD13 ILE 79 1.983 -0.219 0.524 572 H TYR 80 H TYR 80 -1.395 -4.598 -1.304 573 HA TYR 80 HA TYR 80 -2.232 -6.859 0.394 574 HB2 TYR 80 HB2 TYR 80 -3.543 -5.839 -2.140 575 HB3 TYR 80 HB1 TYR 80 -4.100 -7.193 -1.162 576 HD1 TYR 80 HD1 TYR 80 -5.149 -6.777 1.024 577 HD2 TYR 80 HD2 TYR 80 -4.059 -3.562 -1.563 578 HE1 TYR 80 HE1 TYR 80 -6.661 -5.282 2.250 579 HE2 TYR 80 HE2 TYR 80 -5.564 -2.070 -0.333 580 HH TYR 80 HH TYR 80 -7.697 -2.362 1.090 581 H ALA 81 H ALA 81 -0.741 -8.458 -0.078 582 HA ALA 81 HA ALA 81 0.122 -8.861 -2.812 583 HB1 ALA 81 HB1 ALA 81 0.585 -10.441 -0.258 584 HB2 ALA 81 HB2 ALA 81 1.759 -9.521 -1.198 585 HB3 ALA 81 HB3 ALA 81 1.114 -11.042 -1.844 586 H VAL 82 H VAL 82 -0.839 -10.147 -4.264 587 HA VAL 82 HA VAL 82 -3.128 -11.731 -3.259 588 HB VAL 82 HB VAL 82 -4.013 -9.880 -4.533 589 HG11 VAL 82 HG11 VAL 82 -2.318 -10.830 -6.817 590 HG12 VAL 82 HG12 VAL 82 -2.118 -9.327 -5.916 591 HG13 VAL 82 HG13 VAL 82 -3.555 -9.577 -6.908 592 HG21 VAL 82 HG21 VAL 82 -4.158 -12.429 -6.130 593 HG22 VAL 82 HG22 VAL 82 -5.311 -11.094 -6.204 594 HG23 VAL 82 HG23 VAL 82 -5.150 -12.038 -4.723 595 H GLU 83 H GLU 83 -3.304 -13.794 -3.877 596 HA GLU 83 HA GLU 83 -1.183 -14.825 -5.639 597 HB2 GLU 83 HB2 GLU 83 -2.546 -16.491 -3.531 598 HB3 GLU 83 HB1 GLU 83 -1.027 -16.761 -4.368 599 HG2 GLU 83 HG2 GLU 83 -0.451 -16.214 -2.193 600 HG3 GLU 83 HG1 GLU 83 -0.102 -14.818 -3.192 601 H GLU 84 H GLU 84 -1.865 -17.065 -6.524 602 HA GLU 84 HA GLU 84 -3.682 -16.686 -8.502 603 HB2 GLU 84 HB2 GLU 84 -3.039 -19.337 -7.212 604 HB3 GLU 84 HB1 GLU 84 -3.727 -19.116 -8.815 605 HG2 GLU 84 HG2 GLU 84 -1.683 -17.862 -9.458 606 HG3 GLU 84 HG1 GLU 84 -0.998 -18.268 -7.884 607 H ASN 85 H ASN 85 -4.436 -18.295 -5.397 608 HA ASN 85 HA ASN 85 -7.277 -17.866 -6.038 609 HB2 ASN 85 HB2 ASN 85 -7.862 -20.023 -5.095 610 HB3 ASN 85 HB1 ASN 85 -6.689 -20.243 -6.387 611 HD21 ASN 85 HD21 ASN 85 -7.366 -21.987 -4.161 612 HD22 ASN 85 HD22 ASN 85 -5.894 -22.258 -3.293 613 H GLN 86 H GLN 86 -5.169 -16.550 -4.232 614 HA GLN 86 HA GLN 86 -6.856 -16.430 -1.857 615 HB2 GLN 86 HB2 GLN 86 -3.960 -17.264 -1.840 616 HB3 GLN 86 HB1 GLN 86 -4.743 -16.581 -0.425 617 HG2 GLN 86 HG2 GLN 86 -5.607 -19.082 -1.854 618 HG3 GLN 86 HG1 GLN 86 -4.665 -19.025 -0.365 619 HE21 GLN 86 HE21 GLN 86 -7.268 -20.222 -0.851 620 HE22 GLN 86 HE22 GLN 86 -8.363 -19.466 0.243 621 H GLU 87 H GLU 87 -5.930 -14.731 -0.302 622 HA GLU 87 HA GLU 87 -4.349 -12.658 -1.630 623 HB2 GLU 87 HB2 GLU 87 -6.915 -12.072 -0.128 624 HB3 GLU 87 HB1 GLU 87 -5.850 -10.890 -0.864 625 HG2 GLU 87 HG2 GLU 87 -6.474 -11.486 -3.024 626 HG3 GLU 87 HG1 GLU 87 -7.170 -13.019 -2.501 627 H SER 88 H SER 88 -2.689 -12.225 -0.321 628 HA SER 88 HA SER 88 -2.504 -13.304 2.282 629 HB2 SER 88 HB2 SER 88 -0.812 -11.198 0.927 630 HB3 SER 88 HB1 SER 88 -0.384 -12.025 2.423 631 HG SER 88 HG SER 88 -0.763 -13.195 -0.149 632 H THR 89 H THR 89 -1.883 -11.984 4.218 633 HA THR 89 HA THR 89 -3.970 -10.347 5.052 634 HB THR 89 HB THR 89 -2.145 -9.644 6.829 635 HG1 THR 89 HG1 THR 89 -0.353 -10.865 6.808 636 HG21 THR 89 HG21 THR 89 -2.572 -11.739 8.032 637 HG22 THR 89 HG22 THR 89 -3.171 -12.470 6.544 638 HG23 THR 89 HG23 THR 89 -4.040 -11.121 7.275 639 HA PRO 90 HA PRO 90 -2.845 -6.370 3.566 640 HB2 PRO 90 HB2 PRO 90 -4.130 -4.751 5.271 641 HB3 PRO 90 HB1 PRO 90 -5.001 -5.859 4.203 642 HG2 PRO 90 HG2 PRO 90 -4.444 -6.083 7.119 643 HG3 PRO 90 HG1 PRO 90 -5.865 -6.608 6.203 644 HD2 PRO 90 HD2 PRO 90 -3.740 -8.218 7.045 645 HD3 PRO 90 HD1 PRO 90 -4.973 -8.653 5.847 646 H VAL 91 H VAL 91 -1.097 -5.184 3.602 647 HA VAL 91 HA VAL 91 0.531 -4.644 5.930 648 HB VAL 91 HB VAL 91 0.559 -3.609 3.106 649 HG11 VAL 91 HG11 VAL 91 2.736 -2.609 3.719 650 HG12 VAL 91 HG12 VAL 91 2.418 -3.033 5.399 651 HG13 VAL 91 HG13 VAL 91 1.368 -1.890 4.565 652 HG21 VAL 91 HG21 VAL 91 2.598 -4.867 2.847 653 HG22 VAL 91 HG22 VAL 91 1.272 -5.937 3.320 654 HG23 VAL 91 HG23 VAL 91 2.482 -5.448 4.509 655 H VAL 92 H VAL 92 -0.031 -2.969 7.317 656 HA VAL 92 HA VAL 92 -1.292 -0.648 6.020 657 HB VAL 92 HB VAL 92 -1.654 -1.308 8.938 658 HG11 VAL 92 HG11 VAL 92 -3.558 0.264 8.693 659 HG12 VAL 92 HG12 VAL 92 -3.046 0.563 7.029 660 HG13 VAL 92 HG13 VAL 92 -1.992 1.010 8.371 661 HG21 VAL 92 HG21 VAL 92 -3.891 -2.134 8.367 662 HG22 VAL 92 HG22 VAL 92 -2.635 -3.123 7.623 663 HG23 VAL 92 HG23 VAL 92 -3.523 -1.949 6.654 664 H ILE 93 H ILE 93 0.295 0.732 5.705 665 HA ILE 93 HA ILE 93 1.944 1.463 8.032 666 HB ILE 93 HB ILE 93 3.655 2.282 6.333 667 HG12 ILE 93 HG12 ILE 93 2.389 0.343 4.439 668 HG13 ILE 93 HG11 ILE 93 1.904 2.020 4.442 669 HG21 ILE 93 HG21 ILE 93 4.008 0.293 7.675 670 HG22 ILE 93 HG22 ILE 93 4.636 0.053 6.045 671 HG23 ILE 93 HG23 ILE 93 3.100 -0.676 6.515 672 HD11 ILE 93 HD11 ILE 93 4.652 0.950 3.953 673 HD12 ILE 93 HD12 ILE 93 4.257 2.664 4.108 674 HD13 ILE 93 HD13 ILE 93 3.572 1.708 2.779 675 H GLN 94 H GLN 94 1.367 3.388 8.779 676 HA GLN 94 HA GLN 94 -0.048 5.168 6.940 677 HB2 GLN 94 HB2 GLN 94 -0.943 6.259 8.961 678 HB3 GLN 94 HB1 GLN 94 -1.338 4.550 8.874 679 HG2 GLN 94 HG2 GLN 94 0.416 4.043 10.480 680 HG3 GLN 94 HG1 GLN 94 0.851 5.751 10.554 681 HE21 GLN 94 HE21 GLN 94 -0.539 7.197 11.575 682 HE22 GLN 94 HE22 GLN 94 -1.787 6.671 12.647 683 H GLN 95 H GLN 95 0.711 7.036 6.346 684 HA GLN 95 HA GLN 95 2.858 8.326 7.866 685 HB2 GLN 95 HB2 GLN 95 3.067 7.113 5.274 686 HB3 GLN 95 HB1 GLN 95 3.251 8.848 5.098 687 HG2 GLN 95 HG2 GLN 95 4.868 7.049 6.889 688 HG3 GLN 95 HG1 GLN 95 5.400 7.767 5.372 689 HE21 GLN 95 HE21 GLN 95 4.006 10.319 6.030 690 HE22 GLN 95 HE22 GLN 95 5.032 11.090 7.188 691 H GLU 96 H GLU 96 2.470 10.472 8.164 692 HA GLU 96 HA GLU 96 0.183 11.657 6.803 693 HB2 GLU 96 HB2 GLU 96 1.970 12.730 8.993 694 HB3 GLU 96 HB1 GLU 96 0.613 13.609 8.293 695 HG2 GLU 96 HG2 GLU 96 -0.909 11.889 9.054 696 HG3 GLU 96 HG1 GLU 96 0.436 10.981 9.744 697 H THR 97 H THR 97 0.302 13.082 5.209 698 HA THR 97 HA THR 97 2.749 13.484 3.832 699 HB THR 97 HB THR 97 1.366 15.065 2.435 700 HG1 THR 97 HG1 THR 97 -0.962 14.893 2.939 701 HG21 THR 97 HG21 THR 97 0.190 12.329 2.947 702 HG22 THR 97 HG22 THR 97 1.546 12.683 1.879 703 HG23 THR 97 HG23 THR 97 -0.061 13.304 1.499 704 H THR 98 H THR 98 4.280 14.920 4.273 705 HA THR 98 HA THR 98 4.007 16.882 6.297 706 HB THR 98 HB THR 98 6.169 16.777 4.194 707 HG1 THR 98 HG1 THR 98 5.909 15.261 6.603 708 HG21 THR 98 HG21 THR 98 6.211 18.736 5.666 709 HG22 THR 98 HG22 THR 98 7.578 17.673 5.995 710 HG23 THR 98 HG23 THR 98 6.188 17.681 7.079 711 H GLY 99 H GLY 99 3.792 16.911 2.811 712 HA2 GLY 99 HA2 GLY 99 2.458 18.474 1.636 713 HA3 GLY 99 HA1 GLY 99 2.656 19.599 2.959 714 H THR 100 H THR 100 3.565 21.335 2.110 715 HA THR 100 HA THR 100 5.534 21.234 0.040 716 HB THR 100 HB THR 100 4.866 23.577 1.826 717 HG1 THR 100 HG1 THR 100 3.132 23.961 0.567 718 HG21 THR 100 HG21 THR 100 5.908 23.444 -0.992 719 HG22 THR 100 HG22 THR 100 6.842 23.855 0.446 720 HG23 THR 100 HG23 THR 100 5.535 24.909 -0.083 721 HA PRO 101 HA PRO 101 8.952 20.067 2.652 722 HB2 PRO 101 HB2 PRO 101 10.456 21.477 0.500 723 HB3 PRO 101 HB1 PRO 101 10.719 19.871 1.190 724 HG2 PRO 101 HG2 PRO 101 9.580 20.148 -1.198 725 HG3 PRO 101 HG1 PRO 101 9.019 18.911 -0.061 726 HD2 PRO 101 HD2 PRO 101 7.771 21.511 -0.805 727 HD3 PRO 101 HD1 PRO 101 7.004 19.967 -0.383 728 H ARG 102 H ARG 102 10.012 21.017 4.269 729 HA ARG 102 HA ARG 102 10.691 22.596 5.740 730 HB2 ARG 102 HB2 ARG 102 11.230 24.146 3.203 731 HB3 ARG 102 HB1 ARG 102 11.746 24.665 4.803 732 HG2 ARG 102 HG2 ARG 102 13.153 22.725 5.030 733 HG3 ARG 102 HG1 ARG 102 12.558 22.073 3.502 734 HD2 ARG 102 HD2 ARG 102 13.524 23.952 2.305 735 HD3 ARG 102 HD1 ARG 102 14.075 24.658 3.822 736 HE ARG 102 HE ARG 102 15.349 22.397 3.982 737 HH11 ARG 102 HH11 ARG 102 14.813 24.289 1.085 738 HH12 ARG 102 HH12 ARG 102 16.273 23.754 0.318 739 HH21 ARG 102 HH21 ARG 102 17.267 21.700 2.974 740 HH22 ARG 102 HH22 ARG 102 17.668 22.286 1.391 741 H SER 103 H SER 103 8.195 22.417 5.902 742 HA SER 103 HA SER 103 6.542 24.497 4.987 743 HB2 SER 103 HB2 SER 103 6.033 22.843 7.455 744 HB3 SER 103 HB1 SER 103 4.854 23.512 6.326 745 HG SER 103 HG SER 103 6.046 22.078 4.733 746 H ASP 104 H ASP 104 8.134 23.963 8.123 747 HA ASP 104 HA ASP 104 6.954 26.209 9.380 748 HB2 ASP 104 HB2 ASP 104 7.876 24.359 10.691 749 HB3 ASP 104 HB1 ASP 104 9.493 24.735 10.099 750 H GLY 105 H GLY 105 7.414 28.276 9.253 751 HA2 GLY 105 HA2 GLY 105 9.565 29.755 9.299 752 HA3 GLY 105 HA1 GLY 105 9.756 29.080 7.686 753 H THR 106 H THR 106 9.043 31.823 8.960 754 HA THR 106 HA THR 106 6.490 32.378 7.720 755 HB THR 106 HB THR 106 8.403 34.337 8.998 756 HG1 THR 106 HG1 THR 106 6.826 32.369 10.093 757 HG21 THR 106 HG21 THR 106 5.418 34.437 8.547 758 HG22 THR 106 HG22 THR 106 6.624 35.328 7.621 759 HG23 THR 106 HG23 THR 106 6.390 35.681 9.333 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 -8.592 -22.808 -4.479 2 H2 GLY 1 HT2 GLY 1 -10.220 -22.922 -4.048 3 H3 GLY 1 HT3 GLY 1 -9.717 -23.405 -5.588 4 HA2 GLY 1 HA1 GLY 1 -8.966 -24.700 -3.034 5 HA3 GLY 1 HA2 GLY 1 -10.129 -25.325 -4.193 6 H SER 2 H SER 2 -7.905 -26.790 -3.368 7 HA SER 2 HA SER 2 -5.873 -26.474 -5.428 8 HB2 SER 2 HB2 SER 2 -4.755 -28.345 -4.084 9 HB3 SER 2 HB1 SER 2 -4.935 -26.784 -3.285 10 HG SER 2 HG SER 2 -5.840 -27.959 -1.785 11 H HIS 3 H HIS 3 -7.872 -27.146 -6.871 12 HA HIS 3 HA HIS 3 -8.316 -29.969 -7.077 13 HB2 HIS 3 HB2 HIS 3 -9.455 -29.441 -9.208 14 HB3 HIS 3 HB1 HIS 3 -10.034 -28.445 -7.880 15 HD1 HIS 3 HD1 HIS 3 -8.540 -28.265 -11.236 16 HD2 HIS 3 HD2 HIS 3 -9.142 -25.709 -8.011 17 HE1 HIS 3 HE1 HIS 3 -8.181 -25.944 -12.133 18 HE2 HIS 3 HE2 HIS 3 -8.631 -24.410 -10.186 19 H MET 4 H MET 4 -5.977 -27.755 -8.252 20 HA MET 4 HA MET 4 -4.245 -29.814 -9.119 21 HB2 MET 4 HB2 MET 4 -5.772 -29.755 -11.084 22 HB3 MET 4 HB1 MET 4 -5.381 -28.056 -11.309 23 HG2 MET 4 HG2 MET 4 -4.145 -29.494 -12.844 24 HG3 MET 4 HG1 MET 4 -3.072 -28.612 -11.759 25 HE1 MET 4 HE1 MET 4 -4.804 -32.042 -12.498 26 HE2 MET 4 HE2 MET 4 -5.225 -31.787 -10.805 27 HE3 MET 4 HE3 MET 4 -4.112 -33.079 -11.252 28 H GLY 5 H GLY 5 -3.299 -28.448 -7.393 29 HA2 GLY 5 HA2 GLY 5 -1.178 -26.955 -8.157 30 HA3 GLY 5 HA1 GLY 5 -2.476 -25.774 -8.108 31 H THR 6 H THR 6 -1.500 -24.641 -6.410 32 HA THR 6 HA THR 6 -1.558 -26.046 -3.822 33 HB THR 6 HB THR 6 0.372 -23.847 -4.579 34 HG1 THR 6 HG1 THR 6 1.335 -25.429 -5.616 35 HG21 THR 6 HG21 THR 6 1.548 -24.519 -2.546 36 HG22 THR 6 HG22 THR 6 0.325 -25.748 -2.233 37 HG23 THR 6 HG23 THR 6 -0.108 -24.040 -2.175 38 H THR 7 H THR 7 -2.863 -25.159 -2.355 39 HA THR 7 HA THR 7 -3.790 -22.403 -2.723 40 HB THR 7 HB THR 7 -4.758 -24.338 -0.617 41 HG1 THR 7 HG1 THR 7 -5.176 -24.369 -3.350 42 HG21 THR 7 HG21 THR 7 -5.385 -21.987 -0.342 43 HG22 THR 7 HG22 THR 7 -6.795 -22.976 -0.726 44 HG23 THR 7 HG23 THR 7 -6.056 -21.967 -1.971 45 H THR 8 H THR 8 -1.610 -21.686 -2.153 46 HA THR 8 HA THR 8 -0.330 -22.314 0.260 47 HB THR 8 HB THR 8 0.023 -19.726 -1.250 48 HG1 THR 8 HG1 THR 8 0.629 -20.868 -2.906 49 HG21 THR 8 HG21 THR 8 1.950 -21.485 0.275 50 HG22 THR 8 HG22 THR 8 1.295 -19.943 0.828 51 HG23 THR 8 HG23 THR 8 2.370 -19.996 -0.571 52 H ALA 9 H ALA 9 -0.169 -21.204 2.206 53 HA ALA 9 HA ALA 9 -2.124 -19.087 2.718 54 HB1 ALA 9 HB1 ALA 9 -2.001 -20.856 4.393 55 HB2 ALA 9 HB2 ALA 9 -1.448 -19.328 5.077 56 HB3 ALA 9 HB3 ALA 9 -0.276 -20.556 4.605 57 HA PRO 10 HA PRO 10 1.609 -16.806 1.586 58 HB2 PRO 10 HB2 PRO 10 0.416 -14.649 0.530 59 HB3 PRO 10 HB1 PRO 10 0.494 -16.193 -0.331 60 HG2 PRO 10 HG2 PRO 10 -1.774 -14.973 1.190 61 HG3 PRO 10 HG1 PRO 10 -1.805 -15.877 -0.335 62 HD2 PRO 10 HD2 PRO 10 -2.414 -16.952 2.119 63 HD3 PRO 10 HD1 PRO 10 -1.890 -17.881 0.749 64 H ASP 11 H ASP 11 2.790 -15.455 2.743 65 HA ASP 11 HA ASP 11 1.580 -14.011 4.945 66 HB2 ASP 11 HB2 ASP 11 4.391 -14.597 4.087 67 HB3 ASP 11 HB1 ASP 11 4.086 -13.278 5.211 68 H ALA 12 H ALA 12 2.108 -11.749 5.294 69 HA ALA 12 HA ALA 12 1.973 -10.223 2.794 70 HB1 ALA 12 HB1 ALA 12 1.349 -8.345 4.273 71 HB2 ALA 12 HB2 ALA 12 1.533 -9.404 5.672 72 HB3 ALA 12 HB3 ALA 12 0.281 -9.733 4.475 73 HA PRO 13 HA PRO 13 6.164 -8.727 3.195 74 HB2 PRO 13 HB2 PRO 13 5.084 -6.031 2.614 75 HB3 PRO 13 HB1 PRO 13 6.332 -6.950 1.761 76 HG2 PRO 13 HG2 PRO 13 3.920 -6.639 0.699 77 HG3 PRO 13 HG1 PRO 13 4.776 -8.190 0.559 78 HD2 PRO 13 HD2 PRO 13 2.566 -7.398 2.420 79 HD3 PRO 13 HD1 PRO 13 2.779 -8.914 1.513 80 HA PRO 14 HA PRO 14 6.185 -7.124 7.425 81 HB2 PRO 14 HB2 PRO 14 9.029 -6.718 6.629 82 HB3 PRO 14 HB1 PRO 14 8.374 -7.481 8.081 83 HG2 PRO 14 HG2 PRO 14 9.424 -8.947 6.111 84 HG3 PRO 14 HG1 PRO 14 8.007 -9.502 7.020 85 HD2 PRO 14 HD2 PRO 14 8.171 -8.386 4.262 86 HD3 PRO 14 HD1 PRO 14 7.076 -9.613 4.924 87 H ASP 15 H ASP 15 6.203 -5.107 8.247 88 HA ASP 15 HA ASP 15 4.878 -3.346 6.753 89 HB2 ASP 15 HB2 ASP 15 6.746 -2.564 8.990 90 HB3 ASP 15 HB1 ASP 15 5.390 -1.609 8.401 91 HA PRO 16 HA PRO 16 7.911 -1.912 3.656 92 HB2 PRO 16 HB2 PRO 16 5.819 -0.226 2.761 93 HB3 PRO 16 HB1 PRO 16 6.364 -1.728 2.012 94 HG2 PRO 16 HG2 PRO 16 4.138 -1.229 3.935 95 HG3 PRO 16 HG1 PRO 16 4.228 -2.384 2.588 96 HD2 PRO 16 HD2 PRO 16 4.456 -3.313 5.059 97 HD3 PRO 16 HD1 PRO 16 5.600 -3.842 3.793 98 H THR 17 H THR 17 9.033 -0.081 3.474 99 HA THR 17 HA THR 17 8.505 2.009 5.481 100 HB THR 17 HB THR 17 11.078 1.553 3.962 101 HG1 THR 17 HG1 THR 17 10.180 0.466 6.441 102 HG21 THR 17 HG21 THR 17 12.060 2.803 5.838 103 HG22 THR 17 HG22 THR 17 10.455 2.998 6.542 104 HG23 THR 17 HG23 THR 17 10.836 3.754 4.995 105 H VAL 18 H VAL 18 7.916 3.881 4.917 106 HA VAL 18 HA VAL 18 7.692 4.660 2.146 107 HB VAL 18 HB VAL 18 7.118 6.217 4.673 108 HG11 VAL 18 HG11 VAL 18 7.658 7.754 2.882 109 HG12 VAL 18 HG12 VAL 18 5.924 7.792 3.196 110 HG13 VAL 18 HG13 VAL 18 6.547 6.927 1.784 111 HG21 VAL 18 HG21 VAL 18 5.657 4.258 4.270 112 HG22 VAL 18 HG22 VAL 18 5.217 4.951 2.710 113 HG23 VAL 18 HG23 VAL 18 4.798 5.796 4.199 114 H ASP 19 H ASP 19 9.182 5.653 1.003 115 HA ASP 19 HA ASP 19 11.686 6.383 2.271 116 HB2 ASP 19 HB2 ASP 19 11.735 5.007 0.258 117 HB3 ASP 19 HB1 ASP 19 10.886 6.258 -0.642 118 H GLN 20 H GLN 20 9.171 7.949 0.327 119 HA GLN 20 HA GLN 20 10.157 10.542 1.276 120 HB2 GLN 20 HB2 GLN 20 9.583 9.788 -1.580 121 HB3 GLN 20 HB1 GLN 20 9.521 11.457 -1.034 122 HG2 GLN 20 HG2 GLN 20 11.871 11.246 -0.281 123 HG3 GLN 20 HG1 GLN 20 11.909 9.626 -0.979 124 HE21 GLN 20 HE21 GLN 20 13.546 10.232 -2.406 125 HE22 GLN 20 HE22 GLN 20 13.243 11.205 -3.776 126 H VAL 21 H VAL 21 8.653 11.991 1.777 127 HA VAL 21 HA VAL 21 5.839 11.328 1.221 128 HB VAL 21 HB VAL 21 6.861 12.481 3.817 129 HG11 VAL 21 HG11 VAL 21 4.554 13.104 3.061 130 HG12 VAL 21 HG12 VAL 21 4.649 12.301 4.629 131 HG13 VAL 21 HG13 VAL 21 4.129 11.399 3.208 132 HG21 VAL 21 HG21 VAL 21 5.906 9.685 3.236 133 HG22 VAL 21 HG22 VAL 21 6.279 10.331 4.834 134 HG23 VAL 21 HG23 VAL 21 7.557 10.164 3.631 135 H ASP 22 H ASP 22 5.088 12.889 -0.077 136 HA ASP 22 HA ASP 22 5.982 15.664 0.399 137 HB2 ASP 22 HB2 ASP 22 6.662 14.475 -1.786 138 HB3 ASP 22 HB1 ASP 22 4.969 14.605 -2.241 139 H ASP 23 H ASP 23 3.984 16.762 -1.443 140 HA ASP 23 HA ASP 23 1.780 16.898 0.409 141 HB2 ASP 23 HB2 ASP 23 1.987 18.050 -2.375 142 HB3 ASP 23 HB1 ASP 23 0.745 18.437 -1.216 143 H THR 24 H THR 24 1.934 16.044 -3.041 144 HA THR 24 HA THR 24 -0.507 14.420 -2.676 145 HB THR 24 HB THR 24 -0.868 14.792 -5.122 146 HG1 THR 24 HG1 THR 24 1.596 15.639 -5.105 147 HG21 THR 24 HG21 THR 24 -0.640 17.326 -3.497 148 HG22 THR 24 HG22 THR 24 -1.978 16.180 -3.410 149 HG23 THR 24 HG23 THR 24 -1.675 17.073 -4.902 150 H SER 25 H SER 25 1.977 13.266 -2.084 151 HA SER 25 HA SER 25 2.217 11.082 -3.852 152 HB2 SER 25 HB2 SER 25 4.424 13.154 -4.032 153 HB3 SER 25 HB1 SER 25 4.548 11.508 -4.653 154 HG SER 25 HG SER 25 2.300 12.822 -5.504 155 H ILE 26 H ILE 26 3.043 9.416 -2.771 156 HA ILE 26 HA ILE 26 5.095 9.811 -0.718 157 HB ILE 26 HB ILE 26 2.372 8.643 -0.125 158 HG12 ILE 26 HG12 ILE 26 4.089 10.626 1.371 159 HG13 ILE 26 HG11 ILE 26 2.696 11.025 0.375 160 HG21 ILE 26 HG21 ILE 26 3.989 6.984 0.591 161 HG22 ILE 26 HG22 ILE 26 3.263 7.781 1.990 162 HG23 ILE 26 HG23 ILE 26 4.890 8.222 1.471 163 HD11 ILE 26 HD11 ILE 26 2.050 11.075 2.676 164 HD12 ILE 26 HD12 ILE 26 2.699 9.453 2.939 165 HD13 ILE 26 HD13 ILE 26 1.287 9.682 1.908 166 H VAL 27 H VAL 27 6.465 7.950 -0.560 167 HA VAL 27 HA VAL 27 5.735 5.854 -2.514 168 HB VAL 27 HB VAL 27 8.527 6.767 -1.846 169 HG11 VAL 27 HG11 VAL 27 7.881 4.355 -2.679 170 HG12 VAL 27 HG12 VAL 27 9.294 5.191 -3.339 171 HG13 VAL 27 HG13 VAL 27 7.782 5.162 -4.249 172 HG21 VAL 27 HG21 VAL 27 8.565 7.787 -4.072 173 HG22 VAL 27 HG22 VAL 27 7.332 8.522 -3.047 174 HG23 VAL 27 HG23 VAL 27 6.866 7.366 -4.295 175 H VAL 28 H VAL 28 5.848 3.759 -1.823 176 HA VAL 28 HA VAL 28 7.099 3.327 0.794 177 HB VAL 28 HB VAL 28 5.274 2.446 1.734 178 HG11 VAL 28 HG11 VAL 28 4.495 4.589 0.881 179 HG12 VAL 28 HG12 VAL 28 3.214 3.417 1.148 180 HG13 VAL 28 HG13 VAL 28 3.775 3.745 -0.490 181 HG21 VAL 28 HG21 VAL 28 5.282 0.466 0.391 182 HG22 VAL 28 HG22 VAL 28 4.419 1.318 -0.892 183 HG23 VAL 28 HG23 VAL 28 3.621 1.021 0.657 184 H ARG 29 H ARG 29 8.018 1.309 1.147 185 HA ARG 29 HA ARG 29 8.330 -0.431 -1.228 186 HB2 ARG 29 HB2 ARG 29 10.519 0.319 0.726 187 HB3 ARG 29 HB1 ARG 29 10.687 -0.742 -0.660 188 HG2 ARG 29 HG2 ARG 29 10.297 1.136 -2.159 189 HG3 ARG 29 HG1 ARG 29 10.087 2.206 -0.773 190 HD2 ARG 29 HD2 ARG 29 12.364 1.798 -0.070 191 HD3 ARG 29 HD1 ARG 29 12.581 0.616 -1.359 192 HE ARG 29 HE ARG 29 11.961 2.813 -2.747 193 HH11 ARG 29 HH11 ARG 29 14.221 2.308 -0.124 194 HH12 ARG 29 HH12 ARG 29 15.336 3.515 -0.678 195 HH21 ARG 29 HH21 ARG 29 13.434 4.404 -3.487 196 HH22 ARG 29 HH22 ARG 29 14.884 4.713 -2.588 197 H TRP 30 H TRP 30 7.791 -2.433 -0.823 198 HA TRP 30 HA TRP 30 7.716 -3.351 1.986 199 HB2 TRP 30 HB2 TRP 30 5.843 -4.856 1.280 200 HB3 TRP 30 HB1 TRP 30 5.456 -3.151 1.126 201 HD1 TRP 30 HD1 TRP 30 6.315 -6.178 -1.023 202 HE1 TRP 30 HE1 TRP 30 5.430 -5.785 -3.402 203 HE3 TRP 30 HE3 TRP 30 4.685 -1.407 -0.447 204 HZ2 TRP 30 HZ2 TRP 30 4.144 -3.723 -4.819 205 HZ3 TRP 30 HZ3 TRP 30 3.608 -0.303 -2.358 206 HH2 TRP 30 HH2 TRP 30 3.339 -1.425 -4.481 207 H SER 31 H SER 31 8.173 -5.583 2.409 208 HA SER 31 HA SER 31 10.016 -6.746 0.449 209 HB2 SER 31 HB2 SER 31 10.876 -6.313 2.743 210 HB3 SER 31 HB1 SER 31 9.674 -7.433 3.380 211 HG SER 31 HG SER 31 11.366 -8.727 3.107 212 H ARG 32 H ARG 32 8.945 -7.996 -0.893 213 HA ARG 32 HA ARG 32 6.483 -9.165 -0.591 214 HB2 ARG 32 HB2 ARG 32 8.644 -10.236 -2.390 215 HB3 ARG 32 HB1 ARG 32 6.909 -10.270 -2.651 216 HG2 ARG 32 HG2 ARG 32 7.476 -8.541 -4.026 217 HG3 ARG 32 HG1 ARG 32 7.167 -7.664 -2.526 218 HD2 ARG 32 HD2 ARG 32 9.228 -6.874 -2.500 219 HD3 ARG 32 HD1 ARG 32 9.888 -8.514 -2.554 220 HE ARG 32 HE ARG 32 9.008 -7.383 -5.088 221 HH11 ARG 32 HH11 ARG 32 11.680 -8.048 -2.920 222 HH12 ARG 32 HH12 ARG 32 12.883 -7.913 -4.163 223 HH21 ARG 32 HH21 ARG 32 10.594 -7.205 -6.727 224 HH22 ARG 32 HH22 ARG 32 12.272 -7.425 -6.317 225 HA PRO 33 HA PRO 33 6.940 -12.963 1.582 226 HB2 PRO 33 HB2 PRO 33 4.845 -14.261 0.097 227 HB3 PRO 33 HB1 PRO 33 4.716 -13.410 1.643 228 HG2 PRO 33 HG2 PRO 33 3.566 -12.557 -0.705 229 HG3 PRO 33 HG1 PRO 33 3.989 -11.485 0.649 230 HD2 PRO 33 HD2 PRO 33 5.506 -12.050 -1.869 231 HD3 PRO 33 HD1 PRO 33 5.217 -10.498 -1.065 232 H GLN 34 H GLN 34 7.180 -15.298 1.453 233 HA GLN 34 HA GLN 34 8.748 -16.207 -0.784 234 HB2 GLN 34 HB2 GLN 34 9.287 -16.928 1.473 235 HB3 GLN 34 HB1 GLN 34 7.700 -17.660 1.651 236 HG2 GLN 34 HG2 GLN 34 8.316 -19.158 -0.284 237 HG3 GLN 34 HG1 GLN 34 9.957 -18.538 -0.128 238 HE21 GLN 34 HE21 GLN 34 8.951 -21.250 0.228 239 HE22 GLN 34 HE22 GLN 34 9.388 -21.710 1.836 240 H ALA 35 H ALA 35 5.474 -16.249 0.207 241 HA ALA 35 HA ALA 35 4.441 -18.502 -1.071 242 HB1 ALA 35 HB1 ALA 35 2.314 -17.447 -0.878 243 HB2 ALA 35 HB2 ALA 35 3.046 -15.845 -0.827 244 HB3 ALA 35 HB3 ALA 35 3.260 -16.957 0.528 245 HA PRO 36 HA PRO 36 4.746 -17.304 -5.399 246 HB2 PRO 36 HB2 PRO 36 2.591 -19.263 -5.820 247 HB3 PRO 36 HB1 PRO 36 4.224 -19.245 -6.485 248 HG2 PRO 36 HG2 PRO 36 3.458 -21.033 -4.621 249 HG3 PRO 36 HG1 PRO 36 5.110 -20.393 -4.699 250 HD2 PRO 36 HD2 PRO 36 2.872 -19.649 -2.857 251 HD3 PRO 36 HD1 PRO 36 4.607 -19.826 -2.514 252 H ILE 37 H ILE 37 3.797 -15.429 -5.851 253 HA ILE 37 HA ILE 37 0.908 -15.148 -5.383 254 HB ILE 37 HB ILE 37 1.315 -12.789 -4.783 255 HG12 ILE 37 HG12 ILE 37 4.193 -13.573 -5.156 256 HG13 ILE 37 HG11 ILE 37 3.311 -12.261 -5.918 257 HG21 ILE 37 HG21 ILE 37 2.458 -13.188 -2.561 258 HG22 ILE 37 HG22 ILE 37 2.775 -14.841 -3.109 259 HG23 ILE 37 HG23 ILE 37 1.114 -14.279 -2.931 260 HD11 ILE 37 HD11 ILE 37 4.736 -11.302 -4.296 261 HD12 ILE 37 HD12 ILE 37 4.208 -12.458 -3.076 262 HD13 ILE 37 HD13 ILE 37 3.092 -11.227 -3.653 263 H THR 38 H THR 38 -0.144 -13.539 -6.769 264 HA THR 38 HA THR 38 1.051 -13.603 -9.437 265 HB THR 38 HB THR 38 -1.304 -13.049 -10.188 266 HG1 THR 38 HG1 THR 38 -2.680 -12.670 -8.636 267 HG21 THR 38 HG21 THR 38 -2.032 -15.360 -9.958 268 HG22 THR 38 HG22 THR 38 -0.777 -15.630 -8.748 269 HG23 THR 38 HG23 THR 38 -0.337 -15.241 -10.412 270 H GLY 39 H GLY 39 -0.082 -11.297 -7.035 271 HA2 GLY 39 HA2 GLY 39 1.245 -9.206 -8.411 272 HA3 GLY 39 HA1 GLY 39 -0.492 -9.075 -8.615 273 H TYR 40 H TYR 40 -0.101 -7.007 -7.523 274 HA TYR 40 HA TYR 40 -0.552 -7.359 -4.646 275 HB2 TYR 40 HB2 TYR 40 1.538 -5.645 -5.933 276 HB3 TYR 40 HB1 TYR 40 0.710 -5.042 -4.501 277 HD1 TYR 40 HD2 TYR 40 2.146 -8.340 -5.525 278 HD2 TYR 40 HD1 TYR 40 1.914 -5.294 -2.572 279 HE1 TYR 40 HE2 TYR 40 3.702 -9.587 -4.114 280 HE2 TYR 40 HE1 TYR 40 3.435 -6.569 -1.142 281 HH TYR 40 HH TYR 40 5.187 -9.273 -2.303 282 H ARG 41 H ARG 41 -2.281 -6.246 -3.965 283 HA ARG 41 HA ARG 41 -3.172 -3.948 -5.580 284 HB2 ARG 41 HB2 ARG 41 -4.652 -4.987 -3.205 285 HB3 ARG 41 HB1 ARG 41 -5.257 -4.172 -4.647 286 HG2 ARG 41 HG2 ARG 41 -4.941 -6.141 -5.969 287 HG3 ARG 41 HG1 ARG 41 -4.064 -6.932 -4.649 288 HD2 ARG 41 HD2 ARG 41 -6.399 -7.731 -4.895 289 HD3 ARG 41 HD1 ARG 41 -6.071 -7.015 -3.317 290 HE ARG 41 HE ARG 41 -7.104 -5.055 -5.087 291 HH11 ARG 41 HH11 ARG 41 -8.090 -7.853 -3.204 292 HH12 ARG 41 HH12 ARG 41 -9.720 -7.282 -3.001 293 HH21 ARG 41 HH21 ARG 41 -9.212 -4.292 -4.781 294 HH22 ARG 41 HH22 ARG 41 -10.357 -5.246 -3.885 295 H ILE 42 H ILE 42 -3.468 -1.926 -4.565 296 HA ILE 42 HA ILE 42 -2.327 -1.712 -1.848 297 HB ILE 42 HB ILE 42 -1.553 0.125 -4.097 298 HG12 ILE 42 HG12 ILE 42 0.143 -2.026 -2.873 299 HG13 ILE 42 HG11 ILE 42 -0.777 -2.256 -4.353 300 HG21 ILE 42 HG21 ILE 42 -1.465 1.015 -1.765 301 HG22 ILE 42 HG22 ILE 42 0.095 0.984 -2.581 302 HG23 ILE 42 HG23 ILE 42 -0.297 -0.250 -1.381 303 HD11 ILE 42 HD11 ILE 42 1.486 -1.753 -4.889 304 HD12 ILE 42 HD12 ILE 42 1.441 -0.304 -3.890 305 HD13 ILE 42 HD13 ILE 42 0.471 -0.389 -5.359 306 H VAL 43 H VAL 43 -3.968 -0.903 -0.664 307 HA VAL 43 HA VAL 43 -5.519 1.287 -1.878 308 HB VAL 43 HB VAL 43 -6.278 -0.513 0.427 309 HG11 VAL 43 HG11 VAL 43 -7.039 1.730 0.870 310 HG12 VAL 43 HG12 VAL 43 -8.396 0.690 0.456 311 HG13 VAL 43 HG13 VAL 43 -7.762 1.828 -0.734 312 HG21 VAL 43 HG21 VAL 43 -8.087 -1.220 -1.040 313 HG22 VAL 43 HG22 VAL 43 -6.521 -1.520 -1.794 314 HG23 VAL 43 HG23 VAL 43 -7.496 -0.139 -2.300 315 H TYR 44 H TYR 44 -4.730 3.160 -1.358 316 HA TYR 44 HA TYR 44 -3.941 3.626 1.417 317 HB2 TYR 44 HB2 TYR 44 -2.794 5.719 0.323 318 HB3 TYR 44 HB1 TYR 44 -1.997 4.153 0.287 319 HD1 TYR 44 HD2 TYR 44 -2.398 2.719 -1.831 320 HD2 TYR 44 HD1 TYR 44 -3.074 6.909 -1.661 321 HE1 TYR 44 HE2 TYR 44 -2.212 2.822 -4.265 322 HE2 TYR 44 HE1 TYR 44 -2.885 7.039 -4.105 323 HH TYR 44 HH TYR 44 -1.949 5.817 -5.937 324 H SER 45 H SER 45 -5.024 4.896 2.563 325 HA SER 45 HA SER 45 -6.963 6.733 1.361 326 HB2 SER 45 HB2 SER 45 -8.043 4.482 1.674 327 HB3 SER 45 HB1 SER 45 -7.748 4.641 3.404 328 HG SER 45 HG SER 45 -9.884 5.328 2.505 329 HA PRO 46 HA PRO 46 -5.703 9.342 4.798 330 HB2 PRO 46 HB2 PRO 46 -8.310 10.581 4.398 331 HB3 PRO 46 HB1 PRO 46 -6.709 11.300 4.314 332 HG2 PRO 46 HG2 PRO 46 -8.151 10.899 2.105 333 HG3 PRO 46 HG1 PRO 46 -6.393 10.668 2.116 334 HD2 PRO 46 HD2 PRO 46 -8.574 8.624 2.218 335 HD3 PRO 46 HD1 PRO 46 -7.041 8.600 1.322 336 H SER 47 H SER 47 -6.235 9.713 6.912 337 HA SER 47 HA SER 47 -7.557 7.602 8.204 338 HB2 SER 47 HB2 SER 47 -5.677 8.793 9.211 339 HB3 SER 47 HB1 SER 47 -6.638 10.266 9.300 340 HG SER 47 HG SER 47 -7.355 7.839 10.587 341 H VAL 48 H VAL 48 -8.670 10.834 7.320 342 HA VAL 48 HA VAL 48 -11.242 10.167 8.597 343 HB VAL 48 HB VAL 48 -10.059 12.904 8.105 344 HG11 VAL 48 HG11 VAL 48 -12.697 12.135 9.339 345 HG12 VAL 48 HG12 VAL 48 -12.461 12.941 7.789 346 HG13 VAL 48 HG13 VAL 48 -12.026 13.766 9.286 347 HG21 VAL 48 HG21 VAL 48 -10.619 11.418 10.670 348 HG22 VAL 48 HG22 VAL 48 -10.034 13.078 10.551 349 HG23 VAL 48 HG23 VAL 48 -9.027 11.746 9.983 350 H GLU 49 H GLU 49 -9.751 11.751 5.775 351 HA GLU 49 HA GLU 49 -11.558 10.720 3.908 352 HB2 GLU 49 HB2 GLU 49 -12.906 12.691 3.354 353 HB3 GLU 49 HB1 GLU 49 -13.221 12.161 5.000 354 HG2 GLU 49 HG2 GLU 49 -11.736 13.927 5.836 355 HG3 GLU 49 HG1 GLU 49 -11.472 14.469 4.179 356 H GLY 50 H GLY 50 -11.206 11.556 1.751 357 HA2 GLY 50 HA2 GLY 50 -9.870 13.578 0.724 358 HA3 GLY 50 HA1 GLY 50 -8.536 12.733 1.497 359 H SER 51 H SER 51 -7.448 12.132 -0.364 360 HA SER 51 HA SER 51 -8.918 10.742 -2.453 361 HB2 SER 51 HB2 SER 51 -5.988 11.517 -2.250 362 HB3 SER 51 HB1 SER 51 -6.748 10.769 -3.660 363 HG SER 51 HG SER 51 -7.918 13.081 -2.617 364 H SER 52 H SER 52 -9.218 8.623 -2.356 365 HA SER 52 HA SER 52 -7.078 6.979 -1.184 366 HB2 SER 52 HB2 SER 52 -8.982 5.251 -0.904 367 HB3 SER 52 HB1 SER 52 -8.968 6.627 0.204 368 HG SER 52 HG SER 52 -10.639 6.162 -2.029 369 H THR 53 H THR 53 -6.340 5.249 -2.338 370 HA THR 53 HA THR 53 -7.594 4.684 -4.918 371 HB THR 53 HB THR 53 -4.723 5.621 -4.737 372 HG1 THR 53 HG1 THR 53 -7.016 6.992 -4.937 373 HG21 THR 53 HG21 THR 53 -4.774 5.552 -7.185 374 HG22 THR 53 HG22 THR 53 -6.410 4.894 -7.136 375 HG23 THR 53 HG23 THR 53 -5.059 3.955 -6.494 376 H GLU 54 H GLU 54 -6.995 2.702 -5.822 377 HA GLU 54 HA GLU 54 -5.209 1.016 -4.228 378 HB2 GLU 54 HB2 GLU 54 -7.604 0.266 -4.305 379 HB3 GLU 54 HB1 GLU 54 -7.449 0.103 -6.047 380 HG2 GLU 54 HG2 GLU 54 -5.637 -1.549 -5.685 381 HG3 GLU 54 HG1 GLU 54 -5.933 -1.440 -3.953 382 H LEU 55 H LEU 55 -3.282 0.811 -5.232 383 HA LEU 55 HA LEU 55 -3.252 0.867 -8.160 384 HB2 LEU 55 HB2 LEU 55 -0.945 1.074 -6.183 385 HB3 LEU 55 HB1 LEU 55 -0.745 0.919 -7.927 386 HG LEU 55 HG LEU 55 -1.934 3.191 -6.393 387 HD11 LEU 55 HD11 LEU 55 -0.310 4.472 -7.819 388 HD12 LEU 55 HD12 LEU 55 0.360 2.913 -8.303 389 HD13 LEU 55 HD13 LEU 55 0.394 3.404 -6.608 390 HD21 LEU 55 HD21 LEU 55 -2.484 4.226 -8.577 391 HD22 LEU 55 HD22 LEU 55 -3.475 2.819 -8.196 392 HD23 LEU 55 HD23 LEU 55 -2.150 2.677 -9.351 393 H ASN 56 H ASN 56 -2.151 -0.738 -9.355 394 HA ASN 56 HA ASN 56 -2.096 -3.331 -7.964 395 HB2 ASN 56 HB2 ASN 56 -3.953 -3.156 -9.587 396 HB3 ASN 56 HB1 ASN 56 -2.797 -2.775 -10.859 397 HD21 ASN 56 HD21 ASN 56 -4.034 -5.244 -8.754 398 HD22 ASN 56 HD22 ASN 56 -3.342 -6.589 -9.599 399 H LEU 57 H LEU 57 -0.136 -4.208 -7.864 400 HA LEU 57 HA LEU 57 1.873 -3.284 -9.802 401 HB2 LEU 57 HB2 LEU 57 2.183 -3.875 -6.841 402 HB3 LEU 57 HB1 LEU 57 3.541 -3.779 -7.938 403 HG LEU 57 HG LEU 57 1.855 -1.647 -6.792 404 HD11 LEU 57 HD11 LEU 57 3.968 -0.503 -6.670 405 HD12 LEU 57 HD12 LEU 57 4.733 -1.756 -7.647 406 HD13 LEU 57 HD13 LEU 57 4.137 -2.138 -6.034 407 HD21 LEU 57 HD21 LEU 57 3.112 -1.394 -9.507 408 HD22 LEU 57 HD22 LEU 57 2.438 -0.078 -8.547 409 HD23 LEU 57 HD23 LEU 57 1.385 -1.358 -9.147 410 HA PRO 58 HA PRO 58 2.541 -7.505 -10.829 411 HB2 PRO 58 HB2 PRO 58 5.295 -7.530 -11.043 412 HB3 PRO 58 HB1 PRO 58 4.190 -7.005 -12.314 413 HG2 PRO 58 HG2 PRO 58 5.804 -5.387 -10.418 414 HG3 PRO 58 HG1 PRO 58 5.347 -5.037 -12.091 415 HD2 PRO 58 HD2 PRO 58 4.157 -3.878 -9.929 416 HD3 PRO 58 HD1 PRO 58 3.328 -4.127 -11.474 417 H GLU 59 H GLU 59 3.121 -9.399 -9.953 418 HA GLU 59 HA GLU 59 3.156 -9.860 -7.279 419 HB2 GLU 59 HB2 GLU 59 4.146 -12.098 -7.858 420 HB3 GLU 59 HB1 GLU 59 2.731 -11.636 -8.797 421 HG2 GLU 59 HG2 GLU 59 4.158 -10.973 -10.650 422 HG3 GLU 59 HG1 GLU 59 5.588 -11.384 -9.709 423 H THR 60 H THR 60 5.879 -8.912 -9.168 424 HA THR 60 HA THR 60 7.719 -9.627 -6.998 425 HB THR 60 HB THR 60 8.280 -10.648 -9.141 426 HG1 THR 60 HG1 THR 60 10.070 -10.116 -7.910 427 HG21 THR 60 HG21 THR 60 8.464 -7.826 -10.193 428 HG22 THR 60 HG22 THR 60 7.250 -9.028 -10.635 429 HG23 THR 60 HG23 THR 60 8.942 -9.282 -11.067 430 H ALA 61 H ALA 61 5.915 -7.129 -7.584 431 HA ALA 61 HA ALA 61 7.824 -4.979 -7.760 432 HB1 ALA 61 HB1 ALA 61 4.912 -4.945 -6.979 433 HB2 ALA 61 HB2 ALA 61 5.559 -4.667 -8.594 434 HB3 ALA 61 HB3 ALA 61 5.902 -3.521 -7.300 435 H ASN 62 H ASN 62 8.182 -3.411 -6.044 436 HA ASN 62 HA ASN 62 7.706 -4.449 -3.349 437 HB2 ASN 62 HB2 ASN 62 10.000 -4.268 -2.689 438 HB3 ASN 62 HB1 ASN 62 9.934 -5.271 -4.133 439 HD21 ASN 62 HD21 ASN 62 12.119 -3.698 -2.985 440 HD22 ASN 62 HD22 ASN 62 12.641 -2.626 -4.236 441 H SER 63 H SER 63 7.021 -1.963 -5.146 442 HA SER 63 HA SER 63 7.039 -0.115 -2.989 443 HB2 SER 63 HB2 SER 63 8.526 1.591 -4.178 444 HB3 SER 63 HB1 SER 63 9.341 0.217 -3.432 445 HG SER 63 HG SER 63 8.989 -0.704 -5.720 446 H VAL 64 H VAL 64 5.515 1.403 -3.251 447 HA VAL 64 HA VAL 64 4.510 1.879 -5.987 448 HB VAL 64 HB VAL 64 2.722 0.722 -4.826 449 HG11 VAL 64 HG11 VAL 64 3.704 1.659 -2.546 450 HG12 VAL 64 HG12 VAL 64 2.068 1.050 -2.727 451 HG13 VAL 64 HG13 VAL 64 2.368 2.787 -2.775 452 HG21 VAL 64 HG21 VAL 64 2.063 2.453 -6.292 453 HG22 VAL 64 HG22 VAL 64 2.188 3.646 -4.997 454 HG23 VAL 64 HG23 VAL 64 0.975 2.366 -4.913 455 H THR 65 H THR 65 4.548 3.956 -6.664 456 HA THR 65 HA THR 65 4.932 6.084 -4.722 457 HB THR 65 HB THR 65 5.016 5.933 -7.720 458 HG1 THR 65 HG1 THR 65 6.820 5.211 -6.297 459 HG21 THR 65 HG21 THR 65 5.713 8.306 -7.720 460 HG22 THR 65 HG22 THR 65 5.407 8.387 -5.985 461 HG23 THR 65 HG23 THR 65 4.071 8.114 -7.104 462 H LEU 66 H LEU 66 3.041 6.487 -3.773 463 HA LEU 66 HA LEU 66 0.506 6.491 -5.128 464 HB2 LEU 66 HB2 LEU 66 0.742 7.857 -2.547 465 HB3 LEU 66 HB1 LEU 66 -0.407 6.643 -3.069 466 HG LEU 66 HG LEU 66 2.407 5.870 -2.416 467 HD11 LEU 66 HD11 LEU 66 1.220 7.207 -0.583 468 HD12 LEU 66 HD12 LEU 66 1.992 5.677 -0.201 469 HD13 LEU 66 HD13 LEU 66 0.239 5.754 -0.399 470 HD21 LEU 66 HD21 LEU 66 1.248 3.746 -1.869 471 HD22 LEU 66 HD22 LEU 66 1.088 4.226 -3.560 472 HD23 LEU 66 HD23 LEU 66 -0.254 4.481 -2.442 473 H SER 67 H SER 67 -0.763 8.339 -5.568 474 HA SER 67 HA SER 67 0.616 10.901 -5.441 475 HB2 SER 67 HB2 SER 67 0.070 11.258 -7.914 476 HB3 SER 67 HB1 SER 67 1.411 10.171 -7.555 477 HG SER 67 HG SER 67 -0.882 8.781 -7.619 478 H ASP 68 H ASP 68 -0.833 12.663 -6.330 479 HA ASP 68 HA ASP 68 -2.725 13.874 -6.148 480 HB2 ASP 68 HB2 ASP 68 -3.925 11.185 -6.750 481 HB3 ASP 68 HB1 ASP 68 -4.943 12.586 -6.430 482 H LEU 69 H LEU 69 -1.458 12.614 -3.791 483 HA LEU 69 HA LEU 69 -3.503 12.119 -1.876 484 HB2 LEU 69 HB2 LEU 69 -0.826 13.262 -1.128 485 HB3 LEU 69 HB1 LEU 69 -1.869 12.191 -0.214 486 HG LEU 69 HG LEU 69 -0.269 11.379 -2.627 487 HD11 LEU 69 HD11 LEU 69 0.115 10.876 0.315 488 HD12 LEU 69 HD12 LEU 69 1.116 11.905 -0.709 489 HD13 LEU 69 HD13 LEU 69 1.067 10.164 -0.989 490 HD21 LEU 69 HD21 LEU 69 -2.119 9.940 -2.550 491 HD22 LEU 69 HD22 LEU 69 -2.210 10.036 -0.790 492 HD23 LEU 69 HD23 LEU 69 -0.925 9.088 -1.553 493 H GLN 70 H GLN 70 -3.234 13.713 0.216 494 HA GLN 70 HA GLN 70 -3.583 16.446 -0.786 495 HB2 GLN 70 HB2 GLN 70 -5.758 15.405 -0.208 496 HB3 GLN 70 HB1 GLN 70 -5.176 15.130 1.428 497 HG2 GLN 70 HG2 GLN 70 -6.605 17.068 1.374 498 HG3 GLN 70 HG1 GLN 70 -4.952 17.559 1.732 499 HE21 GLN 70 HE21 GLN 70 -5.319 19.659 1.039 500 HE22 GLN 70 HE22 GLN 70 -5.488 20.065 -0.634 501 HA PRO 71 HA PRO 71 -0.169 17.039 1.994 502 HB2 PRO 71 HB2 PRO 71 -0.201 19.765 1.965 503 HB3 PRO 71 HB1 PRO 71 0.507 18.759 0.688 504 HG2 PRO 71 HG2 PRO 71 -2.183 20.084 0.791 505 HG3 PRO 71 HG1 PRO 71 -1.032 19.989 -0.556 506 HD2 PRO 71 HD2 PRO 71 -3.176 18.383 -0.421 507 HD3 PRO 71 HD1 PRO 71 -1.626 17.813 -1.075 508 H GLY 72 H GLY 72 -0.133 16.974 4.146 509 HA2 GLY 72 HA2 GLY 72 -0.562 17.661 6.332 510 HA3 GLY 72 HA1 GLY 72 -1.797 18.755 5.726 511 H VAL 73 H VAL 73 -1.575 15.335 4.962 512 HA VAL 73 HA VAL 73 -3.963 14.814 6.599 513 HB VAL 73 HB VAL 73 -3.684 14.139 3.663 514 HG11 VAL 73 HG11 VAL 73 -6.127 13.430 4.052 515 HG12 VAL 73 HG12 VAL 73 -5.621 13.223 5.734 516 HG13 VAL 73 HG13 VAL 73 -4.826 12.302 4.452 517 HG21 VAL 73 HG21 VAL 73 -5.947 15.359 3.677 518 HG22 VAL 73 HG22 VAL 73 -4.451 16.304 3.666 519 HG23 VAL 73 HG23 VAL 73 -5.353 16.091 5.171 520 H GLN 74 H GLN 74 -4.163 12.753 7.357 521 HA GLN 74 HA GLN 74 -1.785 11.154 7.453 522 HB2 GLN 74 HB2 GLN 74 -3.644 11.695 9.236 523 HB3 GLN 74 HB1 GLN 74 -4.443 10.310 8.518 524 HG2 GLN 74 HG2 GLN 74 -1.694 10.283 9.731 525 HG3 GLN 74 HG1 GLN 74 -3.161 9.701 10.511 526 HE21 GLN 74 HE21 GLN 74 -0.716 9.075 8.142 527 HE22 GLN 74 HE22 GLN 74 -1.186 7.449 7.796 528 H TYR 75 H TYR 75 -1.325 9.716 5.918 529 HA TYR 75 HA TYR 75 -3.555 8.502 4.437 530 HB2 TYR 75 HB2 TYR 75 -0.882 9.484 3.583 531 HB3 TYR 75 HB1 TYR 75 -1.517 8.048 2.774 532 HD1 TYR 75 HD1 TYR 75 -3.491 8.155 1.401 533 HD2 TYR 75 HD2 TYR 75 -2.011 11.642 3.327 534 HE1 TYR 75 HE1 TYR 75 -4.957 9.538 0.006 535 HE2 TYR 75 HE2 TYR 75 -3.472 13.036 1.926 536 HH TYR 75 HH TYR 75 -4.660 12.893 -0.253 537 H ASN 76 H ASN 76 -3.971 6.534 5.037 538 HA ASN 76 HA ASN 76 -1.915 4.770 6.083 539 HB2 ASN 76 HB2 ASN 76 -4.858 4.283 5.554 540 HB3 ASN 76 HB1 ASN 76 -3.773 3.165 6.374 541 HD21 ASN 76 HD21 ASN 76 -5.569 6.116 6.608 542 HD22 ASN 76 HD22 ASN 76 -5.367 6.339 8.313 543 H ILE 77 H ILE 77 -0.619 3.783 4.640 544 HA ILE 77 HA ILE 77 -1.711 2.962 2.054 545 HB ILE 77 HB ILE 77 1.115 2.734 3.100 546 HG12 ILE 77 HG12 ILE 77 1.419 4.357 1.091 547 HG13 ILE 77 HG11 ILE 77 -0.253 4.758 1.382 548 HG21 ILE 77 HG21 ILE 77 1.116 1.062 1.531 549 HG22 ILE 77 HG22 ILE 77 1.474 2.473 0.518 550 HG23 ILE 77 HG23 ILE 77 -0.165 1.827 0.580 551 HD11 ILE 77 HD11 ILE 77 1.236 6.317 2.489 552 HD12 ILE 77 HD12 ILE 77 1.978 4.990 3.384 553 HD13 ILE 77 HD13 ILE 77 0.288 5.409 3.666 554 H THR 78 H THR 78 -2.619 1.097 1.880 555 HA THR 78 HA THR 78 -1.846 -1.046 3.712 556 HB THR 78 HB THR 78 -4.396 -0.629 2.164 557 HG1 THR 78 HG1 THR 78 -3.700 -0.196 4.893 558 HG21 THR 78 HG21 THR 78 -5.283 -2.452 3.560 559 HG22 THR 78 HG22 THR 78 -3.693 -2.657 4.295 560 HG23 THR 78 HG23 THR 78 -3.923 -3.003 2.580 561 H ILE 79 H ILE 79 -0.572 -2.550 2.783 562 HA ILE 79 HA ILE 79 -0.672 -2.874 -0.148 563 HB ILE 79 HB ILE 79 1.296 -4.309 1.642 564 HG12 ILE 79 HG12 ILE 79 1.884 -2.058 2.096 565 HG13 ILE 79 HG11 ILE 79 2.980 -2.628 0.840 566 HG21 ILE 79 HG21 ILE 79 1.248 -5.256 -0.491 567 HG22 ILE 79 HG22 ILE 79 2.659 -4.183 -0.468 568 HG23 ILE 79 HG23 ILE 79 1.173 -3.674 -1.273 569 HD11 ILE 79 HD11 ILE 79 2.056 -1.311 -0.779 570 HD12 ILE 79 HD12 ILE 79 1.977 -0.283 0.667 571 HD13 ILE 79 HD13 ILE 79 0.533 -1.118 0.100 572 H TYR 80 H TYR 80 -1.175 -4.788 -1.129 573 HA TYR 80 HA TYR 80 -2.074 -7.018 0.577 574 HB2 TYR 80 HB2 TYR 80 -3.374 -6.067 -1.992 575 HB3 TYR 80 HB1 TYR 80 -3.900 -7.421 -1.007 576 HD1 TYR 80 HD1 TYR 80 -5.117 -7.057 1.056 577 HD2 TYR 80 HD2 TYR 80 -3.868 -3.759 -1.348 578 HE1 TYR 80 HE1 TYR 80 -6.690 -5.595 2.250 579 HE2 TYR 80 HE2 TYR 80 -5.435 -2.301 -0.150 580 HH TYR 80 HH TYR 80 -7.010 -3.231 2.728 581 H ALA 81 H ALA 81 -0.581 -8.598 0.158 582 HA ALA 81 HA ALA 81 0.510 -8.982 -2.502 583 HB1 ALA 81 HB1 ALA 81 1.568 -11.022 -1.457 584 HB2 ALA 81 HB2 ALA 81 0.801 -10.555 0.073 585 HB3 ALA 81 HB3 ALA 81 1.987 -9.491 -0.681 586 H VAL 82 H VAL 82 -0.485 -10.168 -4.060 587 HA VAL 82 HA VAL 82 -2.695 -11.901 -3.104 588 HB VAL 82 HB VAL 82 -3.620 -9.948 -4.210 589 HG11 VAL 82 HG11 VAL 82 -1.825 -9.334 -5.682 590 HG12 VAL 82 HG12 VAL 82 -3.321 -9.545 -6.593 591 HG13 VAL 82 HG13 VAL 82 -2.079 -10.797 -6.632 592 HG21 VAL 82 HG21 VAL 82 -4.769 -12.111 -4.435 593 HG22 VAL 82 HG22 VAL 82 -3.908 -12.377 -5.956 594 HG23 VAL 82 HG23 VAL 82 -5.058 -11.045 -5.810 595 H GLU 83 H GLU 83 -2.739 -13.952 -3.708 596 HA GLU 83 HA GLU 83 -0.919 -14.865 -5.827 597 HB2 GLU 83 HB2 GLU 83 -2.566 -16.750 -4.168 598 HB3 GLU 83 HB1 GLU 83 -1.037 -17.006 -4.980 599 HG2 GLU 83 HG2 GLU 83 0.100 -15.704 -3.325 600 HG3 GLU 83 HG1 GLU 83 -1.416 -15.454 -2.457 601 H GLU 84 H GLU 84 -1.949 -16.761 -7.123 602 HA GLU 84 HA GLU 84 -3.776 -15.908 -8.898 603 HB2 GLU 84 HB2 GLU 84 -3.536 -18.714 -7.825 604 HB3 GLU 84 HB1 GLU 84 -4.435 -18.290 -9.271 605 HG2 GLU 84 HG2 GLU 84 -2.346 -17.417 -10.261 606 HG3 GLU 84 HG1 GLU 84 -1.480 -17.993 -8.837 607 H ASN 85 H ASN 85 -4.638 -17.467 -5.817 608 HA ASN 85 HA ASN 85 -7.384 -16.516 -6.262 609 HB2 ASN 85 HB2 ASN 85 -7.286 -18.937 -6.634 610 HB3 ASN 85 HB1 ASN 85 -6.590 -19.164 -5.035 611 HD21 ASN 85 HD21 ASN 85 -7.902 -19.212 -3.280 612 HD22 ASN 85 HD22 ASN 85 -9.630 -19.104 -3.366 613 H GLN 86 H GLN 86 -4.698 -16.668 -4.116 614 HA GLN 86 HA GLN 86 -6.386 -16.172 -1.778 615 HB2 GLN 86 HB2 GLN 86 -3.462 -16.850 -2.028 616 HB3 GLN 86 HB1 GLN 86 -4.202 -16.354 -0.516 617 HG2 GLN 86 HG2 GLN 86 -3.989 -18.738 -0.572 618 HG3 GLN 86 HG1 GLN 86 -5.692 -18.301 -0.633 619 HE21 GLN 86 HE21 GLN 86 -2.957 -19.354 -2.557 620 HE22 GLN 86 HE22 GLN 86 -3.892 -20.137 -3.787 621 H GLU 87 H GLU 87 -5.560 -14.584 -0.200 622 HA GLU 87 HA GLU 87 -3.978 -12.386 -1.267 623 HB2 GLU 87 HB2 GLU 87 -6.825 -12.120 -0.315 624 HB3 GLU 87 HB1 GLU 87 -5.704 -10.769 -0.228 625 HG2 GLU 87 HG2 GLU 87 -5.394 -10.834 -2.625 626 HG3 GLU 87 HG1 GLU 87 -6.436 -12.249 -2.745 627 H SER 88 H SER 88 -2.497 -11.915 0.188 628 HA SER 88 HA SER 88 -2.430 -13.095 2.748 629 HB2 SER 88 HB2 SER 88 -0.770 -10.762 1.783 630 HB3 SER 88 HB1 SER 88 -0.345 -11.937 3.026 631 HG SER 88 HG SER 88 0.668 -12.713 1.295 632 H THR 89 H THR 89 -2.025 -11.814 4.764 633 HA THR 89 HA THR 89 -4.082 -10.070 5.460 634 HB THR 89 HB THR 89 -2.481 -9.404 7.353 635 HG1 THR 89 HG1 THR 89 -0.515 -9.880 6.374 636 HG21 THR 89 HG21 THR 89 -4.184 -11.129 7.619 637 HG22 THR 89 HG22 THR 89 -2.703 -11.582 8.463 638 HG23 THR 89 HG23 THR 89 -3.098 -12.325 6.913 639 HA PRO 90 HA PRO 90 -2.783 -6.277 3.689 640 HB2 PRO 90 HB2 PRO 90 -4.052 -4.498 5.282 641 HB3 PRO 90 HB1 PRO 90 -4.912 -5.542 4.144 642 HG2 PRO 90 HG2 PRO 90 -4.582 -5.826 7.098 643 HG3 PRO 90 HG1 PRO 90 -6.000 -6.152 6.088 644 HD2 PRO 90 HD2 PRO 90 -4.296 -8.078 7.025 645 HD3 PRO 90 HD1 PRO 90 -5.298 -8.245 5.572 646 H VAL 91 H VAL 91 -1.028 -5.081 3.781 647 HA VAL 91 HA VAL 91 0.533 -4.593 6.170 648 HB VAL 91 HB VAL 91 0.669 -3.510 3.369 649 HG11 VAL 91 HG11 VAL 91 2.831 -2.581 4.050 650 HG12 VAL 91 HG12 VAL 91 2.516 -3.094 5.706 651 HG13 VAL 91 HG13 VAL 91 1.488 -1.881 4.948 652 HG21 VAL 91 HG21 VAL 91 1.278 -5.882 3.570 653 HG22 VAL 91 HG22 VAL 91 2.499 -5.448 4.769 654 HG23 VAL 91 HG23 VAL 91 2.638 -4.856 3.109 655 H VAL 92 H VAL 92 -0.059 -2.912 7.555 656 HA VAL 92 HA VAL 92 -1.275 -0.588 6.218 657 HB VAL 92 HB VAL 92 -1.629 -1.187 9.148 658 HG11 VAL 92 HG11 VAL 92 -3.523 0.377 8.871 659 HG12 VAL 92 HG12 VAL 92 -3.046 0.613 7.187 660 HG13 VAL 92 HG13 VAL 92 -1.966 1.113 8.491 661 HG21 VAL 92 HG21 VAL 92 -2.595 -3.045 7.874 662 HG22 VAL 92 HG22 VAL 92 -3.504 -1.899 6.887 663 HG23 VAL 92 HG23 VAL 92 -3.854 -2.052 8.609 664 H ILE 93 H ILE 93 0.323 0.770 5.870 665 HA ILE 93 HA ILE 93 1.942 1.581 8.191 666 HB ILE 93 HB ILE 93 3.599 2.456 6.433 667 HG12 ILE 93 HG12 ILE 93 2.380 0.361 4.667 668 HG13 ILE 93 HG11 ILE 93 1.888 2.032 4.565 669 HG21 ILE 93 HG21 ILE 93 4.068 0.561 7.884 670 HG22 ILE 93 HG22 ILE 93 4.712 0.279 6.266 671 HG23 ILE 93 HG23 ILE 93 3.223 -0.518 6.773 672 HD11 ILE 93 HD11 ILE 93 4.636 0.938 4.126 673 HD12 ILE 93 HD12 ILE 93 4.245 2.657 4.190 674 HD13 ILE 93 HD13 ILE 93 3.552 1.635 2.916 675 H GLN 94 H GLN 94 1.252 3.461 8.932 676 HA GLN 94 HA GLN 94 -0.206 5.200 7.093 677 HB2 GLN 94 HB2 GLN 94 -1.180 6.219 9.113 678 HB3 GLN 94 HB1 GLN 94 -1.481 4.492 9.012 679 HG2 GLN 94 HG2 GLN 94 0.359 4.105 10.602 680 HG3 GLN 94 HG1 GLN 94 0.571 5.848 10.748 681 HE21 GLN 94 HE21 GLN 94 -1.022 7.065 11.783 682 HE22 GLN 94 HE22 GLN 94 -2.184 6.334 12.839 683 H GLN 95 H GLN 95 0.687 6.937 6.349 684 HA GLN 95 HA GLN 95 2.739 8.327 7.932 685 HB2 GLN 95 HB2 GLN 95 2.977 7.073 5.370 686 HB3 GLN 95 HB1 GLN 95 3.150 8.805 5.156 687 HG2 GLN 95 HG2 GLN 95 4.763 7.053 6.995 688 HG3 GLN 95 HG1 GLN 95 5.302 7.762 5.476 689 HE21 GLN 95 HE21 GLN 95 3.855 10.296 6.095 690 HE22 GLN 95 HE22 GLN 95 4.871 11.104 7.239 691 H GLU 96 H GLU 96 2.310 10.443 8.251 692 HA GLU 96 HA GLU 96 0.058 11.662 6.882 693 HB2 GLU 96 HB2 GLU 96 1.915 12.713 9.028 694 HB3 GLU 96 HB1 GLU 96 0.547 13.605 8.373 695 HG2 GLU 96 HG2 GLU 96 -0.998 12.029 9.242 696 HG3 GLU 96 HG1 GLU 96 0.297 10.928 9.707 697 H THR 97 H THR 97 0.177 13.176 5.319 698 HA THR 97 HA THR 97 2.596 13.341 3.853 699 HB THR 97 HB THR 97 1.312 15.022 2.462 700 HG1 THR 97 HG1 THR 97 -1.064 14.828 2.989 701 HG21 THR 97 HG21 THR 97 0.005 12.346 2.963 702 HG22 THR 97 HG22 THR 97 1.404 12.621 1.927 703 HG23 THR 97 HG23 THR 97 -0.160 13.322 1.503 704 H THR 98 H THR 98 4.262 14.525 4.371 705 HA THR 98 HA THR 98 4.212 16.712 6.173 706 HB THR 98 HB THR 98 6.411 16.085 4.202 707 HG1 THR 98 HG1 THR 98 5.635 14.735 6.579 708 HG21 THR 98 HG21 THR 98 6.456 17.206 7.011 709 HG22 THR 98 HG22 THR 98 6.688 18.130 5.527 710 HG23 THR 98 HG23 THR 98 7.868 16.908 6.000 711 H GLY 99 H GLY 99 4.143 16.327 2.725 712 HA2 GLY 99 HA2 GLY 99 3.664 17.753 1.022 713 HA3 GLY 99 HA1 GLY 99 2.915 18.782 2.217 714 H THR 100 H THR 100 3.622 20.748 1.908 715 HA THR 100 HA THR 100 6.311 21.240 0.938 716 HB THR 100 HB THR 100 4.100 23.222 1.484 717 HG1 THR 100 HG1 THR 100 3.960 21.315 -0.225 718 HG21 THR 100 HG21 THR 100 6.301 24.210 1.279 719 HG22 THR 100 HG22 THR 100 5.286 24.619 -0.100 720 HG23 THR 100 HG23 THR 100 6.538 23.387 -0.262 721 HA PRO 101 HA PRO 101 7.792 21.952 5.113 722 HB2 PRO 101 HB2 PRO 101 10.015 23.275 3.672 723 HB3 PRO 101 HB1 PRO 101 10.062 21.956 4.846 724 HG2 PRO 101 HG2 PRO 101 10.491 21.503 2.249 725 HG3 PRO 101 HG1 PRO 101 9.599 20.343 3.251 726 HD2 PRO 101 HD2 PRO 101 8.558 22.340 1.280 727 HD3 PRO 101 HD1 PRO 101 8.028 20.673 1.587 728 H ARG 102 H ARG 102 6.304 23.503 5.770 729 HA ARG 102 HA ARG 102 6.651 26.267 4.939 730 HB2 ARG 102 HB2 ARG 102 4.665 24.923 6.776 731 HB3 ARG 102 HB1 ARG 102 4.674 26.650 6.443 732 HG2 ARG 102 HG2 ARG 102 4.149 26.299 4.155 733 HG3 ARG 102 HG1 ARG 102 4.423 24.561 4.295 734 HD2 ARG 102 HD2 ARG 102 2.268 26.085 5.754 735 HD3 ARG 102 HD1 ARG 102 2.023 25.192 4.254 736 HE ARG 102 HE ARG 102 3.078 23.313 5.851 737 HH11 ARG 102 HH11 ARG 102 0.443 25.571 6.338 738 HH12 ARG 102 HH12 ARG 102 -0.409 24.528 7.432 739 HH21 ARG 102 HH21 ARG 102 1.959 21.948 7.290 740 HH22 ARG 102 HH22 ARG 102 0.454 22.476 7.975 741 H SER 103 H SER 103 7.398 24.187 7.609 742 HA SER 103 HA SER 103 8.117 26.379 9.357 743 HB2 SER 103 HB2 SER 103 7.194 24.193 10.212 744 HB3 SER 103 HB1 SER 103 8.697 23.424 9.704 745 HG SER 103 HG SER 103 9.485 24.046 11.538 746 H ASP 104 H ASP 104 9.866 27.504 8.790 747 HA ASP 104 HA ASP 104 11.909 26.410 7.118 748 HB2 ASP 104 HB2 ASP 104 11.804 29.048 8.591 749 HB3 ASP 104 HB1 ASP 104 12.992 28.620 7.367 750 H GLY 105 H GLY 105 11.501 26.866 10.527 751 HA2 GLY 105 HA2 GLY 105 12.766 25.660 12.130 752 HA3 GLY 105 HA1 GLY 105 14.087 25.559 10.972 753 H THR 106 H THR 106 15.780 26.621 11.767 754 HA THR 106 HA THR 106 15.379 29.418 12.522 755 HB THR 106 HB THR 106 17.147 27.580 14.148 756 HG1 THR 106 HG1 THR 106 14.763 27.242 14.317 757 HG21 THR 106 HG21 THR 106 17.211 29.457 15.714 758 HG22 THR 106 HG22 THR 106 16.175 30.398 14.643 759 HG23 THR 106 HG23 THR 106 17.800 29.950 14.126 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 0.776 -37.914 4.148 2 H2 GLY 1 HT2 GLY 1 0.904 -39.531 4.610 3 H3 GLY 1 HT3 GLY 1 2.051 -38.858 3.564 4 HA2 GLY 1 HA1 GLY 1 2.997 -39.045 5.745 5 HA3 GLY 1 HA2 GLY 1 2.785 -37.355 5.318 6 H SER 2 H SER 2 2.430 -36.388 7.232 7 HA SER 2 HA SER 2 0.404 -37.561 9.007 8 HB2 SER 2 HB2 SER 2 1.414 -35.939 10.702 9 HB3 SER 2 HB1 SER 2 2.438 -37.281 10.190 10 HG SER 2 HG SER 2 3.680 -35.935 9.045 11 H HIS 3 H HIS 3 1.107 -34.843 7.000 12 HA HIS 3 HA HIS 3 -0.894 -33.125 8.154 13 HB2 HIS 3 HB2 HIS 3 0.825 -32.965 5.693 14 HB3 HIS 3 HB1 HIS 3 -0.494 -31.830 5.947 15 HD1 HIS 3 HD1 HIS 3 2.859 -32.809 7.339 16 HD2 HIS 3 HD2 HIS 3 -0.015 -29.850 7.820 17 HE1 HIS 3 HE1 HIS 3 3.939 -31.047 8.767 18 HE2 HIS 3 HE2 HIS 3 2.246 -29.186 8.883 19 H MET 4 H MET 4 -2.984 -33.417 7.898 20 HA MET 4 HA MET 4 -3.963 -35.016 5.669 21 HB2 MET 4 HB2 MET 4 -5.369 -33.877 8.092 22 HB3 MET 4 HB1 MET 4 -6.162 -34.836 6.847 23 HG2 MET 4 HG2 MET 4 -3.939 -35.736 8.664 24 HG3 MET 4 HG1 MET 4 -5.632 -36.223 8.744 25 HE1 MET 4 HE1 MET 4 -3.099 -38.204 8.645 26 HE2 MET 4 HE2 MET 4 -3.680 -39.446 7.537 27 HE3 MET 4 HE3 MET 4 -4.756 -38.792 8.770 28 H GLY 5 H GLY 5 -4.080 -31.749 6.911 29 HA2 GLY 5 HA2 GLY 5 -5.447 -30.917 4.432 30 HA3 GLY 5 HA1 GLY 5 -5.485 -30.011 5.942 31 H THR 6 H THR 6 -4.493 -29.383 3.135 32 HA THR 6 HA THR 6 -1.988 -28.186 4.024 33 HB THR 6 HB THR 6 -2.088 -29.700 1.407 34 HG1 THR 6 HG1 THR 6 -1.696 -30.599 3.975 35 HG21 THR 6 HG21 THR 6 0.351 -29.467 1.503 36 HG22 THR 6 HG22 THR 6 0.211 -28.581 3.022 37 HG23 THR 6 HG23 THR 6 -0.436 -27.889 1.534 38 H THR 7 H THR 7 -3.963 -26.611 3.911 39 HA THR 7 HA THR 7 -4.462 -25.484 1.307 40 HB THR 7 HB THR 7 -5.032 -24.313 4.045 41 HG1 THR 7 HG1 THR 7 -7.033 -25.278 3.859 42 HG21 THR 7 HG21 THR 7 -6.198 -23.667 1.334 43 HG22 THR 7 HG22 THR 7 -5.083 -22.651 2.246 44 HG23 THR 7 HG23 THR 7 -6.704 -22.961 2.869 45 H THR 8 H THR 8 -3.185 -24.041 0.291 46 HA THR 8 HA THR 8 -0.706 -23.271 1.399 47 HB THR 8 HB THR 8 -2.095 -22.092 -1.015 48 HG1 THR 8 HG1 THR 8 -0.686 -24.481 -0.567 49 HG21 THR 8 HG21 THR 8 -0.195 -20.765 -0.178 50 HG22 THR 8 HG22 THR 8 0.165 -21.507 -1.738 51 HG23 THR 8 HG23 THR 8 0.830 -22.197 -0.257 52 H ALA 9 H ALA 9 -0.279 -21.722 2.769 53 HA ALA 9 HA ALA 9 -2.179 -19.490 3.041 54 HB1 ALA 9 HB1 ALA 9 -0.560 -20.788 5.230 55 HB2 ALA 9 HB2 ALA 9 -2.284 -21.028 4.951 56 HB3 ALA 9 HB3 ALA 9 -1.680 -19.439 5.421 57 HA PRO 10 HA PRO 10 1.777 -17.568 1.830 58 HB2 PRO 10 HB2 PRO 10 0.653 -15.422 0.642 59 HB3 PRO 10 HB1 PRO 10 0.768 -16.992 -0.162 60 HG2 PRO 10 HG2 PRO 10 -1.555 -15.767 1.270 61 HG3 PRO 10 HG1 PRO 10 -1.524 -16.612 -0.288 62 HD2 PRO 10 HD2 PRO 10 -2.297 -17.817 1.988 63 HD3 PRO 10 HD1 PRO 10 -1.497 -18.680 0.711 64 H ASP 11 H ASP 11 2.616 -15.332 2.237 65 HA ASP 11 HA ASP 11 1.445 -14.230 4.709 66 HB2 ASP 11 HB2 ASP 11 4.383 -14.457 4.003 67 HB3 ASP 11 HB1 ASP 11 3.738 -13.715 5.459 68 H ALA 12 H ALA 12 1.866 -11.963 5.061 69 HA ALA 12 HA ALA 12 1.948 -10.438 2.565 70 HB1 ALA 12 HB1 ALA 12 1.201 -8.570 3.956 71 HB2 ALA 12 HB2 ALA 12 1.379 -9.561 5.404 72 HB3 ALA 12 HB3 ALA 12 0.165 -9.977 4.194 73 HA PRO 13 HA PRO 13 6.119 -9.031 3.142 74 HB2 PRO 13 HB2 PRO 13 5.203 -6.284 2.520 75 HB3 PRO 13 HB1 PRO 13 6.393 -7.287 1.683 76 HG2 PRO 13 HG2 PRO 13 4.018 -6.839 0.595 77 HG3 PRO 13 HG1 PRO 13 4.767 -8.447 0.489 78 HD2 PRO 13 HD2 PRO 13 2.636 -7.466 2.355 79 HD3 PRO 13 HD1 PRO 13 2.696 -8.986 1.429 80 HA PRO 14 HA PRO 14 6.146 -7.507 7.395 81 HB2 PRO 14 HB2 PRO 14 8.993 -7.094 6.602 82 HB3 PRO 14 HB1 PRO 14 8.331 -7.859 8.051 83 HG2 PRO 14 HG2 PRO 14 9.355 -9.337 6.089 84 HG3 PRO 14 HG1 PRO 14 7.900 -9.859 6.960 85 HD2 PRO 14 HD2 PRO 14 8.156 -8.695 4.226 86 HD3 PRO 14 HD1 PRO 14 7.024 -9.920 4.832 87 H ASP 15 H ASP 15 6.362 -5.497 8.355 88 HA ASP 15 HA ASP 15 5.146 -3.483 7.123 89 HB2 ASP 15 HB2 ASP 15 7.234 -3.233 9.278 90 HB3 ASP 15 HB1 ASP 15 6.200 -1.901 8.773 91 HA PRO 16 HA PRO 16 8.106 -2.071 4.038 92 HB2 PRO 16 HB2 PRO 16 5.715 -0.578 3.156 93 HB3 PRO 16 HB1 PRO 16 6.719 -1.723 2.232 94 HG2 PRO 16 HG2 PRO 16 4.268 -2.397 3.020 95 HG3 PRO 16 HG1 PRO 16 5.591 -3.571 3.092 96 HD2 PRO 16 HD2 PRO 16 4.436 -1.905 5.309 97 HD3 PRO 16 HD1 PRO 16 4.773 -3.656 5.295 98 H THR 17 H THR 17 9.024 -0.081 3.597 99 HA THR 17 HA THR 17 8.393 2.011 5.592 100 HB THR 17 HB THR 17 11.070 1.479 4.280 101 HG1 THR 17 HG1 THR 17 10.045 0.714 6.834 102 HG21 THR 17 HG21 THR 17 10.305 3.200 6.645 103 HG22 THR 17 HG22 THR 17 10.759 3.788 5.045 104 HG23 THR 17 HG23 THR 17 11.943 2.942 6.043 105 H VAL 18 H VAL 18 7.930 3.911 4.986 106 HA VAL 18 HA VAL 18 7.671 4.595 2.202 107 HB VAL 18 HB VAL 18 7.232 6.234 4.702 108 HG11 VAL 18 HG11 VAL 18 7.845 7.731 2.887 109 HG12 VAL 18 HG12 VAL 18 6.126 7.883 3.240 110 HG13 VAL 18 HG13 VAL 18 6.659 6.975 1.817 111 HG21 VAL 18 HG21 VAL 18 4.893 5.926 4.268 112 HG22 VAL 18 HG22 VAL 18 5.667 4.339 4.288 113 HG23 VAL 18 HG23 VAL 18 5.239 5.096 2.754 114 H ASP 19 H ASP 19 9.129 5.444 0.966 115 HA ASP 19 HA ASP 19 11.769 6.006 1.943 116 HB2 ASP 19 HB2 ASP 19 11.403 4.821 -0.176 117 HB3 ASP 19 HB1 ASP 19 10.585 6.232 -0.834 118 H GLN 20 H GLN 20 9.271 7.891 0.266 119 HA GLN 20 HA GLN 20 10.351 10.331 1.457 120 HB2 GLN 20 HB2 GLN 20 10.038 9.808 -1.487 121 HB3 GLN 20 HB1 GLN 20 9.970 11.442 -0.840 122 HG2 GLN 20 HG2 GLN 20 12.196 11.297 -0.020 123 HG3 GLN 20 HG1 GLN 20 12.272 9.572 -0.373 124 HE21 GLN 20 HE21 GLN 20 12.595 8.890 -2.449 125 HE22 GLN 20 HE22 GLN 20 13.087 9.940 -3.709 126 H VAL 21 H VAL 21 8.893 11.901 1.832 127 HA VAL 21 HA VAL 21 6.080 11.223 1.277 128 HB VAL 21 HB VAL 21 7.182 12.536 3.765 129 HG11 VAL 21 HG11 VAL 21 4.960 13.357 3.169 130 HG12 VAL 21 HG12 VAL 21 4.915 12.384 4.639 131 HG13 VAL 21 HG13 VAL 21 4.362 11.700 3.111 132 HG21 VAL 21 HG21 VAL 21 6.019 9.781 3.382 133 HG22 VAL 21 HG22 VAL 21 6.495 10.494 4.924 134 HG23 VAL 21 HG23 VAL 21 7.712 10.163 3.691 135 H ASP 22 H ASP 22 5.063 12.694 0.097 136 HA ASP 22 HA ASP 22 5.885 15.513 0.322 137 HB2 ASP 22 HB2 ASP 22 5.136 13.943 -2.150 138 HB3 ASP 22 HB1 ASP 22 5.088 15.700 -2.106 139 H ASP 23 H ASP 23 3.925 16.666 -1.177 140 HA ASP 23 HA ASP 23 1.641 16.582 0.506 141 HB2 ASP 23 HB2 ASP 23 0.688 18.102 -1.330 142 HB3 ASP 23 HB1 ASP 23 2.114 18.662 -0.478 143 H THR 24 H THR 24 1.899 15.949 -2.968 144 HA THR 24 HA THR 24 -0.538 14.301 -2.800 145 HB THR 24 HB THR 24 -0.789 14.892 -5.223 146 HG1 THR 24 HG1 THR 24 1.245 16.832 -4.699 147 HG21 THR 24 HG21 THR 24 -1.516 17.195 -4.818 148 HG22 THR 24 HG22 THR 24 -0.559 17.245 -3.332 149 HG23 THR 24 HG23 THR 24 -1.948 16.159 -3.453 150 H SER 25 H SER 25 1.988 13.207 -2.194 151 HA SER 25 HA SER 25 2.297 11.048 -3.975 152 HB2 SER 25 HB2 SER 25 4.448 13.183 -4.114 153 HB3 SER 25 HB1 SER 25 4.630 11.543 -4.736 154 HG SER 25 HG SER 25 2.360 12.761 -5.640 155 H ILE 26 H ILE 26 3.106 9.406 -2.818 156 HA ILE 26 HA ILE 26 5.189 9.872 -0.816 157 HB ILE 26 HB ILE 26 2.475 8.740 -0.102 158 HG12 ILE 26 HG12 ILE 26 4.218 10.806 1.248 159 HG13 ILE 26 HG11 ILE 26 2.804 11.148 0.261 160 HG21 ILE 26 HG21 ILE 26 3.425 8.011 2.044 161 HG22 ILE 26 HG22 ILE 26 5.039 8.397 1.442 162 HG23 ILE 26 HG23 ILE 26 4.092 7.121 0.675 163 HD11 ILE 26 HD11 ILE 26 2.191 11.331 2.555 164 HD12 ILE 26 HD12 ILE 26 2.871 9.740 2.915 165 HD13 ILE 26 HD13 ILE 26 1.434 9.877 1.899 166 H VAL 27 H VAL 27 6.511 7.967 -0.550 167 HA VAL 27 HA VAL 27 5.753 5.859 -2.481 168 HB VAL 27 HB VAL 27 8.556 6.705 -1.758 169 HG11 VAL 27 HG11 VAL 27 7.879 4.288 -2.539 170 HG12 VAL 27 HG12 VAL 27 9.322 5.075 -3.191 171 HG13 VAL 27 HG13 VAL 27 7.831 5.049 -4.134 172 HG21 VAL 27 HG21 VAL 27 7.456 8.459 -3.037 173 HG22 VAL 27 HG22 VAL 27 6.968 7.284 -4.258 174 HG23 VAL 27 HG23 VAL 27 8.677 7.651 -4.018 175 H VAL 28 H VAL 28 5.806 3.768 -1.748 176 HA VAL 28 HA VAL 28 7.031 3.368 0.889 177 HB VAL 28 HB VAL 28 5.207 2.475 1.818 178 HG11 VAL 28 HG11 VAL 28 3.745 3.782 -0.428 179 HG12 VAL 28 HG12 VAL 28 4.419 4.607 0.978 180 HG13 VAL 28 HG13 VAL 28 3.135 3.422 1.187 181 HG21 VAL 28 HG21 VAL 28 3.573 1.040 0.720 182 HG22 VAL 28 HG22 VAL 28 5.240 0.493 0.475 183 HG23 VAL 28 HG23 VAL 28 4.387 1.340 -0.817 184 H ARG 29 H ARG 29 7.942 1.323 1.262 185 HA ARG 29 HA ARG 29 8.293 -0.355 -1.144 186 HB2 ARG 29 HB2 ARG 29 10.552 0.327 0.741 187 HB3 ARG 29 HB1 ARG 29 10.654 -0.447 -0.833 188 HG2 ARG 29 HG2 ARG 29 9.994 1.643 -1.911 189 HG3 ARG 29 HG1 ARG 29 9.876 2.420 -0.333 190 HD2 ARG 29 HD2 ARG 29 11.975 3.030 -1.256 191 HD3 ARG 29 HD1 ARG 29 12.293 1.856 0.018 192 HE ARG 29 HE ARG 29 12.059 0.630 -2.554 193 HH11 ARG 29 HH11 ARG 29 14.236 2.341 -0.420 194 HH12 ARG 29 HH12 ARG 29 15.669 1.744 -1.191 195 HH21 ARG 29 HH21 ARG 29 13.935 -0.164 -3.580 196 HH22 ARG 29 HH22 ARG 29 15.501 0.303 -2.989 197 H TRP 30 H TRP 30 7.902 -2.382 -0.776 198 HA TRP 30 HA TRP 30 7.798 -3.331 2.021 199 HB2 TRP 30 HB2 TRP 30 5.967 -4.880 1.262 200 HB3 TRP 30 HB1 TRP 30 5.547 -3.174 1.144 201 HD1 TRP 30 HD1 TRP 30 6.430 -6.150 -1.043 202 HE1 TRP 30 HE1 TRP 30 5.580 -5.718 -3.426 203 HE3 TRP 30 HE3 TRP 30 4.832 -1.381 -0.415 204 HZ2 TRP 30 HZ2 TRP 30 4.323 -3.628 -4.828 205 HZ3 TRP 30 HZ3 TRP 30 3.781 -0.242 -2.320 206 HH2 TRP 30 HH2 TRP 30 3.529 -1.330 -4.464 207 H SER 31 H SER 31 8.295 -5.539 2.431 208 HA SER 31 HA SER 31 10.200 -6.654 0.509 209 HB2 SER 31 HB2 SER 31 9.737 -7.407 3.404 210 HB3 SER 31 HB1 SER 31 11.061 -7.952 2.378 211 HG SER 31 HG SER 31 10.744 -5.208 2.576 212 H ARG 32 H ARG 32 9.131 -7.869 -0.910 213 HA ARG 32 HA ARG 32 6.688 -9.069 -0.680 214 HB2 ARG 32 HB2 ARG 32 8.891 -10.199 -2.385 215 HB3 ARG 32 HB1 ARG 32 7.168 -10.212 -2.702 216 HG2 ARG 32 HG2 ARG 32 7.844 -8.549 -4.116 217 HG3 ARG 32 HG1 ARG 32 7.440 -7.623 -2.669 218 HD2 ARG 32 HD2 ARG 32 9.531 -6.932 -2.370 219 HD3 ARG 32 HD1 ARG 32 10.194 -8.548 -2.673 220 HE ARG 32 HE ARG 32 9.302 -7.286 -5.077 221 HH11 ARG 32 HH11 ARG 32 11.959 -7.425 -2.798 222 HH12 ARG 32 HH12 ARG 32 13.141 -6.894 -3.952 223 HH21 ARG 32 HH21 ARG 32 10.856 -6.609 -6.599 224 HH22 ARG 32 HH22 ARG 32 12.514 -6.425 -6.114 225 HA PRO 33 HA PRO 33 7.111 -12.787 1.608 226 HB2 PRO 33 HB2 PRO 33 5.037 -14.112 0.105 227 HB3 PRO 33 HB1 PRO 33 4.889 -13.259 1.647 228 HG2 PRO 33 HG2 PRO 33 3.748 -12.413 -0.703 229 HG3 PRO 33 HG1 PRO 33 4.183 -11.330 0.640 230 HD2 PRO 33 HD2 PRO 33 5.693 -11.937 -1.870 231 HD3 PRO 33 HD1 PRO 33 5.414 -10.371 -1.089 232 H GLN 34 H GLN 34 7.552 -15.031 1.584 233 HA GLN 34 HA GLN 34 9.089 -16.044 -0.601 234 HB2 GLN 34 HB2 GLN 34 9.556 -16.635 1.719 235 HB3 GLN 34 HB1 GLN 34 7.982 -17.398 1.864 236 HG2 GLN 34 HG2 GLN 34 8.686 -19.016 0.108 237 HG3 GLN 34 HG1 GLN 34 10.295 -18.296 0.162 238 HE21 GLN 34 HE21 GLN 34 8.257 -18.691 2.972 239 HE22 GLN 34 HE22 GLN 34 9.219 -19.902 3.741 240 H ALA 35 H ALA 35 5.814 -16.003 0.296 241 HA ALA 35 HA ALA 35 4.784 -18.291 -0.948 242 HB1 ALA 35 HB1 ALA 35 3.342 -15.659 -0.788 243 HB2 ALA 35 HB2 ALA 35 3.631 -16.663 0.641 244 HB3 ALA 35 HB3 ALA 35 2.675 -17.294 -0.701 245 HA PRO 36 HA PRO 36 4.781 -16.974 -5.255 246 HB2 PRO 36 HB2 PRO 36 2.681 -18.916 -5.744 247 HB3 PRO 36 HB1 PRO 36 4.355 -18.943 -6.299 248 HG2 PRO 36 HG2 PRO 36 3.342 -20.691 -4.461 249 HG3 PRO 36 HG1 PRO 36 5.050 -20.228 -4.542 250 HD2 PRO 36 HD2 PRO 36 2.910 -19.273 -2.687 251 HD3 PRO 36 HD1 PRO 36 4.628 -19.596 -2.364 252 H ILE 37 H ILE 37 3.779 -15.110 -5.603 253 HA ILE 37 HA ILE 37 0.886 -14.903 -5.080 254 HB ILE 37 HB ILE 37 1.266 -12.491 -4.650 255 HG12 ILE 37 HG12 ILE 37 4.028 -13.267 -5.396 256 HG13 ILE 37 HG11 ILE 37 3.147 -11.787 -5.724 257 HG21 ILE 37 HG21 ILE 37 2.016 -12.661 -2.412 258 HG22 ILE 37 HG22 ILE 37 3.096 -14.020 -2.790 259 HG23 ILE 37 HG23 ILE 37 1.346 -14.262 -2.791 260 HD11 ILE 37 HD11 ILE 37 4.913 -11.213 -4.292 261 HD12 ILE 37 HD12 ILE 37 4.577 -12.574 -3.223 262 HD13 ILE 37 HD13 ILE 37 3.456 -11.217 -3.294 263 H THR 38 H THR 38 -0.291 -13.516 -6.588 264 HA THR 38 HA THR 38 0.885 -13.674 -9.255 265 HB THR 38 HB THR 38 -1.479 -13.135 -10.000 266 HG1 THR 38 HG1 THR 38 -2.924 -12.824 -8.498 267 HG21 THR 38 HG21 THR 38 -2.213 -15.415 -9.710 268 HG22 THR 38 HG22 THR 38 -1.006 -15.661 -8.450 269 HG23 THR 38 HG23 THR 38 -0.502 -15.352 -10.110 270 H GLY 39 H GLY 39 -0.128 -11.258 -6.947 271 HA2 GLY 39 HA2 GLY 39 1.132 -9.228 -8.475 272 HA3 GLY 39 HA1 GLY 39 -0.615 -9.102 -8.596 273 H TYR 40 H TYR 40 -0.062 -6.966 -7.585 274 HA TYR 40 HA TYR 40 -0.536 -7.276 -4.704 275 HB2 TYR 40 HB2 TYR 40 1.559 -5.573 -6.003 276 HB3 TYR 40 HB1 TYR 40 0.741 -4.980 -4.561 277 HD1 TYR 40 HD2 TYR 40 2.064 -8.333 -5.551 278 HD2 TYR 40 HD1 TYR 40 2.084 -5.177 -2.704 279 HE1 TYR 40 HE2 TYR 40 3.641 -9.589 -4.171 280 HE2 TYR 40 HE1 TYR 40 3.632 -6.454 -1.305 281 HH TYR 40 HH TYR 40 5.264 -9.217 -2.449 282 H ARG 41 H ARG 41 -2.282 -6.203 -4.058 283 HA ARG 41 HA ARG 41 -3.203 -3.890 -5.635 284 HB2 ARG 41 HB2 ARG 41 -4.564 -4.870 -3.163 285 HB3 ARG 41 HB1 ARG 41 -5.237 -4.054 -4.573 286 HG2 ARG 41 HG2 ARG 41 -4.109 -6.833 -4.663 287 HG3 ARG 41 HG1 ARG 41 -5.811 -6.503 -4.299 288 HD2 ARG 41 HD2 ARG 41 -4.333 -5.750 -6.820 289 HD3 ARG 41 HD1 ARG 41 -5.526 -7.039 -6.655 290 HE ARG 41 HE ARG 41 -6.556 -4.469 -5.883 291 HH11 ARG 41 HH11 ARG 41 -5.937 -6.590 -8.606 292 HH12 ARG 41 HH12 ARG 41 -7.134 -5.848 -9.618 293 HH21 ARG 41 HH21 ARG 41 -8.120 -3.472 -7.224 294 HH22 ARG 41 HH22 ARG 41 -8.378 -4.085 -8.832 295 H ILE 42 H ILE 42 -3.425 -1.844 -4.614 296 HA ILE 42 HA ILE 42 -2.231 -1.652 -1.925 297 HB ILE 42 HB ILE 42 -1.456 0.168 -4.185 298 HG12 ILE 42 HG12 ILE 42 0.225 -1.971 -2.918 299 HG13 ILE 42 HG11 ILE 42 -0.672 -2.210 -4.409 300 HG21 ILE 42 HG21 ILE 42 -1.371 1.120 -1.889 301 HG22 ILE 42 HG22 ILE 42 0.203 1.038 -2.675 302 HG23 ILE 42 HG23 ILE 42 -0.232 -0.153 -1.449 303 HD11 ILE 42 HD11 ILE 42 1.500 -0.205 -3.953 304 HD12 ILE 42 HD12 ILE 42 0.604 -0.423 -5.454 305 HD13 ILE 42 HD13 ILE 42 1.644 -1.713 -4.847 306 H VAL 43 H VAL 43 -3.837 -0.844 -0.710 307 HA VAL 43 HA VAL 43 -5.406 1.354 -1.896 308 HB VAL 43 HB VAL 43 -6.200 -0.516 0.342 309 HG11 VAL 43 HG11 VAL 43 -8.341 0.669 0.321 310 HG12 VAL 43 HG12 VAL 43 -7.646 1.864 -0.779 311 HG13 VAL 43 HG13 VAL 43 -6.998 1.678 0.850 312 HG21 VAL 43 HG21 VAL 43 -7.418 -0.087 -2.375 313 HG22 VAL 43 HG22 VAL 43 -7.933 -1.259 -1.162 314 HG23 VAL 43 HG23 VAL 43 -6.364 -1.435 -1.950 315 H TYR 44 H TYR 44 -4.620 3.207 -1.305 316 HA TYR 44 HA TYR 44 -3.914 3.578 1.500 317 HB2 TYR 44 HB2 TYR 44 -2.786 5.736 0.532 318 HB3 TYR 44 HB1 TYR 44 -1.958 4.189 0.453 319 HD1 TYR 44 HD2 TYR 44 -2.297 2.842 -1.753 320 HD2 TYR 44 HD1 TYR 44 -2.978 7.019 -1.393 321 HE1 TYR 44 HE2 TYR 44 -2.007 3.068 -4.168 322 HE2 TYR 44 HE1 TYR 44 -2.684 7.279 -3.817 323 HH TYR 44 HH TYR 44 -2.669 4.689 -5.962 324 H SER 45 H SER 45 -5.043 4.754 2.675 325 HA SER 45 HA SER 45 -7.031 6.567 1.507 326 HB2 SER 45 HB2 SER 45 -8.712 5.559 3.123 327 HB3 SER 45 HB1 SER 45 -8.261 4.543 1.755 328 HG SER 45 HG SER 45 -7.188 4.387 4.386 329 HA PRO 46 HA PRO 46 -5.790 9.198 4.924 330 HB2 PRO 46 HB2 PRO 46 -8.356 10.483 4.482 331 HB3 PRO 46 HB1 PRO 46 -6.738 11.155 4.360 332 HG2 PRO 46 HG2 PRO 46 -8.233 10.723 2.183 333 HG3 PRO 46 HG1 PRO 46 -6.474 10.482 2.172 334 HD2 PRO 46 HD2 PRO 46 -8.667 8.458 2.365 335 HD3 PRO 46 HD1 PRO 46 -7.154 8.404 1.435 336 H SER 47 H SER 47 -6.347 9.561 7.035 337 HA SER 47 HA SER 47 -7.879 7.491 8.227 338 HB2 SER 47 HB2 SER 47 -5.807 8.450 9.217 339 HB3 SER 47 HB1 SER 47 -6.686 9.944 9.538 340 HG SER 47 HG SER 47 -7.040 7.384 10.680 341 H VAL 48 H VAL 48 -8.500 10.922 7.612 342 HA VAL 48 HA VAL 48 -11.199 10.463 8.694 343 HB VAL 48 HB VAL 48 -11.382 12.930 9.037 344 HG11 VAL 48 HG11 VAL 48 -10.952 11.442 10.898 345 HG12 VAL 48 HG12 VAL 48 -10.050 12.943 11.109 346 HG13 VAL 48 HG13 VAL 48 -9.222 11.484 10.565 347 HG21 VAL 48 HG21 VAL 48 -8.391 12.917 8.673 348 HG22 VAL 48 HG22 VAL 48 -9.403 14.295 9.104 349 HG23 VAL 48 HG23 VAL 48 -9.537 13.568 7.504 350 H GLU 49 H GLU 49 -9.378 12.026 6.071 351 HA GLU 49 HA GLU 49 -11.336 11.472 4.142 352 HB2 GLU 49 HB2 GLU 49 -12.108 13.796 3.660 353 HB3 GLU 49 HB1 GLU 49 -12.728 13.126 5.159 354 HG2 GLU 49 HG2 GLU 49 -11.085 14.407 6.422 355 HG3 GLU 49 HG1 GLU 49 -10.444 15.072 4.919 356 H GLY 50 H GLY 50 -10.784 12.172 2.047 357 HA2 GLY 50 HA2 GLY 50 -9.020 13.850 1.015 358 HA3 GLY 50 HA1 GLY 50 -7.928 12.693 1.770 359 H SER 51 H SER 51 -7.143 12.210 -0.399 360 HA SER 51 HA SER 51 -9.061 10.883 -2.162 361 HB2 SER 51 HB2 SER 51 -7.545 12.586 -3.121 362 HB3 SER 51 HB1 SER 51 -6.150 11.611 -2.649 363 HG SER 51 HG SER 51 -6.849 11.350 -4.875 364 H SER 52 H SER 52 -9.295 8.732 -2.048 365 HA SER 52 HA SER 52 -7.046 7.127 -1.041 366 HB2 SER 52 HB2 SER 52 -9.923 6.249 -1.434 367 HB3 SER 52 HB1 SER 52 -8.656 5.376 -0.570 368 HG SER 52 HG SER 52 -10.198 7.551 0.224 369 H THR 53 H THR 53 -6.239 5.408 -2.234 370 HA THR 53 HA THR 53 -7.375 4.953 -4.888 371 HB THR 53 HB THR 53 -4.508 5.857 -4.544 372 HG1 THR 53 HG1 THR 53 -6.789 7.252 -4.846 373 HG21 THR 53 HG21 THR 53 -4.761 4.241 -6.354 374 HG22 THR 53 HG22 THR 53 -4.444 5.853 -6.995 375 HG23 THR 53 HG23 THR 53 -6.080 5.195 -7.035 376 H GLU 54 H GLU 54 -6.829 2.984 -5.800 377 HA GLU 54 HA GLU 54 -5.067 1.226 -4.264 378 HB2 GLU 54 HB2 GLU 54 -7.386 0.416 -4.293 379 HB3 GLU 54 HB1 GLU 54 -7.398 0.485 -6.049 380 HG2 GLU 54 HG2 GLU 54 -5.571 -1.194 -6.079 381 HG3 GLU 54 HG1 GLU 54 -5.715 -1.324 -4.327 382 H LEU 55 H LEU 55 -3.152 0.970 -5.253 383 HA LEU 55 HA LEU 55 -3.099 1.063 -8.182 384 HB2 LEU 55 HB2 LEU 55 -0.781 1.176 -6.212 385 HB3 LEU 55 HB1 LEU 55 -0.609 1.101 -7.964 386 HG LEU 55 HG LEU 55 -1.747 3.310 -6.305 387 HD11 LEU 55 HD11 LEU 55 0.495 3.115 -8.285 388 HD12 LEU 55 HD12 LEU 55 0.582 3.505 -6.564 389 HD13 LEU 55 HD13 LEU 55 -0.145 4.647 -7.691 390 HD21 LEU 55 HD21 LEU 55 -2.025 2.939 -9.281 391 HD22 LEU 55 HD22 LEU 55 -2.336 4.449 -8.427 392 HD23 LEU 55 HD23 LEU 55 -3.328 3.032 -8.095 393 H ASN 56 H ASN 56 -1.671 -0.550 -9.269 394 HA ASN 56 HA ASN 56 -1.911 -3.166 -7.945 395 HB2 ASN 56 HB2 ASN 56 -3.760 -2.862 -9.570 396 HB3 ASN 56 HB1 ASN 56 -2.576 -2.571 -10.839 397 HD21 ASN 56 HD21 ASN 56 -4.028 -4.931 -8.762 398 HD22 ASN 56 HD22 ASN 56 -3.423 -6.329 -9.579 399 H LEU 57 H LEU 57 0.077 -3.929 -7.716 400 HA LEU 57 HA LEU 57 2.079 -3.159 -9.727 401 HB2 LEU 57 HB2 LEU 57 2.394 -3.751 -6.769 402 HB3 LEU 57 HB1 LEU 57 3.744 -3.676 -7.878 403 HG LEU 57 HG LEU 57 2.119 -1.505 -6.715 404 HD11 LEU 57 HD11 LEU 57 4.264 -0.390 -6.686 405 HD12 LEU 57 HD12 LEU 57 4.976 -1.703 -7.626 406 HD13 LEU 57 HD13 LEU 57 4.392 -2.003 -5.992 407 HD21 LEU 57 HD21 LEU 57 2.670 0.044 -8.502 408 HD22 LEU 57 HD22 LEU 57 1.593 -1.234 -9.067 409 HD23 LEU 57 HD23 LEU 57 3.310 -1.288 -9.465 410 HA PRO 58 HA PRO 58 2.651 -7.406 -10.676 411 HB2 PRO 58 HB2 PRO 58 5.418 -7.502 -10.825 412 HB3 PRO 58 HB1 PRO 58 4.344 -7.019 -12.138 413 HG2 PRO 58 HG2 PRO 58 5.982 -5.352 -10.321 414 HG3 PRO 58 HG1 PRO 58 5.496 -5.052 -11.996 415 HD2 PRO 58 HD2 PRO 58 4.367 -3.820 -9.825 416 HD3 PRO 58 HD1 PRO 58 3.533 -4.052 -11.369 417 H GLU 59 H GLU 59 3.090 -9.270 -9.714 418 HA GLU 59 HA GLU 59 3.090 -9.699 -7.050 419 HB2 GLU 59 HB2 GLU 59 3.991 -11.970 -7.578 420 HB3 GLU 59 HB1 GLU 59 2.669 -11.460 -8.623 421 HG2 GLU 59 HG2 GLU 59 4.298 -10.838 -10.352 422 HG3 GLU 59 HG1 GLU 59 5.603 -11.387 -9.305 423 H THR 60 H THR 60 5.864 -8.852 -8.908 424 HA THR 60 HA THR 60 7.660 -9.646 -6.732 425 HB THR 60 HB THR 60 8.094 -10.712 -8.897 426 HG1 THR 60 HG1 THR 60 10.067 -8.815 -8.097 427 HG21 THR 60 HG21 THR 60 8.920 -9.356 -10.788 428 HG22 THR 60 HG22 THR 60 8.507 -7.895 -9.891 429 HG23 THR 60 HG23 THR 60 7.238 -9.016 -10.386 430 H ALA 61 H ALA 61 6.032 -7.014 -7.489 431 HA ALA 61 HA ALA 61 8.091 -5.008 -7.633 432 HB1 ALA 61 HB1 ALA 61 5.880 -4.559 -8.538 433 HB2 ALA 61 HB2 ALA 61 6.251 -3.416 -7.249 434 HB3 ALA 61 HB3 ALA 61 5.165 -4.770 -6.943 435 H ASN 62 H ASN 62 8.368 -3.340 -5.913 436 HA ASN 62 HA ASN 62 7.780 -4.322 -3.229 437 HB2 ASN 62 HB2 ASN 62 10.068 -4.118 -2.466 438 HB3 ASN 62 HB1 ASN 62 9.981 -5.267 -3.795 439 HD21 ASN 62 HD21 ASN 62 12.215 -3.666 -2.743 440 HD22 ASN 62 HD22 ASN 62 12.830 -2.789 -4.103 441 H SER 63 H SER 63 7.211 -1.859 -5.063 442 HA SER 63 HA SER 63 7.133 -0.042 -2.877 443 HB2 SER 63 HB2 SER 63 8.625 1.706 -3.985 444 HB3 SER 63 HB1 SER 63 9.454 0.328 -3.262 445 HG SER 63 HG SER 63 8.790 -0.136 -5.856 446 H VAL 64 H VAL 64 5.557 1.412 -3.193 447 HA VAL 64 HA VAL 64 4.615 1.865 -5.954 448 HB VAL 64 HB VAL 64 2.832 0.720 -4.792 449 HG11 VAL 64 HG11 VAL 64 2.223 1.020 -2.683 450 HG12 VAL 64 HG12 VAL 64 2.420 2.769 -2.754 451 HG13 VAL 64 HG13 VAL 64 3.824 1.727 -2.520 452 HG21 VAL 64 HG21 VAL 64 1.068 2.312 -4.903 453 HG22 VAL 64 HG22 VAL 64 2.182 2.479 -6.255 454 HG23 VAL 64 HG23 VAL 64 2.238 3.632 -4.920 455 H THR 65 H THR 65 4.487 3.933 -6.658 456 HA THR 65 HA THR 65 4.952 6.089 -4.757 457 HB THR 65 HB THR 65 4.894 5.909 -7.756 458 HG1 THR 65 HG1 THR 65 6.810 5.179 -6.827 459 HG21 THR 65 HG21 THR 65 5.587 8.292 -7.781 460 HG22 THR 65 HG22 THR 65 5.314 8.370 -6.040 461 HG23 THR 65 HG23 THR 65 3.961 8.078 -7.133 462 H LEU 66 H LEU 66 3.082 6.451 -3.730 463 HA LEU 66 HA LEU 66 0.504 6.421 -4.993 464 HB2 LEU 66 HB2 LEU 66 0.797 7.872 -2.472 465 HB3 LEU 66 HB1 LEU 66 -0.334 6.612 -2.912 466 HG LEU 66 HG LEU 66 2.521 5.975 -2.268 467 HD11 LEU 66 HD11 LEU 66 0.308 5.838 -0.288 468 HD12 LEU 66 HD12 LEU 66 1.303 7.280 -0.469 469 HD13 LEU 66 HD13 LEU 66 2.054 5.747 -0.041 470 HD21 LEU 66 HD21 LEU 66 -0.061 4.442 -2.296 471 HD22 LEU 66 HD22 LEU 66 1.469 3.799 -1.688 472 HD23 LEU 66 HD23 LEU 66 1.307 4.234 -3.391 473 H SER 67 H SER 67 -0.775 8.231 -5.471 474 HA SER 67 HA SER 67 0.572 10.819 -5.421 475 HB2 SER 67 HB2 SER 67 -0.001 11.188 -7.821 476 HB3 SER 67 HB1 SER 67 1.188 9.909 -7.585 477 HG SER 67 HG SER 67 -1.212 9.781 -8.771 478 H ASP 68 H ASP 68 -1.008 12.513 -6.371 479 HA ASP 68 HA ASP 68 -2.936 13.673 -6.153 480 HB2 ASP 68 HB2 ASP 68 -3.761 11.867 -7.671 481 HB3 ASP 68 HB1 ASP 68 -4.300 10.976 -6.255 482 H LEU 69 H LEU 69 -1.524 12.632 -3.777 483 HA LEU 69 HA LEU 69 -3.513 12.114 -1.791 484 HB2 LEU 69 HB2 LEU 69 -0.817 13.267 -1.137 485 HB3 LEU 69 HB1 LEU 69 -1.828 12.197 -0.186 486 HG LEU 69 HG LEU 69 -0.320 11.365 -2.652 487 HD11 LEU 69 HD11 LEU 69 1.108 10.190 -1.073 488 HD12 LEU 69 HD12 LEU 69 0.208 10.891 0.271 489 HD13 LEU 69 HD13 LEU 69 1.147 11.931 -0.799 490 HD21 LEU 69 HD21 LEU 69 -2.160 9.921 -2.460 491 HD22 LEU 69 HD22 LEU 69 -2.158 10.034 -0.700 492 HD23 LEU 69 HD23 LEU 69 -0.910 9.087 -1.523 493 H GLN 70 H GLN 70 -3.186 13.759 0.264 494 HA GLN 70 HA GLN 70 -3.569 16.482 -0.750 495 HB2 GLN 70 HB2 GLN 70 -5.775 15.381 -0.346 496 HB3 GLN 70 HB1 GLN 70 -5.314 15.137 1.331 497 HG2 GLN 70 HG2 GLN 70 -6.732 17.022 1.274 498 HG3 GLN 70 HG1 GLN 70 -5.097 17.630 1.528 499 HE21 GLN 70 HE21 GLN 70 -7.722 17.320 -0.739 500 HE22 GLN 70 HE22 GLN 70 -7.169 18.527 -1.849 501 HA PRO 71 HA PRO 71 -0.377 17.032 2.327 502 HB2 PRO 71 HB2 PRO 71 -0.485 19.777 2.368 503 HB3 PRO 71 HB1 PRO 71 0.418 18.810 1.202 504 HG2 PRO 71 HG2 PRO 71 -2.260 20.098 0.919 505 HG3 PRO 71 HG1 PRO 71 -0.943 19.978 -0.262 506 HD2 PRO 71 HD2 PRO 71 -3.105 18.386 -0.378 507 HD3 PRO 71 HD1 PRO 71 -1.491 17.804 -0.838 508 H GLY 72 H GLY 72 -0.378 17.138 4.499 509 HA2 GLY 72 HA2 GLY 72 -1.053 17.729 6.645 510 HA3 GLY 72 HA1 GLY 72 -2.296 18.758 5.942 511 H VAL 73 H VAL 73 -1.932 15.455 4.974 512 HA VAL 73 HA VAL 73 -4.326 14.715 6.513 513 HB VAL 73 HB VAL 73 -3.880 14.304 3.545 514 HG11 VAL 73 HG11 VAL 73 -6.322 13.380 4.933 515 HG12 VAL 73 HG12 VAL 73 -4.885 12.350 5.018 516 HG13 VAL 73 HG13 VAL 73 -5.580 12.774 3.449 517 HG21 VAL 73 HG21 VAL 73 -6.356 15.336 4.804 518 HG22 VAL 73 HG22 VAL 73 -5.685 15.679 3.206 519 HG23 VAL 73 HG23 VAL 73 -4.974 16.425 4.641 520 H GLN 74 H GLN 74 -4.317 12.708 7.351 521 HA GLN 74 HA GLN 74 -1.835 11.265 7.363 522 HB2 GLN 74 HB2 GLN 74 -3.685 11.764 9.216 523 HB3 GLN 74 HB1 GLN 74 -4.311 10.229 8.640 524 HG2 GLN 74 HG2 GLN 74 -1.509 10.650 9.642 525 HG3 GLN 74 HG1 GLN 74 -2.837 10.017 10.613 526 HE21 GLN 74 HE21 GLN 74 -0.556 9.368 8.103 527 HE22 GLN 74 HE22 GLN 74 -0.873 7.677 7.967 528 H TYR 75 H TYR 75 -1.367 9.719 5.910 529 HA TYR 75 HA TYR 75 -3.617 8.437 4.519 530 HB2 TYR 75 HB2 TYR 75 -0.937 9.353 3.593 531 HB3 TYR 75 HB1 TYR 75 -1.651 7.936 2.816 532 HD1 TYR 75 HD2 TYR 75 -3.682 8.114 1.518 533 HD2 TYR 75 HD1 TYR 75 -1.956 11.551 3.325 534 HE1 TYR 75 HE2 TYR 75 -5.115 9.551 0.141 535 HE2 TYR 75 HE1 TYR 75 -3.389 12.998 1.951 536 HH TYR 75 HH TYR 75 -4.634 12.835 -0.249 537 H ASN 76 H ASN 76 -4.008 6.463 5.125 538 HA ASN 76 HA ASN 76 -1.908 4.759 6.200 539 HB2 ASN 76 HB2 ASN 76 -4.847 4.170 5.750 540 HB3 ASN 76 HB1 ASN 76 -3.722 3.193 6.687 541 HD21 ASN 76 HD21 ASN 76 -3.170 3.830 8.747 542 HD22 ASN 76 HD22 ASN 76 -3.966 5.119 9.579 543 H ILE 77 H ILE 77 -0.638 3.762 4.738 544 HA ILE 77 HA ILE 77 -1.759 2.964 2.158 545 HB ILE 77 HB ILE 77 1.088 2.753 3.157 546 HG12 ILE 77 HG12 ILE 77 1.341 4.412 1.174 547 HG13 ILE 77 HG11 ILE 77 -0.332 4.791 1.495 548 HG21 ILE 77 HG21 ILE 77 1.399 2.549 0.559 549 HG22 ILE 77 HG22 ILE 77 -0.222 1.854 0.652 550 HG23 ILE 77 HG23 ILE 77 1.108 1.118 1.558 551 HD11 ILE 77 HD11 ILE 77 1.934 5.016 3.458 552 HD12 ILE 77 HD12 ILE 77 0.242 5.393 3.791 553 HD13 ILE 77 HD13 ILE 77 1.145 6.347 2.612 554 H THR 78 H THR 78 -2.605 1.082 1.916 555 HA THR 78 HA THR 78 -1.819 -1.084 3.712 556 HB THR 78 HB THR 78 -4.321 -0.769 2.073 557 HG1 THR 78 HG1 THR 78 -4.338 0.842 3.605 558 HG21 THR 78 HG21 THR 78 -5.216 -2.489 3.605 559 HG22 THR 78 HG22 THR 78 -3.633 -2.604 4.375 560 HG23 THR 78 HG23 THR 78 -3.831 -3.084 2.688 561 H ILE 79 H ILE 79 -0.489 -2.547 2.759 562 HA ILE 79 HA ILE 79 -0.560 -2.792 -0.187 563 HB ILE 79 HB ILE 79 1.429 -4.226 1.586 564 HG12 ILE 79 HG12 ILE 79 1.978 -1.955 2.035 565 HG13 ILE 79 HG11 ILE 79 3.088 -2.520 0.787 566 HG21 ILE 79 HG21 ILE 79 1.291 -3.590 -1.327 567 HG22 ILE 79 HG22 ILE 79 1.393 -5.173 -0.546 568 HG23 ILE 79 HG23 ILE 79 2.783 -4.076 -0.524 569 HD11 ILE 79 HD11 ILE 79 1.991 -0.186 0.633 570 HD12 ILE 79 HD12 ILE 79 0.620 -1.086 -0.021 571 HD13 ILE 79 HD13 ILE 79 2.201 -1.186 -0.812 572 H TYR 80 H TYR 80 -1.040 -4.696 -1.218 573 HA TYR 80 HA TYR 80 -1.974 -6.936 0.454 574 HB2 TYR 80 HB2 TYR 80 -3.256 -5.951 -2.104 575 HB3 TYR 80 HB1 TYR 80 -3.803 -7.296 -1.121 576 HD1 TYR 80 HD1 TYR 80 -3.663 -3.615 -1.405 577 HD2 TYR 80 HD2 TYR 80 -5.071 -6.932 0.889 578 HE1 TYR 80 HE1 TYR 80 -5.221 -2.145 -0.214 579 HE2 TYR 80 HE2 TYR 80 -6.625 -5.450 2.081 580 HH TYR 80 HH TYR 80 -7.332 -2.304 1.027 581 H ALA 81 H ALA 81 -0.488 -8.531 0.025 582 HA ALA 81 HA ALA 81 0.473 -8.993 -2.663 583 HB1 ALA 81 HB1 ALA 81 1.948 -9.706 -0.896 584 HB2 ALA 81 HB2 ALA 81 1.344 -11.176 -1.687 585 HB3 ALA 81 HB3 ALA 81 0.672 -10.650 -0.126 586 H VAL 82 H VAL 82 -0.686 -10.018 -4.186 587 HA VAL 82 HA VAL 82 -3.024 -11.566 -3.231 588 HB VAL 82 HB VAL 82 -3.762 -9.606 -4.487 589 HG11 VAL 82 HG11 VAL 82 -1.852 -9.234 -5.906 590 HG12 VAL 82 HG12 VAL 82 -3.329 -9.356 -6.861 591 HG13 VAL 82 HG13 VAL 82 -2.208 -10.716 -6.793 592 HG21 VAL 82 HG21 VAL 82 -5.218 -10.684 -6.069 593 HG22 VAL 82 HG22 VAL 82 -5.045 -11.713 -4.646 594 HG23 VAL 82 HG23 VAL 82 -4.157 -12.094 -6.125 595 H GLU 83 H GLU 83 -3.354 -13.596 -3.952 596 HA GLU 83 HA GLU 83 -1.238 -14.708 -5.664 597 HB2 GLU 83 HB2 GLU 83 -2.788 -16.432 -3.769 598 HB3 GLU 83 HB1 GLU 83 -1.177 -16.634 -4.428 599 HG2 GLU 83 HG2 GLU 83 -0.797 -16.217 -2.214 600 HG3 GLU 83 HG1 GLU 83 -0.498 -14.688 -3.020 601 H GLU 84 H GLU 84 -2.055 -16.906 -6.606 602 HA GLU 84 HA GLU 84 -3.717 -16.320 -8.681 603 HB2 GLU 84 HB2 GLU 84 -3.401 -19.063 -7.459 604 HB3 GLU 84 HB1 GLU 84 -3.891 -18.709 -9.109 605 HG2 GLU 84 HG2 GLU 84 -1.674 -17.623 -9.453 606 HG3 GLU 84 HG1 GLU 84 -1.207 -18.201 -7.856 607 H ASN 85 H ASN 85 -4.720 -17.825 -5.617 608 HA ASN 85 HA ASN 85 -7.508 -17.529 -6.529 609 HB2 ASN 85 HB2 ASN 85 -6.945 -19.866 -6.319 610 HB3 ASN 85 HB1 ASN 85 -6.294 -19.611 -4.707 611 HD21 ASN 85 HD21 ASN 85 -9.187 -19.855 -6.625 612 HD22 ASN 85 HD22 ASN 85 -10.281 -20.062 -5.301 613 H GLN 86 H GLN 86 -5.260 -16.415 -4.223 614 HA GLN 86 HA GLN 86 -7.443 -15.749 -2.363 615 HB2 GLN 86 HB2 GLN 86 -4.685 -16.699 -1.578 616 HB3 GLN 86 HB1 GLN 86 -5.956 -16.204 -0.472 617 HG2 GLN 86 HG2 GLN 86 -7.321 -18.086 -1.165 618 HG3 GLN 86 HG1 GLN 86 -6.089 -18.566 -2.332 619 HE21 GLN 86 HE21 GLN 86 -4.178 -19.492 -1.598 620 HE22 GLN 86 HE22 GLN 86 -4.000 -20.097 0.007 621 H GLU 87 H GLU 87 -6.637 -14.127 -0.690 622 HA GLU 87 HA GLU 87 -4.593 -12.308 -1.757 623 HB2 GLU 87 HB2 GLU 87 -7.249 -11.559 -0.513 624 HB3 GLU 87 HB1 GLU 87 -5.939 -10.417 -0.778 625 HG2 GLU 87 HG2 GLU 87 -6.062 -10.822 -3.176 626 HG3 GLU 87 HG1 GLU 87 -7.361 -11.984 -2.918 627 H SER 88 H SER 88 -3.009 -11.965 -0.354 628 HA SER 88 HA SER 88 -3.037 -13.250 2.185 629 HB2 SER 88 HB2 SER 88 -1.012 -11.338 1.010 630 HB3 SER 88 HB1 SER 88 -0.754 -12.375 2.412 631 HG SER 88 HG SER 88 -1.391 -13.293 -0.213 632 H THR 89 H THR 89 -2.087 -11.996 4.129 633 HA THR 89 HA THR 89 -4.003 -10.181 5.049 634 HB THR 89 HB THR 89 -1.921 -9.721 6.722 635 HG1 THR 89 HG1 THR 89 -0.348 -11.040 6.194 636 HG21 THR 89 HG21 THR 89 -4.123 -10.622 7.328 637 HG22 THR 89 HG22 THR 89 -2.821 -11.526 8.103 638 HG23 THR 89 HG23 THR 89 -3.647 -12.199 6.698 639 HA PRO 90 HA PRO 90 -2.469 -6.376 3.527 640 HB2 PRO 90 HB2 PRO 90 -3.748 -4.640 5.108 641 HB3 PRO 90 HB1 PRO 90 -4.617 -5.710 4.003 642 HG2 PRO 90 HG2 PRO 90 -4.301 -5.886 6.951 643 HG3 PRO 90 HG1 PRO 90 -5.664 -6.377 5.934 644 HD2 PRO 90 HD2 PRO 90 -3.652 -8.037 6.988 645 HD3 PRO 90 HD1 PRO 90 -4.857 -8.478 5.766 646 H VAL 91 H VAL 91 -0.778 -5.102 3.657 647 HA VAL 91 HA VAL 91 0.761 -4.577 6.056 648 HB VAL 91 HB VAL 91 0.823 -3.551 3.226 649 HG11 VAL 91 HG11 VAL 91 1.269 -1.681 4.743 650 HG12 VAL 91 HG12 VAL 91 2.698 -2.131 3.824 651 HG13 VAL 91 HG13 VAL 91 2.551 -2.617 5.509 652 HG21 VAL 91 HG21 VAL 91 2.905 -4.997 4.850 653 HG22 VAL 91 HG22 VAL 91 3.024 -4.525 3.152 654 HG23 VAL 91 HG23 VAL 91 1.845 -5.742 3.650 655 H VAL 92 H VAL 92 0.121 -2.947 7.481 656 HA VAL 92 HA VAL 92 -1.202 -0.643 6.213 657 HB VAL 92 HB VAL 92 -1.508 -1.304 9.134 658 HG11 VAL 92 HG11 VAL 92 -3.471 0.192 8.888 659 HG12 VAL 92 HG12 VAL 92 -2.987 0.487 7.215 660 HG13 VAL 92 HG13 VAL 92 -1.935 0.989 8.541 661 HG21 VAL 92 HG21 VAL 92 -2.430 -3.174 7.844 662 HG22 VAL 92 HG22 VAL 92 -3.393 -2.043 6.893 663 HG23 VAL 92 HG23 VAL 92 -3.708 -2.237 8.617 664 H ILE 93 H ILE 93 0.348 0.775 5.896 665 HA ILE 93 HA ILE 93 1.992 1.558 8.209 666 HB ILE 93 HB ILE 93 3.656 2.424 6.463 667 HG12 ILE 93 HG12 ILE 93 2.445 0.348 4.674 668 HG13 ILE 93 HG11 ILE 93 1.927 2.012 4.595 669 HG21 ILE 93 HG21 ILE 93 4.742 0.229 6.260 670 HG22 ILE 93 HG22 ILE 93 3.250 -0.545 6.795 671 HG23 ILE 93 HG23 ILE 93 4.131 0.524 7.888 672 HD11 ILE 93 HD11 ILE 93 3.576 1.702 2.939 673 HD12 ILE 93 HD12 ILE 93 4.669 0.936 4.096 674 HD13 ILE 93 HD13 ILE 93 4.303 2.659 4.243 675 H GLN 94 H GLN 94 1.327 3.465 8.941 676 HA GLN 94 HA GLN 94 -0.116 5.191 7.078 677 HB2 GLN 94 HB2 GLN 94 -1.098 6.251 9.027 678 HB3 GLN 94 HB1 GLN 94 -1.312 4.511 9.097 679 HG2 GLN 94 HG2 GLN 94 0.596 4.376 10.661 680 HG3 GLN 94 HG1 GLN 94 0.686 6.137 10.649 681 HE21 GLN 94 HE21 GLN 94 0.229 6.343 12.817 682 HE22 GLN 94 HE22 GLN 94 -1.333 6.014 13.478 683 H GLN 95 H GLN 95 0.707 6.957 6.331 684 HA GLN 95 HA GLN 95 2.745 8.413 7.859 685 HB2 GLN 95 HB2 GLN 95 3.104 7.061 5.372 686 HB3 GLN 95 HB1 GLN 95 3.177 8.785 5.056 687 HG2 GLN 95 HG2 GLN 95 4.854 7.257 7.033 688 HG3 GLN 95 HG1 GLN 95 5.383 7.869 5.470 689 HE21 GLN 95 HE21 GLN 95 3.873 10.386 5.812 690 HE22 GLN 95 HE22 GLN 95 4.787 11.317 6.948 691 H GLU 96 H GLU 96 2.170 10.508 8.127 692 HA GLU 96 HA GLU 96 -0.072 11.549 6.605 693 HB2 GLU 96 HB2 GLU 96 -0.026 11.982 8.994 694 HB3 GLU 96 HB1 GLU 96 1.536 12.774 8.854 695 HG2 GLU 96 HG2 GLU 96 0.513 14.525 7.485 696 HG3 GLU 96 HG1 GLU 96 -1.050 13.726 7.637 697 H THR 97 H THR 97 0.001 13.154 5.143 698 HA THR 97 HA THR 97 2.420 13.467 3.695 699 HB THR 97 HB THR 97 1.049 15.105 2.350 700 HG1 THR 97 HG1 THR 97 -1.356 14.476 3.197 701 HG21 THR 97 HG21 THR 97 -0.223 12.408 2.843 702 HG22 THR 97 HG22 THR 97 1.191 12.683 1.827 703 HG23 THR 97 HG23 THR 97 -0.366 13.385 1.382 704 H THR 98 H THR 98 4.013 14.774 4.177 705 HA THR 98 HA THR 98 3.851 16.825 6.127 706 HB THR 98 HB THR 98 6.038 16.422 4.079 707 HG1 THR 98 HG1 THR 98 5.201 14.846 6.199 708 HG21 THR 98 HG21 THR 98 6.201 18.468 5.442 709 HG22 THR 98 HG22 THR 98 7.483 17.328 5.839 710 HG23 THR 98 HG23 THR 98 6.092 17.500 6.909 711 H GLY 99 H GLY 99 3.705 16.731 2.638 712 HA2 GLY 99 HA2 GLY 99 2.305 18.355 1.534 713 HA3 GLY 99 HA1 GLY 99 2.854 19.547 2.689 714 H THR 100 H THR 100 3.351 20.880 0.862 715 HA THR 100 HA THR 100 5.717 20.075 -0.657 716 HB THR 100 HB THR 100 4.080 22.601 -0.937 717 HG1 THR 100 HG1 THR 100 3.797 20.023 -2.089 718 HG21 THR 100 HG21 THR 100 5.084 22.692 -3.161 719 HG22 THR 100 HG22 THR 100 6.065 21.281 -2.765 720 HG23 THR 100 HG23 THR 100 6.281 22.789 -1.877 721 HA PRO 101 HA PRO 101 8.239 22.257 2.342 722 HB2 PRO 101 HB2 PRO 101 10.281 22.162 0.211 723 HB3 PRO 101 HB1 PRO 101 10.343 21.529 1.858 724 HG2 PRO 101 HG2 PRO 101 10.107 19.907 -0.265 725 HG3 PRO 101 HG1 PRO 101 9.316 19.548 1.279 726 HD2 PRO 101 HD2 PRO 101 8.147 20.642 -1.244 727 HD3 PRO 101 HD1 PRO 101 7.460 19.482 -0.088 728 H ARG 102 H ARG 102 7.775 23.184 -0.979 729 HA ARG 102 HA ARG 102 7.304 25.177 -1.929 730 HB2 ARG 102 HB2 ARG 102 7.375 26.188 0.912 731 HB3 ARG 102 HB1 ARG 102 6.898 27.160 -0.471 732 HG2 ARG 102 HG2 ARG 102 5.044 25.661 -0.918 733 HG3 ARG 102 HG1 ARG 102 5.535 24.634 0.432 734 HD2 ARG 102 HD2 ARG 102 3.690 26.115 1.046 735 HD3 ARG 102 HD1 ARG 102 5.137 26.456 1.985 736 HE ARG 102 HE ARG 102 5.498 28.391 0.527 737 HH11 ARG 102 HH11 ARG 102 2.308 26.941 0.538 738 HH12 ARG 102 HH12 ARG 102 1.504 28.408 0.080 739 HH21 ARG 102 HH21 ARG 102 4.437 30.321 -0.080 740 HH22 ARG 102 HH22 ARG 102 2.708 30.329 -0.264 741 H SER 103 H SER 103 8.281 27.784 -1.212 742 HA SER 103 HA SER 103 10.008 29.120 -1.802 743 HB2 SER 103 HB2 SER 103 11.653 26.915 -0.535 744 HB3 SER 103 HB1 SER 103 12.257 28.522 -0.940 745 HG SER 103 HG SER 103 10.435 29.275 0.453 746 H ASP 104 H ASP 104 8.983 27.323 -3.727 747 HA ASP 104 HA ASP 104 11.356 26.751 -5.377 748 HB2 ASP 104 HB2 ASP 104 9.912 25.120 -6.579 749 HB3 ASP 104 HB1 ASP 104 10.126 24.717 -4.880 750 H GLY 105 H GLY 105 9.401 29.150 -4.973 751 HA2 GLY 105 HA2 GLY 105 9.334 30.770 -6.887 752 HA3 GLY 105 HA1 GLY 105 8.612 29.452 -7.804 753 H THR 106 H THR 106 6.861 28.376 -6.089 754 HA THR 106 HA THR 106 4.683 28.525 -5.498 755 HB THR 106 HB THR 106 4.206 30.273 -3.700 756 HG1 THR 106 HG1 THR 106 6.272 31.452 -4.597 757 HG21 THR 106 HG21 THR 106 6.523 28.375 -3.329 758 HG22 THR 106 HG22 THR 106 4.813 27.972 -3.178 759 HG23 THR 106 HG23 THR 106 5.562 29.084 -2.032 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 -5.558 -40.938 9.554 2 H2 GLY 1 HT2 GLY 1 -4.602 -42.171 10.199 3 H3 GLY 1 HT3 GLY 1 -5.692 -42.509 8.953 4 HA2 GLY 1 HA1 GLY 1 -3.440 -42.416 8.110 5 HA3 GLY 1 HA2 GLY 1 -4.447 -41.150 7.423 6 H SER 2 H SER 2 -2.137 -40.363 7.031 7 HA SER 2 HA SER 2 -0.838 -39.163 9.314 8 HB2 SER 2 HB2 SER 2 0.689 -38.234 7.510 9 HB3 SER 2 HB1 SER 2 0.607 -39.992 7.603 10 HG SER 2 HG SER 2 0.426 -39.304 5.456 11 H HIS 3 H HIS 3 -2.937 -38.175 6.680 12 HA HIS 3 HA HIS 3 -4.128 -36.269 6.303 13 HB2 HIS 3 HB2 HIS 3 -4.777 -36.838 8.712 14 HB3 HIS 3 HB1 HIS 3 -3.631 -35.602 9.209 15 HD1 HIS 3 HD1 HIS 3 -4.370 -33.178 9.027 16 HD2 HIS 3 HD2 HIS 3 -7.108 -35.859 7.421 17 HE1 HIS 3 HE1 HIS 3 -6.477 -31.857 8.661 18 HE2 HIS 3 HE2 HIS 3 -8.172 -33.551 7.889 19 H MET 4 H MET 4 -1.893 -35.888 5.191 20 HA MET 4 HA MET 4 -0.632 -33.464 6.284 21 HB2 MET 4 HB2 MET 4 0.394 -35.432 4.232 22 HB3 MET 4 HB1 MET 4 1.235 -33.971 4.722 23 HG2 MET 4 HG2 MET 4 1.394 -34.841 7.007 24 HG3 MET 4 HG1 MET 4 0.578 -36.317 6.489 25 HE1 MET 4 HE1 MET 4 3.344 -36.361 7.994 26 HE2 MET 4 HE2 MET 4 4.289 -37.498 7.036 27 HE3 MET 4 HE3 MET 4 2.600 -37.843 7.400 28 H GLY 5 H GLY 5 -3.115 -33.196 5.047 29 HA2 GLY 5 HA2 GLY 5 -2.794 -32.440 2.301 30 HA3 GLY 5 HA1 GLY 5 -4.193 -32.114 3.315 31 H THR 6 H THR 6 -1.553 -30.759 1.758 32 HA THR 6 HA THR 6 -1.078 -28.638 3.639 33 HB THR 6 HB THR 6 0.751 -29.449 2.213 34 HG1 THR 6 HG1 THR 6 1.478 -27.499 2.500 35 HG21 THR 6 HG21 THR 6 -0.494 -29.955 0.178 36 HG22 THR 6 HG22 THR 6 0.836 -28.852 -0.166 37 HG23 THR 6 HG23 THR 6 -0.814 -28.237 -0.068 38 H THR 7 H THR 7 -2.073 -26.757 3.761 39 HA THR 7 HA THR 7 -4.004 -26.047 1.672 40 HB THR 7 HB THR 7 -4.850 -24.445 3.481 41 HG1 THR 7 HG1 THR 7 -4.200 -25.515 5.647 42 HG21 THR 7 HG21 THR 7 -6.004 -26.533 2.909 43 HG22 THR 7 HG22 THR 7 -6.100 -26.207 4.639 44 HG23 THR 7 HG23 THR 7 -4.968 -27.415 4.031 45 H THR 8 H THR 8 -3.581 -24.347 0.380 46 HA THR 8 HA THR 8 -1.079 -23.068 0.481 47 HB THR 8 HB THR 8 -3.460 -21.989 -1.018 48 HG1 THR 8 HG1 THR 8 -2.114 -23.522 -2.631 49 HG21 THR 8 HG21 THR 8 -1.418 -20.630 -0.995 50 HG22 THR 8 HG22 THR 8 -1.732 -21.281 -2.605 51 HG23 THR 8 HG23 THR 8 -0.493 -22.009 -1.584 52 H ALA 9 H ALA 9 -0.429 -21.526 1.765 53 HA ALA 9 HA ALA 9 -2.268 -19.405 2.572 54 HB1 ALA 9 HB1 ALA 9 -1.585 -19.583 4.915 55 HB2 ALA 9 HB2 ALA 9 -0.626 -21.011 4.532 56 HB3 ALA 9 HB3 ALA 9 -2.381 -21.056 4.368 57 HA PRO 10 HA PRO 10 1.678 -17.464 1.613 58 HB2 PRO 10 HB2 PRO 10 0.684 -15.208 0.599 59 HB3 PRO 10 HB1 PRO 10 0.603 -16.728 -0.302 60 HG2 PRO 10 HG2 PRO 10 -1.537 -15.283 1.187 61 HG3 PRO 10 HG1 PRO 10 -1.654 -16.255 -0.289 62 HD2 PRO 10 HD2 PRO 10 -2.266 -17.108 2.311 63 HD3 PRO 10 HD1 PRO 10 -2.094 -18.123 0.912 64 H ASP 11 H ASP 11 2.651 -15.364 2.217 65 HA ASP 11 HA ASP 11 1.454 -14.285 4.683 66 HB2 ASP 11 HB2 ASP 11 4.366 -14.632 3.948 67 HB3 ASP 11 HB1 ASP 11 3.816 -13.681 5.321 68 H ALA 12 H ALA 12 1.948 -12.021 5.092 69 HA ALA 12 HA ALA 12 1.934 -10.470 2.607 70 HB1 ALA 12 HB1 ALA 12 1.402 -9.633 5.464 71 HB2 ALA 12 HB2 ALA 12 0.175 -10.037 4.264 72 HB3 ALA 12 HB3 ALA 12 1.201 -8.623 4.035 73 HA PRO 13 HA PRO 13 6.064 -8.909 3.243 74 HB2 PRO 13 HB2 PRO 13 5.025 -6.191 2.707 75 HB3 PRO 13 HB1 PRO 13 6.267 -7.106 1.846 76 HG2 PRO 13 HG2 PRO 13 3.868 -6.713 0.760 77 HG3 PRO 13 HG1 PRO 13 4.710 -8.264 0.569 78 HD2 PRO 13 HD2 PRO 13 2.493 -7.529 2.442 79 HD3 PRO 13 HD1 PRO 13 2.690 -8.999 1.461 80 HA PRO 14 HA PRO 14 5.972 -7.504 7.566 81 HB2 PRO 14 HB2 PRO 14 8.771 -6.949 6.666 82 HB3 PRO 14 HB1 PRO 14 8.205 -7.683 8.170 83 HG2 PRO 14 HG2 PRO 14 9.217 -9.184 6.214 84 HG3 PRO 14 HG1 PRO 14 7.846 -9.747 7.186 85 HD2 PRO 14 HD2 PRO 14 7.905 -8.775 4.383 86 HD3 PRO 14 HD1 PRO 14 6.804 -9.928 5.156 87 H ASP 15 H ASP 15 6.048 -5.489 8.519 88 HA ASP 15 HA ASP 15 4.781 -3.534 7.217 89 HB2 ASP 15 HB2 ASP 15 5.391 -1.980 8.983 90 HB3 ASP 15 HB1 ASP 15 5.052 -3.572 9.644 91 HA PRO 16 HA PRO 16 7.822 -2.096 4.251 92 HB2 PRO 16 HB2 PRO 16 5.446 -0.557 3.369 93 HB3 PRO 16 HB1 PRO 16 6.482 -1.651 2.420 94 HG2 PRO 16 HG2 PRO 16 4.042 -2.402 3.125 95 HG3 PRO 16 HG1 PRO 16 5.386 -3.551 3.224 96 HD2 PRO 16 HD2 PRO 16 4.116 -1.954 5.427 97 HD3 PRO 16 HD1 PRO 16 4.508 -3.694 5.398 98 H THR 17 H THR 17 8.825 -0.162 3.857 99 HA THR 17 HA THR 17 8.207 1.958 5.818 100 HB THR 17 HB THR 17 10.869 1.412 4.486 101 HG1 THR 17 HG1 THR 17 9.721 0.485 6.907 102 HG21 THR 17 HG21 THR 17 11.757 2.895 6.212 103 HG22 THR 17 HG22 THR 17 10.136 3.124 6.867 104 HG23 THR 17 HG23 THR 17 10.530 3.726 5.256 105 H VAL 18 H VAL 18 7.587 3.783 5.164 106 HA VAL 18 HA VAL 18 7.497 4.511 2.382 107 HB VAL 18 HB VAL 18 6.902 6.149 4.852 108 HG11 VAL 18 HG11 VAL 18 6.432 6.808 1.929 109 HG12 VAL 18 HG12 VAL 18 7.528 7.635 3.042 110 HG13 VAL 18 HG13 VAL 18 5.788 7.724 3.299 111 HG21 VAL 18 HG21 VAL 18 5.031 4.867 2.870 112 HG22 VAL 18 HG22 VAL 18 4.582 5.780 4.308 113 HG23 VAL 18 HG23 VAL 18 5.400 4.226 4.470 114 H ASP 19 H ASP 19 9.044 5.362 1.264 115 HA ASP 19 HA ASP 19 11.535 6.072 2.577 116 HB2 ASP 19 HB2 ASP 19 11.639 4.514 0.726 117 HB3 ASP 19 HB1 ASP 19 10.805 5.650 -0.328 118 H GLN 20 H GLN 20 9.100 7.550 0.497 119 HA GLN 20 HA GLN 20 10.236 10.188 1.108 120 HB2 GLN 20 HB2 GLN 20 9.383 9.258 -1.642 121 HB3 GLN 20 HB1 GLN 20 9.836 10.902 -1.225 122 HG2 GLN 20 HG2 GLN 20 11.687 8.552 -0.941 123 HG3 GLN 20 HG1 GLN 20 11.589 9.549 -2.389 124 HE21 GLN 20 HE21 GLN 20 13.682 10.264 -2.222 125 HE22 GLN 20 HE22 GLN 20 14.200 11.368 -1.030 126 H VAL 21 H VAL 21 8.759 11.753 1.462 127 HA VAL 21 HA VAL 21 5.950 11.129 0.873 128 HB VAL 21 HB VAL 21 5.239 12.167 2.991 129 HG11 VAL 21 HG11 VAL 21 7.134 9.846 3.326 130 HG12 VAL 21 HG12 VAL 21 5.427 9.755 2.896 131 HG13 VAL 21 HG13 VAL 21 5.904 10.337 4.490 132 HG21 VAL 21 HG21 VAL 21 6.878 12.525 4.791 133 HG22 VAL 21 HG22 VAL 21 7.135 13.606 3.422 134 HG23 VAL 21 HG23 VAL 21 8.181 12.205 3.644 135 H ASP 22 H ASP 22 4.814 12.711 -0.026 136 HA ASP 22 HA ASP 22 5.817 15.465 0.106 137 HB2 ASP 22 HB2 ASP 22 5.157 13.869 -2.354 138 HB3 ASP 22 HB1 ASP 22 4.971 15.615 -2.358 139 H ASP 23 H ASP 23 3.868 16.585 -1.533 140 HA ASP 23 HA ASP 23 1.628 16.727 0.191 141 HB2 ASP 23 HB2 ASP 23 0.657 18.088 -1.735 142 HB3 ASP 23 HB1 ASP 23 2.164 18.675 -1.050 143 H THR 24 H THR 24 1.694 15.775 -3.224 144 HA THR 24 HA THR 24 -0.702 14.144 -2.737 145 HB THR 24 HB THR 24 -1.205 14.552 -5.136 146 HG1 THR 24 HG1 THR 24 0.800 16.559 -5.110 147 HG21 THR 24 HG21 THR 24 -2.109 16.017 -3.345 148 HG22 THR 24 HG22 THR 24 -1.875 16.877 -4.870 149 HG23 THR 24 HG23 THR 24 -0.717 17.088 -3.553 150 H SER 25 H SER 25 1.734 13.025 -2.162 151 HA SER 25 HA SER 25 2.089 10.843 -3.906 152 HB2 SER 25 HB2 SER 25 4.212 13.003 -4.054 153 HB3 SER 25 HB1 SER 25 4.418 11.363 -4.662 154 HG SER 25 HG SER 25 2.142 12.592 -5.578 155 H ILE 26 H ILE 26 2.950 9.223 -2.748 156 HA ILE 26 HA ILE 26 4.988 9.736 -0.709 157 HB ILE 26 HB ILE 26 2.253 8.666 -0.035 158 HG12 ILE 26 HG12 ILE 26 4.110 10.591 1.374 159 HG13 ILE 26 HG11 ILE 26 2.691 11.025 0.428 160 HG21 ILE 26 HG21 ILE 26 3.152 7.809 2.100 161 HG22 ILE 26 HG22 ILE 26 4.784 8.078 1.484 162 HG23 ILE 26 HG23 ILE 26 3.725 6.911 0.693 163 HD11 ILE 26 HD11 ILE 26 2.756 9.540 3.041 164 HD12 ILE 26 HD12 ILE 26 1.309 9.751 2.057 165 HD13 ILE 26 HD13 ILE 26 2.123 11.162 2.734 166 H VAL 27 H VAL 27 6.361 7.870 -0.433 167 HA VAL 27 HA VAL 27 5.642 5.725 -2.336 168 HB VAL 27 HB VAL 27 8.431 6.627 -1.649 169 HG11 VAL 27 HG11 VAL 27 9.202 5.010 -3.096 170 HG12 VAL 27 HG12 VAL 27 7.711 4.997 -4.038 171 HG13 VAL 27 HG13 VAL 27 7.757 4.206 -2.458 172 HG21 VAL 27 HG21 VAL 27 7.291 8.375 -2.890 173 HG22 VAL 27 HG22 VAL 27 6.794 7.206 -4.114 174 HG23 VAL 27 HG23 VAL 27 8.502 7.592 -3.904 175 H VAL 28 H VAL 28 5.708 3.663 -1.587 176 HA VAL 28 HA VAL 28 6.932 3.283 1.052 177 HB VAL 28 HB VAL 28 5.096 2.417 1.978 178 HG11 VAL 28 HG11 VAL 28 3.023 3.319 1.294 179 HG12 VAL 28 HG12 VAL 28 3.644 3.631 -0.325 180 HG13 VAL 28 HG13 VAL 28 4.291 4.512 1.058 181 HG21 VAL 28 HG21 VAL 28 3.503 0.922 0.915 182 HG22 VAL 28 HG22 VAL 28 5.180 0.399 0.679 183 HG23 VAL 28 HG23 VAL 28 4.310 1.200 -0.633 184 H ARG 29 H ARG 29 7.878 1.281 1.439 185 HA ARG 29 HA ARG 29 8.243 -0.462 -0.922 186 HB2 ARG 29 HB2 ARG 29 10.413 0.265 1.058 187 HB3 ARG 29 HB1 ARG 29 10.591 -0.714 -0.387 188 HG2 ARG 29 HG2 ARG 29 10.051 1.299 -1.744 189 HG3 ARG 29 HG1 ARG 29 10.053 2.243 -0.253 190 HD2 ARG 29 HD2 ARG 29 12.369 1.544 0.169 191 HD3 ARG 29 HD1 ARG 29 12.363 0.639 -1.341 192 HE ARG 29 HE ARG 29 11.777 3.471 -1.567 193 HH11 ARG 29 HH11 ARG 29 14.169 0.929 -1.745 194 HH12 ARG 29 HH12 ARG 29 15.307 1.881 -2.640 195 HH21 ARG 29 HH21 ARG 29 13.297 4.750 -2.725 196 HH22 ARG 29 HH22 ARG 29 14.820 4.057 -3.182 197 H TRP 30 H TRP 30 7.795 -2.486 -0.537 198 HA TRP 30 HA TRP 30 7.508 -3.338 2.272 199 HB2 TRP 30 HB2 TRP 30 5.723 -4.899 1.403 200 HB3 TRP 30 HB1 TRP 30 5.331 -3.189 1.289 201 HD1 TRP 30 HD1 TRP 30 6.388 -6.102 -0.909 202 HE1 TRP 30 HE1 TRP 30 5.638 -5.649 -3.324 203 HE3 TRP 30 HE3 TRP 30 4.569 -1.430 -0.246 204 HZ2 TRP 30 HZ2 TRP 30 4.356 -3.572 -4.733 205 HZ3 TRP 30 HZ3 TRP 30 3.558 -0.287 -2.165 206 HH2 TRP 30 HH2 TRP 30 3.446 -1.321 -4.342 207 H SER 31 H SER 31 8.103 -5.393 2.892 208 HA SER 31 HA SER 31 10.148 -6.632 1.255 209 HB2 SER 31 HB2 SER 31 9.199 -7.389 4.028 210 HB3 SER 31 HB1 SER 31 10.699 -7.893 3.251 211 HG SER 31 HG SER 31 11.525 -5.900 3.502 212 H ARG 32 H ARG 32 9.005 -7.576 -0.380 213 HA ARG 32 HA ARG 32 6.620 -8.882 -0.389 214 HB2 ARG 32 HB2 ARG 32 8.952 -9.702 -2.104 215 HB3 ARG 32 HB1 ARG 32 7.248 -9.806 -2.504 216 HG2 ARG 32 HG2 ARG 32 7.723 -7.917 -3.645 217 HG3 ARG 32 HG1 ARG 32 7.406 -7.189 -2.073 218 HD2 ARG 32 HD2 ARG 32 9.399 -6.190 -2.721 219 HD3 ARG 32 HD1 ARG 32 9.918 -7.491 -1.651 220 HE ARG 32 HE ARG 32 9.863 -8.462 -4.285 221 HH11 ARG 32 HH11 ARG 32 11.718 -6.261 -2.278 222 HH12 ARG 32 HH12 ARG 32 13.190 -6.505 -3.161 223 HH21 ARG 32 HH21 ARG 32 11.803 -8.797 -5.424 224 HH22 ARG 32 HH22 ARG 32 13.241 -7.954 -4.944 225 HA PRO 33 HA PRO 33 7.037 -12.774 1.551 226 HB2 PRO 33 HB2 PRO 33 4.962 -13.978 -0.018 227 HB3 PRO 33 HB1 PRO 33 4.799 -13.166 1.544 228 HG2 PRO 33 HG2 PRO 33 3.734 -12.240 -0.826 229 HG3 PRO 33 HG1 PRO 33 4.098 -11.219 0.583 230 HD2 PRO 33 HD2 PRO 33 5.719 -11.689 -1.887 231 HD3 PRO 33 HD1 PRO 33 5.407 -10.169 -1.035 232 H GLN 34 H GLN 34 7.214 -15.119 1.253 233 HA GLN 34 HA GLN 34 8.807 -15.768 -1.104 234 HB2 GLN 34 HB2 GLN 34 8.318 -17.447 1.358 235 HB3 GLN 34 HB1 GLN 34 9.542 -17.699 0.119 236 HG2 GLN 34 HG2 GLN 34 10.575 -15.552 0.750 237 HG3 GLN 34 HG1 GLN 34 9.407 -15.409 2.061 238 HE21 GLN 34 HE21 GLN 34 9.550 -16.826 3.821 239 HE22 GLN 34 HE22 GLN 34 11.011 -17.682 4.169 240 H ALA 35 H ALA 35 5.654 -15.940 -0.082 241 HA ALA 35 HA ALA 35 4.765 -18.363 -1.252 242 HB1 ALA 35 HB1 ALA 35 3.459 -16.896 0.326 243 HB2 ALA 35 HB2 ALA 35 2.564 -17.426 -1.097 244 HB3 ALA 35 HB3 ALA 35 3.209 -15.785 -1.026 245 HA PRO 36 HA PRO 36 4.939 -17.108 -5.567 246 HB2 PRO 36 HB2 PRO 36 2.803 -19.028 -6.110 247 HB3 PRO 36 HB1 PRO 36 4.480 -19.052 -6.659 248 HG2 PRO 36 HG2 PRO 36 3.506 -20.815 -4.847 249 HG3 PRO 36 HG1 PRO 36 5.194 -20.273 -4.853 250 HD2 PRO 36 HD2 PRO 36 2.928 -19.402 -3.104 251 HD3 PRO 36 HD1 PRO 36 4.631 -19.685 -2.690 252 H ILE 37 H ILE 37 4.012 -15.218 -5.997 253 HA ILE 37 HA ILE 37 1.132 -14.908 -5.486 254 HB ILE 37 HB ILE 37 1.605 -12.546 -4.909 255 HG12 ILE 37 HG12 ILE 37 4.444 -13.425 -5.357 256 HG13 ILE 37 HG11 ILE 37 3.598 -12.053 -6.048 257 HG21 ILE 37 HG21 ILE 37 1.380 -14.090 -3.078 258 HG22 ILE 37 HG22 ILE 37 2.698 -12.967 -2.691 259 HG23 ILE 37 HG23 ILE 37 3.059 -14.611 -3.240 260 HD11 ILE 37 HD11 ILE 37 5.012 -11.096 -4.492 261 HD12 ILE 37 HD12 ILE 37 4.730 -12.378 -3.316 262 HD13 ILE 37 HD13 ILE 37 3.469 -11.189 -3.634 263 H THR 38 H THR 38 0.009 -13.437 -6.895 264 HA THR 38 HA THR 38 1.193 -13.453 -9.564 265 HB THR 38 HB THR 38 -1.187 -12.949 -10.293 266 HG1 THR 38 HG1 THR 38 -2.505 -12.560 -8.690 267 HG21 THR 38 HG21 THR 38 -1.811 -15.247 -10.203 268 HG22 THR 38 HG22 THR 38 -0.714 -15.544 -8.856 269 HG23 THR 38 HG23 THR 38 -0.073 -15.139 -10.449 270 H GLY 39 H GLY 39 0.021 -11.176 -7.152 271 HA2 GLY 39 HA2 GLY 39 1.380 -9.085 -8.480 272 HA3 GLY 39 HA1 GLY 39 -0.346 -8.942 -8.756 273 H TYR 40 H TYR 40 0.021 -6.873 -7.633 274 HA TYR 40 HA TYR 40 -0.477 -7.254 -4.765 275 HB2 TYR 40 HB2 TYR 40 1.602 -5.514 -6.017 276 HB3 TYR 40 HB1 TYR 40 0.762 -4.926 -4.588 277 HD1 TYR 40 HD1 TYR 40 2.175 -8.235 -5.607 278 HD2 TYR 40 HD2 TYR 40 2.017 -5.151 -2.687 279 HE1 TYR 40 HE1 TYR 40 3.772 -9.465 -4.222 280 HE2 TYR 40 HE2 TYR 40 3.580 -6.403 -1.280 281 HH TYR 40 HH TYR 40 5.334 -9.079 -2.460 282 H ARG 41 H ARG 41 -2.187 -6.172 -4.072 283 HA ARG 41 HA ARG 41 -3.163 -3.896 -5.661 284 HB2 ARG 41 HB2 ARG 41 -4.677 -5.088 -3.401 285 HB3 ARG 41 HB1 ARG 41 -5.260 -4.376 -4.899 286 HG2 ARG 41 HG2 ARG 41 -4.378 -6.350 -6.119 287 HG3 ARG 41 HG1 ARG 41 -3.928 -7.053 -4.560 288 HD2 ARG 41 HD2 ARG 41 -6.636 -6.528 -5.694 289 HD3 ARG 41 HD1 ARG 41 -5.986 -8.034 -5.080 290 HE ARG 41 HE ARG 41 -6.331 -7.263 -2.881 291 HH11 ARG 41 HH11 ARG 41 -7.502 -5.013 -5.292 292 HH12 ARG 41 HH12 ARG 41 -8.525 -4.153 -4.187 293 HH21 ARG 41 HH21 ARG 41 -7.729 -6.192 -1.434 294 HH22 ARG 41 HH22 ARG 41 -8.680 -4.854 -1.988 295 H ILE 42 H ILE 42 -3.570 -1.934 -4.592 296 HA ILE 42 HA ILE 42 -2.444 -1.761 -1.869 297 HB ILE 42 HB ILE 42 -1.611 0.084 -4.084 298 HG12 ILE 42 HG12 ILE 42 0.017 -2.100 -2.815 299 HG13 ILE 42 HG11 ILE 42 -0.831 -2.287 -4.342 300 HG21 ILE 42 HG21 ILE 42 0.004 0.936 -2.529 301 HG22 ILE 42 HG22 ILE 42 -0.414 -0.299 -1.343 302 HG23 ILE 42 HG23 ILE 42 -1.573 0.968 -1.742 303 HD11 ILE 42 HD11 ILE 42 1.514 -1.802 -4.672 304 HD12 ILE 42 HD12 ILE 42 1.334 -0.302 -3.767 305 HD13 ILE 42 HD13 ILE 42 0.499 -0.505 -5.305 306 H VAL 43 H VAL 43 -4.001 -0.921 -0.626 307 HA VAL 43 HA VAL 43 -5.551 1.302 -1.807 308 HB VAL 43 HB VAL 43 -6.390 -0.585 0.398 309 HG11 VAL 43 HG11 VAL 43 -8.504 0.658 0.403 310 HG12 VAL 43 HG12 VAL 43 -7.772 1.864 -0.658 311 HG13 VAL 43 HG13 VAL 43 -7.138 1.613 0.967 312 HG21 VAL 43 HG21 VAL 43 -7.576 -0.055 -2.318 313 HG22 VAL 43 HG22 VAL 43 -8.166 -1.214 -1.127 314 HG23 VAL 43 HG23 VAL 43 -6.599 -1.461 -1.894 315 H TYR 44 H TYR 44 -4.764 3.148 -1.192 316 HA TYR 44 HA TYR 44 -4.031 3.490 1.614 317 HB2 TYR 44 HB2 TYR 44 -2.762 5.559 0.655 318 HB3 TYR 44 HB1 TYR 44 -2.036 3.962 0.535 319 HD1 TYR 44 HD1 TYR 44 -2.421 2.684 -1.665 320 HD2 TYR 44 HD2 TYR 44 -2.990 6.874 -1.260 321 HE1 TYR 44 HE1 TYR 44 -2.172 2.924 -4.085 322 HE2 TYR 44 HE2 TYR 44 -2.744 7.145 -3.688 323 HH TYR 44 HH TYR 44 -2.834 4.559 -5.847 324 H SER 45 H SER 45 -5.106 4.767 2.768 325 HA SER 45 HA SER 45 -6.986 6.646 1.513 326 HB2 SER 45 HB2 SER 45 -7.772 4.624 3.626 327 HB3 SER 45 HB1 SER 45 -8.835 5.774 2.811 328 HG SER 45 HG SER 45 -7.677 4.472 0.890 329 HA PRO 46 HA PRO 46 -5.743 9.390 4.783 330 HB2 PRO 46 HB2 PRO 46 -7.969 10.931 4.893 331 HB3 PRO 46 HB1 PRO 46 -6.804 11.035 3.567 332 HG2 PRO 46 HG2 PRO 46 -9.393 9.520 3.687 333 HG3 PRO 46 HG1 PRO 46 -8.794 10.598 2.409 334 HD2 PRO 46 HD2 PRO 46 -8.584 7.952 2.175 335 HD3 PRO 46 HD1 PRO 46 -7.275 9.021 1.626 336 H SER 47 H SER 47 -6.119 9.791 6.956 337 HA SER 47 HA SER 47 -7.669 7.819 8.333 338 HB2 SER 47 HB2 SER 47 -5.464 8.601 9.156 339 HB3 SER 47 HB1 SER 47 -6.157 10.196 9.443 340 HG SER 47 HG SER 47 -6.880 7.753 10.693 341 H VAL 48 H VAL 48 -7.971 11.298 7.718 342 HA VAL 48 HA VAL 48 -10.594 11.199 9.064 343 HB VAL 48 HB VAL 48 -8.757 13.569 8.706 344 HG11 VAL 48 HG11 VAL 48 -10.377 14.770 10.117 345 HG12 VAL 48 HG12 VAL 48 -11.449 13.372 10.044 346 HG13 VAL 48 HG13 VAL 48 -11.064 14.265 8.572 347 HG21 VAL 48 HG21 VAL 48 -9.541 12.024 11.173 348 HG22 VAL 48 HG22 VAL 48 -8.569 13.495 11.152 349 HG23 VAL 48 HG23 VAL 48 -7.957 12.024 10.398 350 H GLU 49 H GLU 49 -8.845 12.578 6.294 351 HA GLU 49 HA GLU 49 -11.089 12.405 4.568 352 HB2 GLU 49 HB2 GLU 49 -11.791 14.347 5.946 353 HB3 GLU 49 HB1 GLU 49 -10.325 15.190 5.471 354 HG2 GLU 49 HG2 GLU 49 -12.244 15.950 4.188 355 HG3 GLU 49 HG1 GLU 49 -11.048 15.174 3.151 356 H GLY 50 H GLY 50 -10.451 12.525 2.462 357 HA2 GLY 50 HA2 GLY 50 -8.535 13.950 1.214 358 HA3 GLY 50 HA1 GLY 50 -7.595 12.696 2.008 359 H SER 51 H SER 51 -7.046 12.246 -0.301 360 HA SER 51 HA SER 51 -9.175 10.954 -1.827 361 HB2 SER 51 HB2 SER 51 -6.331 11.629 -2.631 362 HB3 SER 51 HB1 SER 51 -7.614 11.064 -3.705 363 HG SER 51 HG SER 51 -8.785 12.982 -3.121 364 H SER 52 H SER 52 -9.430 8.807 -1.729 365 HA SER 52 HA SER 52 -7.186 7.134 -0.855 366 HB2 SER 52 HB2 SER 52 -10.042 6.258 -1.361 367 HB3 SER 52 HB1 SER 52 -8.807 5.413 -0.424 368 HG SER 52 HG SER 52 -10.256 7.753 0.227 369 H THR 53 H THR 53 -6.336 5.512 -2.119 370 HA THR 53 HA THR 53 -7.465 5.103 -4.775 371 HB THR 53 HB THR 53 -4.635 6.096 -4.377 372 HG1 THR 53 HG1 THR 53 -6.964 7.377 -4.750 373 HG21 THR 53 HG21 THR 53 -4.448 6.045 -6.801 374 HG22 THR 53 HG22 THR 53 -6.080 5.393 -6.932 375 HG23 THR 53 HG23 THR 53 -4.804 4.431 -6.184 376 H GLU 54 H GLU 54 -6.778 3.203 -5.788 377 HA GLU 54 HA GLU 54 -5.158 1.370 -4.193 378 HB2 GLU 54 HB2 GLU 54 -7.562 0.733 -4.317 379 HB3 GLU 54 HB1 GLU 54 -7.432 0.686 -6.069 380 HG2 GLU 54 HG2 GLU 54 -5.689 -1.077 -5.818 381 HG3 GLU 54 HG1 GLU 54 -6.046 -1.103 -4.092 382 H LEU 55 H LEU 55 -3.282 0.850 -5.168 383 HA LEU 55 HA LEU 55 -3.166 1.088 -8.093 384 HB2 LEU 55 HB2 LEU 55 -0.877 1.135 -6.085 385 HB3 LEU 55 HB1 LEU 55 -0.672 1.056 -7.835 386 HG LEU 55 HG LEU 55 -1.777 3.295 -6.195 387 HD11 LEU 55 HD11 LEU 55 -0.131 4.574 -7.626 388 HD12 LEU 55 HD12 LEU 55 0.503 3.000 -8.111 389 HD13 LEU 55 HD13 LEU 55 0.536 3.484 -6.415 390 HD21 LEU 55 HD21 LEU 55 -2.307 4.451 -8.325 391 HD22 LEU 55 HD22 LEU 55 -3.348 3.068 -7.995 392 HD23 LEU 55 HD23 LEU 55 -2.041 2.927 -9.171 393 H ASN 56 H ASN 56 -2.003 -0.529 -9.286 394 HA ASN 56 HA ASN 56 -2.018 -3.152 -7.950 395 HB2 ASN 56 HB2 ASN 56 -3.876 -2.961 -9.569 396 HB3 ASN 56 HB1 ASN 56 -2.724 -2.554 -10.835 397 HD21 ASN 56 HD21 ASN 56 -3.986 -5.068 -8.809 398 HD22 ASN 56 HD22 ASN 56 -3.287 -6.394 -9.670 399 H LEU 57 H LEU 57 -0.037 -3.933 -7.788 400 HA LEU 57 HA LEU 57 1.987 -2.977 -9.700 401 HB2 LEU 57 HB2 LEU 57 2.254 -3.695 -6.764 402 HB3 LEU 57 HB1 LEU 57 3.625 -3.513 -7.834 403 HG LEU 57 HG LEU 57 1.935 -1.491 -6.545 404 HD11 LEU 57 HD11 LEU 57 4.258 -1.932 -5.938 405 HD12 LEU 57 HD12 LEU 57 4.027 -0.282 -6.510 406 HD13 LEU 57 HD13 LEU 57 4.762 -1.488 -7.566 407 HD21 LEU 57 HD21 LEU 57 1.316 -1.103 -8.865 408 HD22 LEU 57 HD22 LEU 57 3.022 -1.029 -9.307 409 HD23 LEU 57 HD23 LEU 57 2.333 0.194 -8.240 410 HA PRO 58 HA PRO 58 2.721 -7.153 -10.862 411 HB2 PRO 58 HB2 PRO 58 5.491 -7.158 -10.942 412 HB3 PRO 58 HB1 PRO 58 4.438 -6.624 -12.252 413 HG2 PRO 58 HG2 PRO 58 5.962 -5.023 -10.275 414 HG3 PRO 58 HG1 PRO 58 5.539 -4.639 -11.950 415 HD2 PRO 58 HD2 PRO 58 4.285 -3.556 -9.780 416 HD3 PRO 58 HD1 PRO 58 3.506 -3.755 -11.357 417 H GLU 59 H GLU 59 3.183 -9.068 -9.993 418 HA GLU 59 HA GLU 59 3.233 -9.689 -7.370 419 HB2 GLU 59 HB2 GLU 59 4.254 -11.866 -8.053 420 HB3 GLU 59 HB1 GLU 59 2.898 -11.364 -9.054 421 HG2 GLU 59 HG2 GLU 59 4.460 -10.545 -10.752 422 HG3 GLU 59 HG1 GLU 59 5.812 -11.066 -9.753 423 H THR 60 H THR 60 5.963 -8.646 -9.211 424 HA THR 60 HA THR 60 7.796 -9.385 -7.049 425 HB THR 60 HB THR 60 8.385 -10.367 -9.188 426 HG1 THR 60 HG1 THR 60 10.083 -8.249 -8.332 427 HG21 THR 60 HG21 THR 60 7.316 -8.781 -10.684 428 HG22 THR 60 HG22 THR 60 9.018 -8.963 -11.107 429 HG23 THR 60 HG23 THR 60 8.479 -7.536 -10.226 430 H ALA 61 H ALA 61 5.990 -6.938 -7.371 431 HA ALA 61 HA ALA 61 7.878 -4.754 -7.620 432 HB1 ALA 61 HB1 ALA 61 5.957 -3.320 -7.093 433 HB2 ALA 61 HB2 ALA 61 4.982 -4.757 -6.783 434 HB3 ALA 61 HB3 ALA 61 5.597 -4.442 -8.404 435 H ASN 62 H ASN 62 8.351 -3.276 -5.895 436 HA ASN 62 HA ASN 62 8.002 -4.447 -3.220 437 HB2 ASN 62 HB2 ASN 62 10.289 -4.011 -2.646 438 HB3 ASN 62 HB1 ASN 62 10.269 -4.980 -4.118 439 HD21 ASN 62 HD21 ASN 62 12.308 -3.162 -3.023 440 HD22 ASN 62 HD22 ASN 62 12.631 -2.018 -4.279 441 H SER 63 H SER 63 7.205 -1.870 -4.995 442 HA SER 63 HA SER 63 7.055 -0.131 -2.729 443 HB2 SER 63 HB2 SER 63 8.513 1.668 -3.744 444 HB3 SER 63 HB1 SER 63 9.386 0.246 -3.174 445 HG SER 63 HG SER 63 8.897 -0.377 -5.593 446 H VAL 64 H VAL 64 5.435 1.296 -3.002 447 HA VAL 64 HA VAL 64 4.490 1.772 -5.760 448 HB VAL 64 HB VAL 64 2.714 0.626 -4.589 449 HG11 VAL 64 HG11 VAL 64 2.307 2.718 -2.582 450 HG12 VAL 64 HG12 VAL 64 3.670 1.634 -2.319 451 HG13 VAL 64 HG13 VAL 64 2.048 0.976 -2.496 452 HG21 VAL 64 HG21 VAL 64 0.948 2.245 -4.718 453 HG22 VAL 64 HG22 VAL 64 2.048 2.316 -6.091 454 HG23 VAL 64 HG23 VAL 64 2.147 3.535 -4.818 455 H THR 65 H THR 65 4.465 3.830 -6.473 456 HA THR 65 HA THR 65 4.867 5.986 -4.564 457 HB THR 65 HB THR 65 4.886 5.823 -7.567 458 HG1 THR 65 HG1 THR 65 6.795 5.073 -6.887 459 HG21 THR 65 HG21 THR 65 4.048 8.033 -6.902 460 HG22 THR 65 HG22 THR 65 5.680 8.167 -7.557 461 HG23 THR 65 HG23 THR 65 5.420 8.235 -5.815 462 H LEU 66 H LEU 66 2.962 6.311 -3.605 463 HA LEU 66 HA LEU 66 0.416 6.265 -4.895 464 HB2 LEU 66 HB2 LEU 66 0.735 7.777 -2.398 465 HB3 LEU 66 HB1 LEU 66 -0.458 6.573 -2.829 466 HG LEU 66 HG LEU 66 2.362 5.822 -2.140 467 HD11 LEU 66 HD11 LEU 66 0.096 5.711 -0.223 468 HD12 LEU 66 HD12 LEU 66 1.117 7.139 -0.360 469 HD13 LEU 66 HD13 LEU 66 1.832 5.589 0.067 470 HD21 LEU 66 HD21 LEU 66 1.161 4.119 -3.306 471 HD22 LEU 66 HD22 LEU 66 -0.259 4.373 -2.293 472 HD23 LEU 66 HD23 LEU 66 1.208 3.678 -1.597 473 H SER 67 H SER 67 -0.889 8.057 -5.401 474 HA SER 67 HA SER 67 0.444 10.643 -5.479 475 HB2 SER 67 HB2 SER 67 1.037 9.362 -7.584 476 HB3 SER 67 HB1 SER 67 -0.678 9.387 -7.992 477 HG SER 67 HG SER 67 1.189 11.465 -7.962 478 H ASP 68 H ASP 68 -1.080 12.308 -6.396 479 HA ASP 68 HA ASP 68 -2.992 13.484 -6.191 480 HB2 ASP 68 HB2 ASP 68 -4.189 10.755 -6.660 481 HB3 ASP 68 HB1 ASP 68 -5.172 12.206 -6.494 482 H LEU 69 H LEU 69 -1.669 12.270 -3.836 483 HA LEU 69 HA LEU 69 -3.682 11.893 -1.857 484 HB2 LEU 69 HB2 LEU 69 -0.979 13.020 -1.193 485 HB3 LEU 69 HB1 LEU 69 -2.018 11.985 -0.238 486 HG LEU 69 HG LEU 69 -0.472 11.081 -2.649 487 HD11 LEU 69 HD11 LEU 69 0.903 9.916 -1.007 488 HD12 LEU 69 HD12 LEU 69 -0.015 10.668 0.299 489 HD13 LEU 69 HD13 LEU 69 0.966 11.663 -0.776 490 HD21 LEU 69 HD21 LEU 69 -2.355 9.685 -2.459 491 HD22 LEU 69 HD22 LEU 69 -2.354 9.808 -0.700 492 HD23 LEU 69 HD23 LEU 69 -1.121 8.835 -1.513 493 H GLN 70 H GLN 70 -3.334 13.603 0.143 494 HA GLN 70 HA GLN 70 -3.666 16.285 -1.012 495 HB2 GLN 70 HB2 GLN 70 -5.077 15.197 1.429 496 HB3 GLN 70 HB1 GLN 70 -5.267 16.795 0.726 497 HG2 GLN 70 HG2 GLN 70 -5.924 14.302 -0.794 498 HG3 GLN 70 HG1 GLN 70 -7.082 15.099 0.269 499 HE21 GLN 70 HE21 GLN 70 -7.178 14.691 -2.618 500 HE22 GLN 70 HE22 GLN 70 -7.302 16.270 -3.319 501 HA PRO 71 HA PRO 71 -0.244 17.257 1.674 502 HB2 PRO 71 HB2 PRO 71 -0.600 19.969 1.714 503 HB3 PRO 71 HB1 PRO 71 0.213 19.078 0.425 504 HG2 PRO 71 HG2 PRO 71 -2.586 20.116 0.537 505 HG3 PRO 71 HG1 PRO 71 -1.450 20.107 -0.823 506 HD2 PRO 71 HD2 PRO 71 -3.459 18.316 -0.610 507 HD3 PRO 71 HD1 PRO 71 -1.896 17.905 -1.346 508 H GLY 72 H GLY 72 -0.229 17.044 3.817 509 HA2 GLY 72 HA2 GLY 72 -0.665 17.588 6.036 510 HA3 GLY 72 HA1 GLY 72 -1.892 18.724 5.493 511 H VAL 73 H VAL 73 -1.604 15.309 4.690 512 HA VAL 73 HA VAL 73 -3.996 14.736 6.288 513 HB VAL 73 HB VAL 73 -3.677 14.097 3.347 514 HG11 VAL 73 HG11 VAL 73 -6.035 13.132 3.749 515 HG12 VAL 73 HG12 VAL 73 -5.468 12.909 5.409 516 HG13 VAL 73 HG13 VAL 73 -4.618 12.127 4.072 517 HG21 VAL 73 HG21 VAL 73 -5.514 15.815 4.933 518 HG22 VAL 73 HG22 VAL 73 -6.058 15.065 3.433 519 HG23 VAL 73 HG23 VAL 73 -4.668 16.163 3.418 520 H GLN 74 H GLN 74 -4.034 12.778 7.216 521 HA GLN 74 HA GLN 74 -1.609 11.242 7.254 522 HB2 GLN 74 HB2 GLN 74 -3.409 11.884 9.106 523 HB3 GLN 74 HB1 GLN 74 -4.126 10.373 8.586 524 HG2 GLN 74 HG2 GLN 74 -1.297 10.665 9.553 525 HG3 GLN 74 HG1 GLN 74 -2.652 10.144 10.552 526 HE21 GLN 74 HE21 GLN 74 -0.449 9.294 8.039 527 HE22 GLN 74 HE22 GLN 74 -0.857 7.620 7.960 528 H TYR 75 H TYR 75 -1.231 9.577 5.889 529 HA TYR 75 HA TYR 75 -3.577 8.316 4.653 530 HB2 TYR 75 HB2 TYR 75 -0.905 9.038 3.533 531 HB3 TYR 75 HB1 TYR 75 -1.786 7.665 2.853 532 HD1 TYR 75 HD2 TYR 75 -4.059 8.012 1.910 533 HD2 TYR 75 HD1 TYR 75 -1.589 11.270 3.067 534 HE1 TYR 75 HE2 TYR 75 -5.470 9.537 0.602 535 HE2 TYR 75 HE1 TYR 75 -2.996 12.807 1.768 536 HH TYR 75 HH TYR 75 -4.607 12.530 -0.315 537 H ASN 76 H ASN 76 -4.003 6.424 5.371 538 HA ASN 76 HA ASN 76 -1.985 4.609 6.380 539 HB2 ASN 76 HB2 ASN 76 -4.903 4.024 5.827 540 HB3 ASN 76 HB1 ASN 76 -3.826 3.169 6.925 541 HD21 ASN 76 HD21 ASN 76 -3.443 4.001 8.955 542 HD22 ASN 76 HD22 ASN 76 -4.357 5.316 9.614 543 H ILE 77 H ILE 77 -0.745 3.633 4.867 544 HA ILE 77 HA ILE 77 -1.888 2.879 2.290 545 HB ILE 77 HB ILE 77 0.946 2.617 3.308 546 HG12 ILE 77 HG12 ILE 77 1.232 4.244 1.299 547 HG13 ILE 77 HG11 ILE 77 -0.435 4.648 1.612 548 HG21 ILE 77 HG21 ILE 77 0.950 0.955 1.736 549 HG22 ILE 77 HG22 ILE 77 1.287 2.369 0.720 550 HG23 ILE 77 HG23 ILE 77 -0.345 1.707 0.798 551 HD11 ILE 77 HD11 ILE 77 0.144 5.273 3.902 552 HD12 ILE 77 HD12 ILE 77 1.057 6.202 2.712 553 HD13 ILE 77 HD13 ILE 77 1.830 4.873 3.577 554 H THR 78 H THR 78 -2.732 0.988 1.983 555 HA THR 78 HA THR 78 -1.972 -1.199 3.771 556 HB THR 78 HB THR 78 -4.483 -0.803 2.161 557 HG1 THR 78 HG1 THR 78 -3.751 0.357 4.380 558 HG21 THR 78 HG21 THR 78 -3.795 -2.850 4.283 559 HG22 THR 78 HG22 THR 78 -3.960 -3.174 2.557 560 HG23 THR 78 HG23 THR 78 -5.365 -2.674 3.497 561 H ILE 79 H ILE 79 -0.646 -2.639 2.862 562 HA ILE 79 HA ILE 79 -0.649 -2.922 -0.081 563 HB ILE 79 HB ILE 79 1.332 -4.282 1.756 564 HG12 ILE 79 HG12 ILE 79 1.854 -2.006 2.156 565 HG13 ILE 79 HG11 ILE 79 2.975 -2.573 0.919 566 HG21 ILE 79 HG21 ILE 79 1.229 -3.741 -1.177 567 HG22 ILE 79 HG22 ILE 79 1.352 -5.296 -0.341 568 HG23 ILE 79 HG23 ILE 79 2.719 -4.170 -0.338 569 HD11 ILE 79 HD11 ILE 79 0.485 -1.180 0.101 570 HD12 ILE 79 HD12 ILE 79 2.057 -1.286 -0.709 571 HD13 ILE 79 HD13 ILE 79 1.854 -0.262 0.725 572 H TYR 80 H TYR 80 -1.449 -4.636 -1.042 573 HA TYR 80 HA TYR 80 -2.171 -7.004 0.562 574 HB2 TYR 80 HB2 TYR 80 -3.462 -6.021 -1.999 575 HB3 TYR 80 HB1 TYR 80 -3.989 -7.380 -1.019 576 HD1 TYR 80 HD1 TYR 80 -5.164 -7.002 1.090 577 HD2 TYR 80 HD2 TYR 80 -4.035 -3.736 -1.414 578 HE1 TYR 80 HE1 TYR 80 -6.761 -5.553 2.265 579 HE2 TYR 80 HE2 TYR 80 -5.625 -2.291 -0.235 580 HH TYR 80 HH TYR 80 -7.755 -2.586 1.093 581 H ALA 81 H ALA 81 -0.682 -8.578 0.074 582 HA ALA 81 HA ALA 81 0.348 -8.757 -2.652 583 HB1 ALA 81 HB1 ALA 81 0.959 -10.377 -0.152 584 HB2 ALA 81 HB2 ALA 81 1.988 -9.169 -0.925 585 HB3 ALA 81 HB3 ALA 81 1.672 -10.706 -1.740 586 H VAL 82 H VAL 82 -0.455 -10.064 -4.158 587 HA VAL 82 HA VAL 82 -2.598 -11.883 -3.224 588 HB VAL 82 HB VAL 82 -3.596 -9.966 -4.320 589 HG11 VAL 82 HG11 VAL 82 -2.008 -10.724 -6.745 590 HG12 VAL 82 HG12 VAL 82 -1.794 -9.273 -5.763 591 HG13 VAL 82 HG13 VAL 82 -3.280 -9.504 -6.684 592 HG21 VAL 82 HG21 VAL 82 -3.752 -12.412 -6.059 593 HG22 VAL 82 HG22 VAL 82 -4.948 -11.116 -5.980 594 HG23 VAL 82 HG23 VAL 82 -4.671 -12.147 -4.575 595 H GLU 83 H GLU 83 -2.583 -13.899 -3.854 596 HA GLU 83 HA GLU 83 -0.702 -14.761 -5.932 597 HB2 GLU 83 HB2 GLU 83 -2.302 -16.716 -4.345 598 HB3 GLU 83 HB1 GLU 83 -0.721 -16.877 -5.076 599 HG2 GLU 83 HG2 GLU 83 0.279 -15.604 -3.336 600 HG3 GLU 83 HG1 GLU 83 -1.297 -15.349 -2.573 601 H GLU 84 H GLU 84 -1.616 -16.743 -7.090 602 HA GLU 84 HA GLU 84 -3.207 -16.062 -9.087 603 HB2 GLU 84 HB2 GLU 84 -3.345 -18.811 -7.865 604 HB3 GLU 84 HB1 GLU 84 -3.534 -18.379 -9.562 605 HG2 GLU 84 HG2 GLU 84 -1.183 -17.588 -9.571 606 HG3 GLU 84 HG1 GLU 84 -1.019 -18.180 -7.921 607 H ASN 85 H ASN 85 -4.595 -17.389 -6.033 608 HA ASN 85 HA ASN 85 -7.172 -16.395 -7.036 609 HB2 ASN 85 HB2 ASN 85 -8.350 -18.387 -6.311 610 HB3 ASN 85 HB1 ASN 85 -7.093 -18.809 -7.467 611 HD21 ASN 85 HD21 ASN 85 -8.134 -19.000 -4.158 612 HD22 ASN 85 HD22 ASN 85 -6.994 -20.202 -3.663 613 H GLN 86 H GLN 86 -5.063 -16.053 -4.526 614 HA GLN 86 HA GLN 86 -7.237 -15.181 -2.801 615 HB2 GLN 86 HB2 GLN 86 -6.547 -16.381 -0.894 616 HB3 GLN 86 HB1 GLN 86 -6.598 -17.539 -2.217 617 HG2 GLN 86 HG2 GLN 86 -4.198 -17.447 -2.443 618 HG3 GLN 86 HG1 GLN 86 -4.108 -16.224 -1.175 619 HE21 GLN 86 HE21 GLN 86 -2.856 -18.819 -1.252 620 HE22 GLN 86 HE22 GLN 86 -3.457 -19.697 0.116 621 H GLU 87 H GLU 87 -6.193 -14.162 -0.713 622 HA GLU 87 HA GLU 87 -3.841 -12.589 -1.548 623 HB2 GLU 87 HB2 GLU 87 -6.370 -11.622 -0.212 624 HB3 GLU 87 HB1 GLU 87 -4.891 -10.675 -0.274 625 HG2 GLU 87 HG2 GLU 87 -4.987 -10.557 -2.656 626 HG3 GLU 87 HG1 GLU 87 -6.342 -11.686 -2.704 627 H SER 88 H SER 88 -2.516 -11.814 0.148 628 HA SER 88 HA SER 88 -2.491 -13.499 2.504 629 HB2 SER 88 HB2 SER 88 -0.638 -11.224 1.757 630 HB3 SER 88 HB1 SER 88 -0.341 -12.476 2.963 631 HG SER 88 HG SER 88 0.719 -13.018 1.066 632 H THR 89 H THR 89 -1.681 -12.093 4.568 633 HA THR 89 HA THR 89 -3.818 -10.500 5.451 634 HB THR 89 HB THR 89 -1.982 -9.736 7.173 635 HG1 THR 89 HG1 THR 89 -0.074 -10.536 6.780 636 HG21 THR 89 HG21 THR 89 -3.799 -11.266 7.704 637 HG22 THR 89 HG22 THR 89 -2.291 -11.834 8.420 638 HG23 THR 89 HG23 THR 89 -2.917 -12.599 6.960 639 HA PRO 90 HA PRO 90 -2.672 -6.585 3.779 640 HB2 PRO 90 HB2 PRO 90 -3.999 -4.896 5.379 641 HB3 PRO 90 HB1 PRO 90 -4.844 -6.048 4.338 642 HG2 PRO 90 HG2 PRO 90 -4.367 -6.145 7.274 643 HG3 PRO 90 HG1 PRO 90 -5.760 -6.714 6.343 644 HD2 PRO 90 HD2 PRO 90 -3.648 -8.278 7.311 645 HD3 PRO 90 HD1 PRO 90 -4.857 -8.772 6.112 646 H VAL 91 H VAL 91 -1.015 -5.252 3.828 647 HA VAL 91 HA VAL 91 0.545 -4.623 6.188 648 HB VAL 91 HB VAL 91 0.565 -3.687 3.332 649 HG11 VAL 91 HG11 VAL 91 0.994 -1.749 4.719 650 HG12 VAL 91 HG12 VAL 91 2.475 -2.256 3.917 651 HG13 VAL 91 HG13 VAL 91 2.224 -2.637 5.615 652 HG21 VAL 91 HG21 VAL 91 2.805 -4.606 3.296 653 HG22 VAL 91 HG22 VAL 91 1.632 -5.837 3.779 654 HG23 VAL 91 HG23 VAL 91 2.660 -5.070 4.993 655 H VAL 92 H VAL 92 -0.105 -2.971 7.568 656 HA VAL 92 HA VAL 92 -1.423 -0.693 6.250 657 HB VAL 92 HB VAL 92 -1.924 -1.394 9.137 658 HG11 VAL 92 HG11 VAL 92 -3.364 0.368 7.155 659 HG12 VAL 92 HG12 VAL 92 -2.333 0.916 8.480 660 HG13 VAL 92 HG13 VAL 92 -3.855 0.094 8.828 661 HG21 VAL 92 HG21 VAL 92 -3.595 -2.147 6.737 662 HG22 VAL 92 HG22 VAL 92 -4.092 -2.315 8.421 663 HG23 VAL 92 HG23 VAL 92 -2.737 -3.260 7.802 664 H ILE 93 H ILE 93 0.099 0.762 6.060 665 HA ILE 93 HA ILE 93 1.715 1.465 8.419 666 HB ILE 93 HB ILE 93 3.439 2.293 6.696 667 HG12 ILE 93 HG12 ILE 93 2.217 0.232 4.898 668 HG13 ILE 93 HG11 ILE 93 1.720 1.902 4.805 669 HG21 ILE 93 HG21 ILE 93 4.471 0.067 6.518 670 HG22 ILE 93 HG22 ILE 93 2.954 -0.662 7.045 671 HG23 ILE 93 HG23 ILE 93 3.851 0.392 8.137 672 HD11 ILE 93 HD11 ILE 93 4.484 0.834 4.405 673 HD12 ILE 93 HD12 ILE 93 4.065 2.548 4.443 674 HD13 ILE 93 HD13 ILE 93 3.406 1.499 3.170 675 H GLN 94 H GLN 94 1.191 3.439 9.126 676 HA GLN 94 HA GLN 94 -0.183 5.206 7.241 677 HB2 GLN 94 HB2 GLN 94 -1.138 6.329 9.150 678 HB3 GLN 94 HB1 GLN 94 -1.376 4.599 9.311 679 HG2 GLN 94 HG2 GLN 94 0.430 4.460 10.912 680 HG3 GLN 94 HG1 GLN 94 0.775 6.174 10.710 681 HE21 GLN 94 HE21 GLN 94 -2.431 4.779 10.847 682 HE22 GLN 94 HE22 GLN 94 -2.880 5.494 12.354 683 H GLN 95 H GLN 95 0.669 7.000 6.526 684 HA GLN 95 HA GLN 95 2.763 8.372 8.041 685 HB2 GLN 95 HB2 GLN 95 3.283 6.815 5.769 686 HB3 GLN 95 HB1 GLN 95 3.265 8.464 5.176 687 HG2 GLN 95 HG2 GLN 95 4.968 7.405 7.421 688 HG3 GLN 95 HG1 GLN 95 5.510 7.740 5.781 689 HE21 GLN 95 HE21 GLN 95 3.930 10.194 5.575 690 HE22 GLN 95 HE22 GLN 95 4.737 11.369 6.551 691 H GLU 96 H GLU 96 2.396 10.548 8.080 692 HA GLU 96 HA GLU 96 0.156 11.544 6.499 693 HB2 GLU 96 HB2 GLU 96 0.125 11.997 8.889 694 HB3 GLU 96 HB1 GLU 96 1.677 12.816 8.781 695 HG2 GLU 96 HG2 GLU 96 0.675 14.543 7.391 696 HG3 GLU 96 HG1 GLU 96 -0.876 13.705 7.455 697 H THR 97 H THR 97 0.273 13.134 5.028 698 HA THR 97 HA THR 97 2.708 13.379 3.600 699 HB THR 97 HB THR 97 1.378 14.993 2.194 700 HG1 THR 97 HG1 THR 97 -1.042 14.501 3.043 701 HG21 THR 97 HG21 THR 97 1.420 12.570 1.732 702 HG22 THR 97 HG22 THR 97 -0.141 13.287 1.325 703 HG23 THR 97 HG23 THR 97 0.043 12.354 2.809 704 H THR 98 H THR 98 4.310 14.763 3.892 705 HA THR 98 HA THR 98 4.256 16.873 5.783 706 HB THR 98 HB THR 98 6.233 16.386 3.547 707 HG1 THR 98 HG1 THR 98 6.220 15.450 6.248 708 HG21 THR 98 HG21 THR 98 6.455 18.606 4.570 709 HG22 THR 98 HG22 THR 98 7.824 17.576 4.988 710 HG23 THR 98 HG23 THR 98 6.546 17.864 6.167 711 H GLY 99 H GLY 99 3.763 16.660 2.337 712 HA2 GLY 99 HA2 GLY 99 2.213 18.190 1.318 713 HA3 GLY 99 HA1 GLY 99 2.790 19.429 2.404 714 H THR 100 H THR 100 2.994 20.707 0.473 715 HA THR 100 HA THR 100 4.956 20.055 -1.502 716 HB THR 100 HB THR 100 3.904 22.811 -0.897 717 HG1 THR 100 HG1 THR 100 2.499 21.360 -2.767 718 HG21 THR 100 HG21 THR 100 4.658 21.469 -3.477 719 HG22 THR 100 HG22 THR 100 5.644 22.626 -2.586 720 HG23 THR 100 HG23 THR 100 4.110 23.132 -3.283 721 HA PRO 101 HA PRO 101 8.493 21.309 0.972 722 HB2 PRO 101 HB2 PRO 101 9.809 21.695 -1.645 723 HB3 PRO 101 HB1 PRO 101 10.277 20.656 -0.298 724 HG2 PRO 101 HG2 PRO 101 9.260 19.653 -2.569 725 HG3 PRO 101 HG1 PRO 101 8.924 18.925 -0.989 726 HD2 PRO 101 HD2 PRO 101 7.190 20.668 -2.687 727 HD3 PRO 101 HD1 PRO 101 6.748 19.275 -1.677 728 H ARG 102 H ARG 102 8.633 23.291 1.808 729 HA ARG 102 HA ARG 102 8.637 25.591 -0.020 730 HB2 ARG 102 HB2 ARG 102 7.376 26.904 1.642 731 HB3 ARG 102 HB1 ARG 102 6.449 25.538 1.044 732 HG2 ARG 102 HG2 ARG 102 7.985 25.325 3.604 733 HG3 ARG 102 HG1 ARG 102 6.400 26.099 3.562 734 HD2 ARG 102 HD2 ARG 102 5.440 24.069 2.599 735 HD3 ARG 102 HD1 ARG 102 7.022 23.300 2.630 736 HE ARG 102 HE ARG 102 6.346 24.179 5.221 737 HH11 ARG 102 HH11 ARG 102 5.483 21.758 2.849 738 HH12 ARG 102 HH12 ARG 102 4.936 20.605 4.030 739 HH21 ARG 102 HH21 ARG 102 5.626 22.674 6.791 740 HH22 ARG 102 HH22 ARG 102 5.020 21.131 6.283 741 H SER 103 H SER 103 9.122 27.604 1.715 742 HA SER 103 HA SER 103 10.740 28.691 2.860 743 HB2 SER 103 HB2 SER 103 10.274 26.910 4.591 744 HB3 SER 103 HB1 SER 103 11.621 25.997 3.919 745 HG SER 103 HG SER 103 12.444 28.493 4.371 746 H ASP 104 H ASP 104 11.121 27.487 0.196 747 HA ASP 104 HA ASP 104 14.060 27.307 0.116 748 HB2 ASP 104 HB2 ASP 104 13.829 26.313 -2.073 749 HB3 ASP 104 HB1 ASP 104 12.751 25.465 -0.973 750 H GLY 105 H GLY 105 11.808 29.551 0.078 751 HA2 GLY 105 HA2 GLY 105 13.212 31.685 -0.784 752 HA3 GLY 105 HA1 GLY 105 12.523 31.054 -2.273 753 H THR 106 H THR 106 11.226 32.887 -2.568 754 HA THR 106 HA THR 106 9.089 33.244 -0.594 755 HB THR 106 HB THR 106 8.642 35.325 -2.136 756 HG1 THR 106 HG1 THR 106 10.111 35.001 -3.752 757 HG21 THR 106 HG21 THR 106 11.013 35.183 -0.270 758 HG22 THR 106 HG22 THR 106 9.336 35.444 0.208 759 HG23 THR 106 HG23 THR 106 10.176 36.655 -0.762 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 -3.069 -32.124 14.213 2 H2 GLY 1 HT2 GLY 1 -3.996 -32.121 12.800 3 H3 GLY 1 HT3 GLY 1 -2.668 -33.155 12.933 4 HA2 GLY 1 HA1 GLY 1 -3.751 -34.380 14.699 5 HA3 GLY 1 HA2 GLY 1 -5.131 -33.299 14.571 6 H SER 2 H SER 2 -5.944 -35.680 14.319 7 HA SER 2 HA SER 2 -5.639 -36.927 11.791 8 HB2 SER 2 HB2 SER 2 -7.856 -37.224 13.829 9 HB3 SER 2 HB1 SER 2 -7.513 -38.339 12.507 10 HG SER 2 HG SER 2 -5.662 -37.684 14.566 11 H HIS 3 H HIS 3 -6.924 -36.890 9.986 12 HA HIS 3 HA HIS 3 -8.291 -36.057 8.393 13 HB2 HIS 3 HB2 HIS 3 -9.956 -35.458 10.826 14 HB3 HIS 3 HB1 HIS 3 -10.480 -34.955 9.224 15 HD1 HIS 3 HD1 HIS 3 -11.843 -36.616 7.990 16 HD2 HIS 3 HD2 HIS 3 -9.499 -38.408 10.918 17 HE1 HIS 3 HE1 HIS 3 -12.512 -39.034 8.004 18 HE2 HIS 3 HE2 HIS 3 -10.995 -40.125 9.688 19 H MET 4 H MET 4 -6.115 -34.503 9.178 20 HA MET 4 HA MET 4 -7.075 -31.751 8.997 21 HB2 MET 4 HB2 MET 4 -5.233 -32.173 10.548 22 HB3 MET 4 HB1 MET 4 -4.271 -32.862 9.248 23 HG2 MET 4 HG2 MET 4 -3.556 -30.602 9.755 24 HG3 MET 4 HG1 MET 4 -4.215 -30.700 8.126 25 HE1 MET 4 HE1 MET 4 -3.721 -27.961 9.578 26 HE2 MET 4 HE2 MET 4 -5.218 -27.085 9.260 27 HE3 MET 4 HE3 MET 4 -4.470 -28.045 7.983 28 H GLY 5 H GLY 5 -7.178 -30.689 7.119 29 HA2 GLY 5 HA2 GLY 5 -6.417 -32.125 4.711 30 HA3 GLY 5 HA1 GLY 5 -7.378 -30.658 4.794 31 H THR 6 H THR 6 -5.344 -31.017 2.942 32 HA THR 6 HA THR 6 -3.003 -29.630 3.879 33 HB THR 6 HB THR 6 -2.843 -31.371 2.125 34 HG1 THR 6 HG1 THR 6 -2.022 -28.740 1.392 35 HG21 THR 6 HG21 THR 6 -3.530 -30.869 -0.175 36 HG22 THR 6 HG22 THR 6 -4.289 -29.377 0.382 37 HG23 THR 6 HG23 THR 6 -4.912 -30.936 0.919 38 H THR 7 H THR 7 -2.639 -27.493 3.793 39 HA THR 7 HA THR 7 -4.137 -25.743 2.086 40 HB THR 7 HB THR 7 -5.799 -26.106 3.852 41 HG1 THR 7 HG1 THR 7 -6.047 -24.083 3.174 42 HG21 THR 7 HG21 THR 7 -5.368 -25.335 6.151 43 HG22 THR 7 HG22 THR 7 -3.680 -25.054 5.728 44 HG23 THR 7 HG23 THR 7 -4.333 -26.691 5.701 45 H THR 8 H THR 8 -3.251 -23.669 1.993 46 HA THR 8 HA THR 8 -0.902 -23.147 3.654 47 HB THR 8 HB THR 8 -0.893 -22.947 0.635 48 HG1 THR 8 HG1 THR 8 -0.729 -25.113 1.709 49 HG21 THR 8 HG21 THR 8 1.303 -22.465 2.655 50 HG22 THR 8 HG22 THR 8 0.480 -21.225 1.708 51 HG23 THR 8 HG23 THR 8 1.488 -22.426 0.901 52 H ALA 9 H ALA 9 -0.873 -21.131 4.379 53 HA ALA 9 HA ALA 9 -2.512 -19.114 2.999 54 HB1 ALA 9 HB1 ALA 9 -3.251 -19.571 5.281 55 HB2 ALA 9 HB2 ALA 9 -2.607 -17.934 5.148 56 HB3 ALA 9 HB3 ALA 9 -1.635 -19.207 5.887 57 HA PRO 10 HA PRO 10 1.424 -17.204 2.067 58 HB2 PRO 10 HB2 PRO 10 0.461 -14.977 0.877 59 HB3 PRO 10 HB1 PRO 10 0.428 -16.561 0.088 60 HG2 PRO 10 HG2 PRO 10 -1.768 -15.125 1.536 61 HG3 PRO 10 HG1 PRO 10 -1.834 -16.003 -0.003 62 HD2 PRO 10 HD2 PRO 10 -2.655 -17.083 2.338 63 HD3 PRO 10 HD1 PRO 10 -1.995 -18.040 1.048 64 H ASP 11 H ASP 11 2.597 -15.277 2.670 65 HA ASP 11 HA ASP 11 1.448 -13.999 5.067 66 HB2 ASP 11 HB2 ASP 11 4.362 -14.337 4.313 67 HB3 ASP 11 HB1 ASP 11 3.760 -13.597 5.791 68 H ALA 12 H ALA 12 1.541 -11.773 5.265 69 HA ALA 12 HA ALA 12 1.814 -10.260 2.819 70 HB1 ALA 12 HB1 ALA 12 1.351 -9.363 5.674 71 HB2 ALA 12 HB2 ALA 12 0.100 -9.692 4.475 72 HB3 ALA 12 HB3 ALA 12 1.215 -8.344 4.241 73 HA PRO 13 HA PRO 13 6.060 -8.953 3.305 74 HB2 PRO 13 HB2 PRO 13 5.106 -6.236 2.594 75 HB3 PRO 13 HB1 PRO 13 6.335 -7.234 1.810 76 HG2 PRO 13 HG2 PRO 13 3.965 -6.875 0.668 77 HG3 PRO 13 HG1 PRO 13 4.762 -8.461 0.617 78 HD2 PRO 13 HD2 PRO 13 2.538 -7.511 2.382 79 HD3 PRO 13 HD1 PRO 13 2.715 -9.065 1.537 80 HA PRO 14 HA PRO 14 6.101 -7.322 7.532 81 HB2 PRO 14 HB2 PRO 14 8.888 -6.775 6.586 82 HB3 PRO 14 HB1 PRO 14 8.343 -7.474 8.115 83 HG2 PRO 14 HG2 PRO 14 9.341 -9.022 6.194 84 HG3 PRO 14 HG1 PRO 14 7.973 -9.563 7.185 85 HD2 PRO 14 HD2 PRO 14 8.017 -8.636 4.360 86 HD3 PRO 14 HD1 PRO 14 6.939 -9.802 5.151 87 H ASP 15 H ASP 15 5.965 -5.317 8.372 88 HA ASP 15 HA ASP 15 4.745 -3.413 6.991 89 HB2 ASP 15 HB2 ASP 15 5.389 -1.754 8.715 90 HB3 ASP 15 HB1 ASP 15 4.853 -3.289 9.383 91 HA PRO 16 HA PRO 16 7.797 -2.023 4.024 92 HB2 PRO 16 HB2 PRO 16 5.403 -0.469 3.194 93 HB3 PRO 16 HB1 PRO 16 6.461 -1.505 2.211 94 HG2 PRO 16 HG2 PRO 16 4.059 -2.359 2.885 95 HG3 PRO 16 HG1 PRO 16 5.442 -3.463 2.994 96 HD2 PRO 16 HD2 PRO 16 4.087 -1.931 5.189 97 HD3 PRO 16 HD1 PRO 16 4.548 -3.653 5.156 98 H THR 17 H THR 17 8.836 -0.129 3.595 99 HA THR 17 HA THR 17 8.347 2.007 5.568 100 HB THR 17 HB THR 17 10.924 1.499 4.076 101 HG1 THR 17 HG1 THR 17 10.081 0.533 6.632 102 HG21 THR 17 HG21 THR 17 10.310 3.006 6.622 103 HG22 THR 17 HG22 THR 17 10.659 3.732 5.054 104 HG23 THR 17 HG23 THR 17 11.907 2.814 5.897 105 H VAL 18 H VAL 18 7.715 3.832 4.937 106 HA VAL 18 HA VAL 18 7.561 4.565 2.153 107 HB VAL 18 HB VAL 18 6.916 6.137 4.653 108 HG11 VAL 18 HG11 VAL 18 7.537 7.687 2.905 109 HG12 VAL 18 HG12 VAL 18 5.790 7.731 3.129 110 HG13 VAL 18 HG13 VAL 18 6.483 6.870 1.746 111 HG21 VAL 18 HG21 VAL 18 5.098 4.876 2.607 112 HG22 VAL 18 HG22 VAL 18 4.605 5.749 4.057 113 HG23 VAL 18 HG23 VAL 18 5.448 4.206 4.200 114 H ASP 19 H ASP 19 9.146 5.422 1.041 115 HA ASP 19 HA ASP 19 11.602 6.161 2.390 116 HB2 ASP 19 HB2 ASP 19 11.705 4.714 0.428 117 HB3 ASP 19 HB1 ASP 19 10.927 5.952 -0.550 118 H GLN 20 H GLN 20 9.104 7.721 0.478 119 HA GLN 20 HA GLN 20 10.243 10.325 1.204 120 HB2 GLN 20 HB2 GLN 20 9.261 9.561 -1.554 121 HB3 GLN 20 HB1 GLN 20 9.645 11.198 -1.048 122 HG2 GLN 20 HG2 GLN 20 11.974 10.467 -0.625 123 HG3 GLN 20 HG1 GLN 20 11.552 8.882 -1.271 124 HE21 GLN 20 HE21 GLN 20 10.356 11.939 -2.510 125 HE22 GLN 20 HE22 GLN 20 11.140 11.848 -4.022 126 H VAL 21 H VAL 21 8.805 11.841 1.753 127 HA VAL 21 HA VAL 21 5.957 11.219 1.411 128 HB VAL 21 HB VAL 21 5.578 12.285 3.689 129 HG11 VAL 21 HG11 VAL 21 6.061 10.188 4.895 130 HG12 VAL 21 HG12 VAL 21 7.022 9.641 3.519 131 HG13 VAL 21 HG13 VAL 21 5.289 9.911 3.334 132 HG21 VAL 21 HG21 VAL 21 7.437 12.152 5.287 133 HG22 VAL 21 HG22 VAL 21 7.785 13.287 3.982 134 HG23 VAL 21 HG23 VAL 21 8.523 11.686 3.978 135 H ASP 22 H ASP 22 4.931 12.765 0.376 136 HA ASP 22 HA ASP 22 5.776 15.554 0.753 137 HB2 ASP 22 HB2 ASP 22 5.332 14.127 -1.870 138 HB3 ASP 22 HB1 ASP 22 5.247 15.879 -1.734 139 H ASP 23 H ASP 23 3.962 16.716 -0.968 140 HA ASP 23 HA ASP 23 1.598 16.721 0.579 141 HB2 ASP 23 HB2 ASP 23 0.751 18.184 -1.341 142 HB3 ASP 23 HB1 ASP 23 2.171 18.749 -0.480 143 H THR 24 H THR 24 2.014 15.896 -2.842 144 HA THR 24 HA THR 24 -0.482 14.333 -2.690 145 HB THR 24 HB THR 24 -0.700 14.909 -5.126 146 HG1 THR 24 HG1 THR 24 1.252 16.924 -4.621 147 HG21 THR 24 HG21 THR 24 -1.416 17.223 -4.734 148 HG22 THR 24 HG22 THR 24 -0.514 17.246 -3.215 149 HG23 THR 24 HG23 THR 24 -1.904 16.171 -3.402 150 H SER 25 H SER 25 2.018 13.192 -2.077 151 HA SER 25 HA SER 25 2.220 11.025 -3.844 152 HB2 SER 25 HB2 SER 25 4.595 11.483 -4.629 153 HB3 SER 25 HB1 SER 25 3.336 12.450 -5.397 154 HG SER 25 HG SER 25 5.391 13.220 -3.712 155 H ILE 26 H ILE 26 3.011 9.358 -2.765 156 HA ILE 26 HA ILE 26 5.080 9.728 -0.722 157 HB ILE 26 HB ILE 26 2.303 8.739 -0.116 158 HG12 ILE 26 HG12 ILE 26 4.244 10.469 1.422 159 HG13 ILE 26 HG11 ILE 26 2.893 11.053 0.461 160 HG21 ILE 26 HG21 ILE 26 4.785 7.947 1.388 161 HG22 ILE 26 HG22 ILE 26 3.683 6.876 0.525 162 HG23 ILE 26 HG23 ILE 26 3.137 7.726 1.972 163 HD11 ILE 26 HD11 ILE 26 2.764 9.424 2.985 164 HD12 ILE 26 HD12 ILE 26 1.368 9.813 1.980 165 HD13 ILE 26 HD13 ILE 26 2.275 11.107 2.762 166 H VAL 27 H VAL 27 6.437 7.889 -0.584 167 HA VAL 27 HA VAL 27 5.675 5.781 -2.509 168 HB VAL 27 HB VAL 27 8.480 6.651 -1.836 169 HG11 VAL 27 HG11 VAL 27 7.744 4.244 -2.680 170 HG12 VAL 27 HG12 VAL 27 9.223 5.022 -3.264 171 HG13 VAL 27 HG13 VAL 27 7.760 5.063 -4.248 172 HG21 VAL 27 HG21 VAL 27 7.331 8.420 -3.053 173 HG22 VAL 27 HG22 VAL 27 6.824 7.264 -4.284 174 HG23 VAL 27 HG23 VAL 27 8.535 7.644 -4.082 175 H VAL 28 H VAL 28 5.681 3.724 -1.783 176 HA VAL 28 HA VAL 28 6.896 3.275 0.851 177 HB VAL 28 HB VAL 28 5.029 2.443 1.741 178 HG11 VAL 28 HG11 VAL 28 4.251 4.539 0.791 179 HG12 VAL 28 HG12 VAL 28 2.976 3.354 1.017 180 HG13 VAL 28 HG13 VAL 28 3.622 3.649 -0.595 181 HG21 VAL 28 HG21 VAL 28 4.315 1.207 -0.878 182 HG22 VAL 28 HG22 VAL 28 3.440 0.960 0.636 183 HG23 VAL 28 HG23 VAL 28 5.120 0.415 0.478 184 H ARG 29 H ARG 29 7.846 1.290 1.198 185 HA ARG 29 HA ARG 29 8.185 -0.454 -1.163 186 HB2 ARG 29 HB2 ARG 29 10.359 0.444 0.747 187 HB3 ARG 29 HB1 ARG 29 10.565 -0.719 -0.553 188 HG2 ARG 29 HG2 ARG 29 10.072 1.026 -2.191 189 HG3 ARG 29 HG1 ARG 29 9.864 2.191 -0.883 190 HD2 ARG 29 HD2 ARG 29 12.166 1.929 -0.226 191 HD3 ARG 29 HD1 ARG 29 12.396 0.641 -1.409 192 HE ARG 29 HE ARG 29 11.696 2.609 -3.019 193 HH11 ARG 29 HH11 ARG 29 13.898 2.665 -0.294 194 HH12 ARG 29 HH12 ARG 29 14.856 3.961 -0.933 195 HH21 ARG 29 HH21 ARG 29 12.961 4.310 -3.865 196 HH22 ARG 29 HH22 ARG 29 14.321 4.901 -2.965 197 H TRP 30 H TRP 30 7.735 -2.470 -0.762 198 HA TRP 30 HA TRP 30 7.520 -3.314 2.054 199 HB2 TRP 30 HB2 TRP 30 5.759 -4.922 1.230 200 HB3 TRP 30 HB1 TRP 30 5.330 -3.223 1.101 201 HD1 TRP 30 HD1 TRP 30 6.384 -6.162 -1.100 202 HE1 TRP 30 HE1 TRP 30 5.558 -5.737 -3.496 203 HE3 TRP 30 HE3 TRP 30 4.531 -1.483 -0.441 204 HZ2 TRP 30 HZ2 TRP 30 4.217 -3.688 -4.894 205 HZ3 TRP 30 HZ3 TRP 30 3.460 -0.369 -2.349 206 HH2 TRP 30 HH2 TRP 30 3.299 -1.435 -4.513 207 H SER 31 H SER 31 8.378 -5.197 2.740 208 HA SER 31 HA SER 31 10.217 -6.585 1.003 209 HB2 SER 31 HB2 SER 31 9.446 -7.089 3.890 210 HB3 SER 31 HB1 SER 31 10.748 -7.911 3.031 211 HG SER 31 HG SER 31 10.642 -5.094 3.241 212 H ARG 32 H ARG 32 8.946 -7.535 -0.512 213 HA ARG 32 HA ARG 32 6.534 -8.792 -0.285 214 HB2 ARG 32 HB2 ARG 32 7.479 -10.172 -2.323 215 HB3 ARG 32 HB1 ARG 32 7.144 -8.451 -2.457 216 HG2 ARG 32 HG2 ARG 32 9.834 -9.070 -1.520 217 HG3 ARG 32 HG1 ARG 32 9.487 -9.647 -3.152 218 HD2 ARG 32 HD2 ARG 32 8.725 -7.383 -3.753 219 HD3 ARG 32 HD1 ARG 32 9.128 -6.825 -2.127 220 HE ARG 32 HE ARG 32 11.437 -7.141 -2.634 221 HH11 ARG 32 HH11 ARG 32 9.309 -7.656 -5.366 222 HH12 ARG 32 HH12 ARG 32 10.536 -7.332 -6.552 223 HH21 ARG 32 HH21 ARG 32 13.064 -6.745 -4.195 224 HH22 ARG 32 HH22 ARG 32 12.672 -6.837 -5.881 225 HA PRO 33 HA PRO 33 6.994 -12.635 1.734 226 HB2 PRO 33 HB2 PRO 33 4.962 -13.925 0.158 227 HB3 PRO 33 HB1 PRO 33 4.793 -13.169 1.746 228 HG2 PRO 33 HG2 PRO 33 3.641 -12.231 -0.576 229 HG3 PRO 33 HG1 PRO 33 3.979 -11.237 0.859 230 HD2 PRO 33 HD2 PRO 33 5.520 -11.497 -1.677 231 HD3 PRO 33 HD1 PRO 33 5.203 -10.060 -0.698 232 H GLN 34 H GLN 34 7.312 -14.939 1.527 233 HA GLN 34 HA GLN 34 8.782 -15.723 -0.839 234 HB2 GLN 34 HB2 GLN 34 9.553 -16.325 1.422 235 HB3 GLN 34 HB1 GLN 34 8.116 -17.312 1.641 236 HG2 GLN 34 HG2 GLN 34 8.828 -18.728 -0.229 237 HG3 GLN 34 HG1 GLN 34 10.278 -17.742 -0.411 238 HE21 GLN 34 HE21 GLN 34 11.660 -19.434 -0.005 239 HE22 GLN 34 HE22 GLN 34 11.846 -20.133 1.566 240 H ALA 35 H ALA 35 5.620 -15.860 0.390 241 HA ALA 35 HA ALA 35 4.498 -18.080 -0.850 242 HB1 ALA 35 HB1 ALA 35 2.407 -16.946 -0.678 243 HB2 ALA 35 HB2 ALA 35 3.194 -15.366 -0.685 244 HB3 ALA 35 HB3 ALA 35 3.369 -16.435 0.713 245 HA PRO 36 HA PRO 36 4.912 -16.911 -5.176 246 HB2 PRO 36 HB2 PRO 36 2.764 -18.855 -5.659 247 HB3 PRO 36 HB1 PRO 36 4.420 -18.853 -6.269 248 HG2 PRO 36 HG2 PRO 36 3.563 -20.624 -4.423 249 HG3 PRO 36 HG1 PRO 36 5.228 -20.018 -4.460 250 HD2 PRO 36 HD2 PRO 36 2.963 -19.236 -2.672 251 HD3 PRO 36 HD1 PRO 36 4.689 -19.427 -2.295 252 H ILE 37 H ILE 37 4.001 -15.020 -5.600 253 HA ILE 37 HA ILE 37 1.101 -14.696 -5.206 254 HB ILE 37 HB ILE 37 1.589 -12.286 -4.795 255 HG12 ILE 37 HG12 ILE 37 4.381 -13.266 -5.226 256 HG13 ILE 37 HG11 ILE 37 3.600 -11.827 -5.854 257 HG21 ILE 37 HG21 ILE 37 3.144 -14.003 -2.837 258 HG22 ILE 37 HG22 ILE 37 1.382 -13.966 -2.912 259 HG23 ILE 37 HG23 ILE 37 2.276 -12.487 -2.499 260 HD11 ILE 37 HD11 ILE 37 5.089 -10.968 -4.340 261 HD12 ILE 37 HD12 ILE 37 4.856 -12.297 -3.207 262 HD13 ILE 37 HD13 ILE 37 3.608 -11.064 -3.379 263 H THR 38 H THR 38 0.011 -13.371 -6.772 264 HA THR 38 HA THR 38 1.310 -13.449 -9.387 265 HB THR 38 HB THR 38 -1.062 -12.969 -10.204 266 HG1 THR 38 HG1 THR 38 -2.380 -12.549 -8.600 267 HG21 THR 38 HG21 THR 38 -0.456 -15.541 -8.784 268 HG22 THR 38 HG22 THR 38 0.003 -15.115 -10.434 269 HG23 THR 38 HG23 THR 38 -1.696 -15.304 -10.014 270 H GLY 39 H GLY 39 -0.051 -11.166 -7.107 271 HA2 GLY 39 HA2 GLY 39 1.086 -9.003 -8.584 272 HA3 GLY 39 HA1 GLY 39 -0.672 -9.021 -8.635 273 H TYR 40 H TYR 40 -0.211 -6.881 -7.595 274 HA TYR 40 HA TYR 40 -0.588 -7.279 -4.718 275 HB2 TYR 40 HB2 TYR 40 1.448 -5.535 -6.027 276 HB3 TYR 40 HB1 TYR 40 0.629 -4.927 -4.593 277 HD1 TYR 40 HD2 TYR 40 2.127 -8.200 -5.618 278 HD2 TYR 40 HD1 TYR 40 1.818 -5.164 -2.670 279 HE1 TYR 40 HE2 TYR 40 3.713 -9.414 -4.208 280 HE2 TYR 40 HE1 TYR 40 3.373 -6.394 -1.235 281 HH TYR 40 HH TYR 40 5.211 -9.033 -2.388 282 H ARG 41 H ARG 41 -2.331 -6.233 -3.987 283 HA ARG 41 HA ARG 41 -3.353 -3.963 -5.564 284 HB2 ARG 41 HB2 ARG 41 -4.721 -4.974 -3.122 285 HB3 ARG 41 HB1 ARG 41 -5.391 -4.253 -4.583 286 HG2 ARG 41 HG2 ARG 41 -4.124 -6.977 -4.483 287 HG3 ARG 41 HG1 ARG 41 -5.858 -6.704 -4.259 288 HD2 ARG 41 HD2 ARG 41 -4.236 -6.005 -6.706 289 HD3 ARG 41 HD1 ARG 41 -5.361 -7.357 -6.554 290 HE ARG 41 HE ARG 41 -6.449 -4.692 -6.098 291 HH11 ARG 41 HH11 ARG 41 -6.007 -7.366 -8.316 292 HH12 ARG 41 HH12 ARG 41 -7.298 -6.868 -9.361 293 HH21 ARG 41 HH21 ARG 41 -8.131 -4.030 -7.461 294 HH22 ARG 41 HH22 ARG 41 -8.517 -4.972 -8.875 295 H ILE 42 H ILE 42 -3.642 -1.941 -4.549 296 HA ILE 42 HA ILE 42 -2.436 -1.707 -1.865 297 HB ILE 42 HB ILE 42 -1.721 0.125 -4.137 298 HG12 ILE 42 HG12 ILE 42 0.001 -2.016 -2.922 299 HG13 ILE 42 HG11 ILE 42 -0.916 -2.240 -4.403 300 HG21 ILE 42 HG21 ILE 42 -0.385 -0.215 -1.457 301 HG22 ILE 42 HG22 ILE 42 -1.611 1.006 -1.787 302 HG23 ILE 42 HG23 ILE 42 -0.082 1.040 -2.662 303 HD11 ILE 42 HD11 ILE 42 0.330 -0.399 -5.420 304 HD12 ILE 42 HD12 ILE 42 1.365 -1.729 -4.904 305 HD13 ILE 42 HD13 ILE 42 1.275 -0.259 -3.940 306 H VAL 43 H VAL 43 -4.065 -0.898 -0.637 307 HA VAL 43 HA VAL 43 -5.633 1.298 -1.828 308 HB VAL 43 HB VAL 43 -6.382 -0.512 0.469 309 HG11 VAL 43 HG11 VAL 43 -7.822 1.877 -0.648 310 HG12 VAL 43 HG12 VAL 43 -7.143 1.697 0.970 311 HG13 VAL 43 HG13 VAL 43 -8.512 0.708 0.477 312 HG21 VAL 43 HG21 VAL 43 -8.169 -1.256 -0.967 313 HG22 VAL 43 HG22 VAL 43 -6.630 -1.464 -1.804 314 HG23 VAL 43 HG23 VAL 43 -7.684 -0.110 -2.214 315 H TYR 44 H TYR 44 -4.847 3.170 -1.299 316 HA TYR 44 HA TYR 44 -4.061 3.624 1.479 317 HB2 TYR 44 HB2 TYR 44 -2.809 5.656 0.426 318 HB3 TYR 44 HB1 TYR 44 -2.086 4.055 0.345 319 HD1 TYR 44 HD2 TYR 44 -2.476 2.707 -1.798 320 HD2 TYR 44 HD1 TYR 44 -3.115 6.899 -1.538 321 HE1 TYR 44 HE2 TYR 44 -2.288 2.858 -4.228 322 HE2 TYR 44 HE1 TYR 44 -2.927 7.080 -3.978 323 HH TYR 44 HH TYR 44 -2.132 5.960 -5.845 324 H SER 45 H SER 45 -5.090 4.950 2.605 325 HA SER 45 HA SER 45 -6.909 6.885 1.372 326 HB2 SER 45 HB2 SER 45 -8.670 6.042 3.067 327 HB3 SER 45 HB1 SER 45 -8.399 5.093 1.607 328 HG SER 45 HG SER 45 -8.388 3.675 3.298 329 HA PRO 46 HA PRO 46 -5.514 9.377 4.825 330 HB2 PRO 46 HB2 PRO 46 -7.238 11.423 4.464 331 HB3 PRO 46 HB1 PRO 46 -5.846 11.159 3.410 332 HG2 PRO 46 HG2 PRO 46 -8.718 10.482 2.963 333 HG3 PRO 46 HG1 PRO 46 -7.534 11.150 1.828 334 HD2 PRO 46 HD2 PRO 46 -8.251 8.523 1.888 335 HD3 PRO 46 HD1 PRO 46 -6.665 9.094 1.335 336 H SER 47 H SER 47 -6.061 9.492 6.903 337 HA SER 47 HA SER 47 -8.276 8.022 7.859 338 HB2 SER 47 HB2 SER 47 -6.120 8.202 9.050 339 HB3 SER 47 HB1 SER 47 -6.445 9.905 9.363 340 HG SER 47 HG SER 47 -8.348 8.000 10.146 341 H VAL 48 H VAL 48 -7.909 11.364 7.069 342 HA VAL 48 HA VAL 48 -10.398 12.018 8.499 343 HB VAL 48 HB VAL 48 -9.767 14.390 8.101 344 HG11 VAL 48 HG11 VAL 48 -7.815 12.716 9.674 345 HG12 VAL 48 HG12 VAL 48 -9.356 13.348 10.253 346 HG13 VAL 48 HG13 VAL 48 -8.041 14.454 9.860 347 HG21 VAL 48 HG21 VAL 48 -8.283 14.053 6.204 348 HG22 VAL 48 HG22 VAL 48 -7.144 13.191 7.236 349 HG23 VAL 48 HG23 VAL 48 -7.452 14.908 7.504 350 H GLU 49 H GLU 49 -9.922 10.727 5.826 351 HA GLU 49 HA GLU 49 -11.119 10.532 3.910 352 HB2 GLU 49 HB2 GLU 49 -13.080 11.344 5.120 353 HB3 GLU 49 HB1 GLU 49 -12.579 13.005 4.850 354 HG2 GLU 49 HG2 GLU 49 -12.862 12.707 2.445 355 HG3 GLU 49 HG1 GLU 49 -13.357 11.035 2.713 356 H GLY 50 H GLY 50 -10.901 11.187 1.797 357 HA2 GLY 50 HA2 GLY 50 -10.243 13.580 0.703 358 HA3 GLY 50 HA1 GLY 50 -8.712 13.003 1.348 359 H SER 51 H SER 51 -7.533 12.215 -0.306 360 HA SER 51 HA SER 51 -8.897 10.871 -2.494 361 HB2 SER 51 HB2 SER 51 -5.950 11.512 -2.154 362 HB3 SER 51 HB1 SER 51 -6.732 10.936 -3.627 363 HG SER 51 HG SER 51 -6.329 13.349 -3.184 364 H SER 52 H SER 52 -9.231 8.746 -2.415 365 HA SER 52 HA SER 52 -7.161 7.069 -1.145 366 HB2 SER 52 HB2 SER 52 -10.074 6.319 -1.545 367 HB3 SER 52 HB1 SER 52 -8.857 5.410 -0.645 368 HG SER 52 HG SER 52 -9.850 7.997 0.012 369 H THR 53 H THR 53 -6.371 5.353 -2.320 370 HA THR 53 HA THR 53 -7.593 4.819 -4.920 371 HB THR 53 HB THR 53 -4.702 5.688 -4.726 372 HG1 THR 53 HG1 THR 53 -6.952 7.126 -4.919 373 HG21 THR 53 HG21 THR 53 -5.100 4.030 -6.483 374 HG22 THR 53 HG22 THR 53 -4.746 5.614 -7.168 375 HG23 THR 53 HG23 THR 53 -6.407 5.023 -7.129 376 H GLU 54 H GLU 54 -7.047 2.846 -5.814 377 HA GLU 54 HA GLU 54 -5.365 1.070 -4.214 378 HB2 GLU 54 HB2 GLU 54 -7.782 0.450 -4.273 379 HB3 GLU 54 HB1 GLU 54 -7.672 0.323 -6.023 380 HG2 GLU 54 HG2 GLU 54 -5.869 -1.407 -5.653 381 HG3 GLU 54 HG1 GLU 54 -6.342 -1.397 -3.956 382 H LEU 55 H LEU 55 -3.442 0.845 -5.219 383 HA LEU 55 HA LEU 55 -3.404 0.891 -8.145 384 HB2 LEU 55 HB2 LEU 55 -1.101 1.073 -6.163 385 HB3 LEU 55 HB1 LEU 55 -0.901 0.938 -7.909 386 HG LEU 55 HG LEU 55 -2.135 3.186 -6.368 387 HD11 LEU 55 HD11 LEU 55 0.179 3.457 -6.448 388 HD12 LEU 55 HD12 LEU 55 -0.445 4.481 -7.743 389 HD13 LEU 55 HD13 LEU 55 0.271 2.915 -8.123 390 HD21 LEU 55 HD21 LEU 55 -3.584 2.843 -8.251 391 HD22 LEU 55 HD22 LEU 55 -2.202 2.719 -9.341 392 HD23 LEU 55 HD23 LEU 55 -2.577 4.258 -8.563 393 H ASN 56 H ASN 56 -2.114 -0.691 -9.294 394 HA ASN 56 HA ASN 56 -2.152 -3.311 -7.956 395 HB2 ASN 56 HB2 ASN 56 -4.048 -3.065 -9.560 396 HB3 ASN 56 HB1 ASN 56 -2.882 -2.768 -10.847 397 HD21 ASN 56 HD21 ASN 56 -4.274 -5.115 -8.726 398 HD22 ASN 56 HD22 ASN 56 -3.626 -6.516 -9.502 399 H LEU 57 H LEU 57 -0.163 -4.093 -7.843 400 HA LEU 57 HA LEU 57 1.779 -3.188 -9.858 401 HB2 LEU 57 HB2 LEU 57 2.183 -3.847 -6.922 402 HB3 LEU 57 HB1 LEU 57 3.502 -3.686 -8.061 403 HG LEU 57 HG LEU 57 1.796 -1.621 -6.808 404 HD11 LEU 57 HD11 LEU 57 3.895 -0.453 -6.671 405 HD12 LEU 57 HD12 LEU 57 4.668 -1.669 -7.689 406 HD13 LEU 57 HD13 LEU 57 4.086 -2.105 -6.086 407 HD21 LEU 57 HD21 LEU 57 2.343 0.013 -8.526 408 HD22 LEU 57 HD22 LEU 57 1.292 -1.260 -9.148 409 HD23 LEU 57 HD23 LEU 57 3.014 -1.269 -9.534 410 HA PRO 58 HA PRO 58 2.392 -7.435 -10.855 411 HB2 PRO 58 HB2 PRO 58 5.092 -7.496 -11.302 412 HB3 PRO 58 HB1 PRO 58 3.917 -6.875 -12.464 413 HG2 PRO 58 HG2 PRO 58 5.698 -5.396 -10.591 414 HG3 PRO 58 HG1 PRO 58 5.202 -4.977 -12.239 415 HD2 PRO 58 HD2 PRO 58 4.124 -3.841 -10.006 416 HD3 PRO 58 HD1 PRO 58 3.239 -4.013 -11.530 417 H GLU 59 H GLU 59 3.027 -9.315 -9.959 418 HA GLU 59 HA GLU 59 3.386 -9.751 -7.308 419 HB2 GLU 59 HB2 GLU 59 4.324 -11.957 -7.929 420 HB3 GLU 59 HB1 GLU 59 2.900 -11.530 -8.870 421 HG2 GLU 59 HG2 GLU 59 4.364 -10.827 -10.720 422 HG3 GLU 59 HG1 GLU 59 5.764 -11.336 -9.779 423 H THR 60 H THR 60 5.827 -8.734 -9.518 424 HA THR 60 HA THR 60 7.972 -9.405 -7.647 425 HB THR 60 HB THR 60 8.224 -10.234 -9.940 426 HG1 THR 60 HG1 THR 60 10.235 -9.960 -9.336 427 HG21 THR 60 HG21 THR 60 7.005 -8.542 -11.151 428 HG22 THR 60 HG22 THR 60 8.650 -8.646 -11.781 429 HG23 THR 60 HG23 THR 60 8.198 -7.320 -10.709 430 H ALA 61 H ALA 61 6.017 -7.038 -7.583 431 HA ALA 61 HA ALA 61 7.880 -4.795 -7.843 432 HB1 ALA 61 HB1 ALA 61 5.919 -3.389 -7.368 433 HB2 ALA 61 HB2 ALA 61 4.947 -4.843 -7.146 434 HB3 ALA 61 HB3 ALA 61 5.639 -4.477 -8.726 435 H ASN 62 H ASN 62 8.132 -3.274 -6.054 436 HA ASN 62 HA ASN 62 7.605 -4.404 -3.409 437 HB2 ASN 62 HB2 ASN 62 9.872 -4.180 -2.663 438 HB3 ASN 62 HB1 ASN 62 9.875 -5.162 -4.122 439 HD21 ASN 62 HD21 ASN 62 11.949 -3.492 -2.832 440 HD22 ASN 62 HD22 ASN 62 12.504 -2.422 -4.071 441 H SER 63 H SER 63 6.956 -1.876 -5.183 442 HA SER 63 HA SER 63 6.944 -0.073 -2.958 443 HB2 SER 63 HB2 SER 63 8.413 1.650 -3.971 444 HB3 SER 63 HB1 SER 63 9.289 0.162 -3.617 445 HG SER 63 HG SER 63 8.534 -0.247 -6.001 446 H VAL 64 H VAL 64 5.336 1.377 -3.187 447 HA VAL 64 HA VAL 64 4.331 1.866 -5.923 448 HB VAL 64 HB VAL 64 2.554 0.714 -4.763 449 HG11 VAL 64 HG11 VAL 64 3.551 1.615 -2.478 450 HG12 VAL 64 HG12 VAL 64 1.912 1.014 -2.657 451 HG13 VAL 64 HG13 VAL 64 2.216 2.752 -2.680 452 HG21 VAL 64 HG21 VAL 64 0.806 2.370 -4.789 453 HG22 VAL 64 HG22 VAL 64 1.859 2.442 -6.197 454 HG23 VAL 64 HG23 VAL 64 2.027 3.638 -4.911 455 H THR 65 H THR 65 4.311 3.926 -6.610 456 HA THR 65 HA THR 65 4.773 6.072 -4.707 457 HB THR 65 HB THR 65 4.743 5.892 -7.707 458 HG1 THR 65 HG1 THR 65 6.614 5.098 -6.651 459 HG21 THR 65 HG21 THR 65 5.239 8.346 -5.995 460 HG22 THR 65 HG22 THR 65 3.867 8.094 -7.077 461 HG23 THR 65 HG23 THR 65 5.494 8.252 -7.738 462 H LEU 66 H LEU 66 2.897 6.478 -3.702 463 HA LEU 66 HA LEU 66 0.335 6.518 -5.003 464 HB2 LEU 66 HB2 LEU 66 0.632 7.910 -2.445 465 HB3 LEU 66 HB1 LEU 66 -0.533 6.698 -2.930 466 HG LEU 66 HG LEU 66 2.292 5.954 -2.270 467 HD11 LEU 66 HD11 LEU 66 1.786 5.670 -0.059 468 HD12 LEU 66 HD12 LEU 66 0.049 5.832 -0.324 469 HD13 LEU 66 HD13 LEU 66 1.099 7.243 -0.444 470 HD21 LEU 66 HD21 LEU 66 1.023 4.290 -3.457 471 HD22 LEU 66 HD22 LEU 66 -0.334 4.497 -2.351 472 HD23 LEU 66 HD23 LEU 66 1.182 3.796 -1.771 473 H SER 67 H SER 67 -0.907 8.369 -5.436 474 HA SER 67 HA SER 67 0.549 10.901 -5.448 475 HB2 SER 67 HB2 SER 67 -0.201 11.185 -7.875 476 HB3 SER 67 HB1 SER 67 1.115 10.044 -7.590 477 HG SER 67 HG SER 67 -0.107 8.658 -8.571 478 H ASP 68 H ASP 68 -0.876 12.714 -6.159 479 HA ASP 68 HA ASP 68 -2.719 13.999 -5.933 480 HB2 ASP 68 HB2 ASP 68 -4.139 11.373 -6.383 481 HB3 ASP 68 HB1 ASP 68 -4.975 12.916 -6.249 482 H LEU 69 H LEU 69 -1.464 12.682 -3.592 483 HA LEU 69 HA LEU 69 -3.499 12.247 -1.648 484 HB2 LEU 69 HB2 LEU 69 -0.778 13.272 -0.910 485 HB3 LEU 69 HB1 LEU 69 -1.829 12.175 -0.036 486 HG LEU 69 HG LEU 69 -0.322 11.434 -2.533 487 HD11 LEU 69 HD11 LEU 69 1.170 11.896 -0.674 488 HD12 LEU 69 HD12 LEU 69 1.093 10.166 -1.009 489 HD13 LEU 69 HD13 LEU 69 0.218 10.839 0.368 490 HD21 LEU 69 HD21 LEU 69 -2.172 10.045 -0.634 491 HD22 LEU 69 HD22 LEU 69 -0.936 9.121 -1.495 492 HD23 LEU 69 HD23 LEU 69 -2.174 10.004 -2.400 493 H GLN 70 H GLN 70 -3.141 13.820 0.465 494 HA GLN 70 HA GLN 70 -3.373 16.578 -0.508 495 HB2 GLN 70 HB2 GLN 70 -5.615 15.686 -0.032 496 HB3 GLN 70 HB1 GLN 70 -5.108 15.260 1.596 497 HG2 GLN 70 HG2 GLN 70 -6.400 17.282 1.655 498 HG3 GLN 70 HG1 GLN 70 -4.728 17.644 2.074 499 HE21 GLN 70 HE21 GLN 70 -4.934 19.801 1.524 500 HE22 GLN 70 HE22 GLN 70 -5.048 20.333 -0.117 501 HA PRO 71 HA PRO 71 -0.032 17.039 2.387 502 HB2 PRO 71 HB2 PRO 71 -0.052 19.771 2.464 503 HB3 PRO 71 HB1 PRO 71 0.713 18.801 1.206 504 HG2 PRO 71 HG2 PRO 71 -1.947 20.165 1.189 505 HG3 PRO 71 HG1 PRO 71 -0.737 20.053 -0.103 506 HD2 PRO 71 HD2 PRO 71 -2.934 18.507 -0.078 507 HD3 PRO 71 HD1 PRO 71 -1.377 17.911 -0.691 508 H GLY 72 H GLY 72 0.080 17.050 4.537 509 HA2 GLY 72 HA2 GLY 72 -0.335 17.749 6.722 510 HA3 GLY 72 HA1 GLY 72 -1.631 18.778 6.127 511 H VAL 73 H VAL 73 -1.419 15.426 5.225 512 HA VAL 73 HA VAL 73 -3.744 14.851 6.940 513 HB VAL 73 HB VAL 73 -3.487 14.198 3.997 514 HG11 VAL 73 HG11 VAL 73 -5.930 13.521 4.393 515 HG12 VAL 73 HG12 VAL 73 -5.428 13.318 6.076 516 HG13 VAL 73 HG13 VAL 73 -4.645 12.380 4.802 517 HG21 VAL 73 HG21 VAL 73 -5.720 15.458 4.010 518 HG22 VAL 73 HG22 VAL 73 -4.213 16.385 4.029 519 HG23 VAL 73 HG23 VAL 73 -5.136 16.161 5.520 520 H GLN 74 H GLN 74 -4.043 12.726 7.534 521 HA GLN 74 HA GLN 74 -1.626 11.134 7.647 522 HB2 GLN 74 HB2 GLN 74 -3.650 11.699 9.396 523 HB3 GLN 74 HB1 GLN 74 -4.116 10.104 8.824 524 HG2 GLN 74 HG2 GLN 74 -1.419 10.766 9.963 525 HG3 GLN 74 HG1 GLN 74 -2.747 10.076 10.892 526 HE21 GLN 74 HE21 GLN 74 -0.333 9.525 8.478 527 HE22 GLN 74 HE22 GLN 74 -0.489 7.807 8.426 528 H TYR 75 H TYR 75 -1.258 9.492 6.284 529 HA TYR 75 HA TYR 75 -3.541 8.487 4.718 530 HB2 TYR 75 HB2 TYR 75 -0.865 9.443 3.880 531 HB3 TYR 75 HB1 TYR 75 -1.472 8.000 3.060 532 HD1 TYR 75 HD2 TYR 75 -2.155 11.575 3.711 533 HD2 TYR 75 HD1 TYR 75 -3.291 8.104 1.533 534 HE1 TYR 75 HE2 TYR 75 -3.597 12.953 2.270 535 HE2 TYR 75 HE1 TYR 75 -4.739 9.471 0.095 536 HH TYR 75 HH TYR 75 -4.630 12.870 0.047 537 H ASN 76 H ASN 76 -4.020 6.483 5.168 538 HA ASN 76 HA ASN 76 -2.011 4.636 6.171 539 HB2 ASN 76 HB2 ASN 76 -4.994 4.363 5.753 540 HB3 ASN 76 HB1 ASN 76 -3.972 3.058 6.337 541 HD21 ASN 76 HD21 ASN 76 -5.083 2.925 8.262 542 HD22 ASN 76 HD22 ASN 76 -4.931 4.113 9.507 543 H ILE 77 H ILE 77 -0.768 3.653 4.707 544 HA ILE 77 HA ILE 77 -1.898 2.880 2.119 545 HB ILE 77 HB ILE 77 0.947 2.636 3.117 546 HG12 ILE 77 HG12 ILE 77 1.222 4.305 1.147 547 HG13 ILE 77 HG11 ILE 77 -0.444 4.705 1.469 548 HG21 ILE 77 HG21 ILE 77 -0.378 1.793 0.597 549 HG22 ILE 77 HG22 ILE 77 0.925 1.007 1.504 550 HG23 ILE 77 HG23 ILE 77 1.257 2.445 0.524 551 HD11 ILE 77 HD11 ILE 77 1.825 4.888 3.435 552 HD12 ILE 77 HD12 ILE 77 0.139 5.287 3.770 553 HD13 ILE 77 HD13 ILE 77 1.056 6.235 2.597 554 H THR 78 H THR 78 -2.773 0.994 1.915 555 HA THR 78 HA THR 78 -1.954 -1.163 3.713 556 HB THR 78 HB THR 78 -4.507 -0.817 2.154 557 HG1 THR 78 HG1 THR 78 -4.726 0.636 3.736 558 HG21 THR 78 HG21 THR 78 -3.772 -2.772 4.343 559 HG22 THR 78 HG22 THR 78 -3.954 -3.165 2.634 560 HG23 THR 78 HG23 THR 78 -5.352 -2.639 3.571 561 H ILE 79 H ILE 79 -0.668 -2.650 2.751 562 HA ILE 79 HA ILE 79 -0.782 -2.905 -0.193 563 HB ILE 79 HB ILE 79 1.255 -4.331 1.530 564 HG12 ILE 79 HG12 ILE 79 1.788 -2.053 1.995 565 HG13 ILE 79 HG11 ILE 79 2.892 -2.613 0.734 566 HG21 ILE 79 HG21 ILE 79 1.158 -5.238 -0.622 567 HG22 ILE 79 HG22 ILE 79 2.558 -4.154 -0.603 568 HG23 ILE 79 HG23 ILE 79 1.053 -3.640 -1.367 569 HD11 ILE 79 HD11 ILE 79 1.949 -1.301 -0.870 570 HD12 ILE 79 HD12 ILE 79 1.823 -0.283 0.577 571 HD13 ILE 79 HD13 ILE 79 0.411 -1.157 -0.009 572 H TYR 80 H TYR 80 -1.212 -4.838 -1.214 573 HA TYR 80 HA TYR 80 -2.027 -7.112 0.482 574 HB2 TYR 80 HB2 TYR 80 -3.399 -6.228 -2.070 575 HB3 TYR 80 HB1 TYR 80 -3.893 -7.540 -1.014 576 HD1 TYR 80 HD2 TYR 80 -3.874 -3.878 -1.493 577 HD2 TYR 80 HD1 TYR 80 -5.075 -7.094 1.048 578 HE1 TYR 80 HE2 TYR 80 -5.418 -2.381 -0.313 579 HE2 TYR 80 HE1 TYR 80 -6.621 -5.589 2.220 580 HH TYR 80 HH TYR 80 -7.637 -2.717 1.045 581 H ALA 81 H ALA 81 -0.484 -8.641 0.038 582 HA ALA 81 HA ALA 81 0.608 -8.992 -2.628 583 HB1 ALA 81 HB1 ALA 81 2.118 -9.542 -0.867 584 HB2 ALA 81 HB2 ALA 81 1.643 -11.090 -1.595 585 HB3 ALA 81 HB3 ALA 81 0.928 -10.561 -0.052 586 H VAL 82 H VAL 82 -0.574 -9.941 -4.190 587 HA VAL 82 HA VAL 82 -2.710 -11.777 -3.255 588 HB VAL 82 HB VAL 82 -3.658 -9.856 -4.405 589 HG11 VAL 82 HG11 VAL 82 -2.060 -10.702 -6.789 590 HG12 VAL 82 HG12 VAL 82 -1.822 -9.237 -5.836 591 HG13 VAL 82 HG13 VAL 82 -3.303 -9.454 -6.767 592 HG21 VAL 82 HG21 VAL 82 -3.838 -12.321 -6.115 593 HG22 VAL 82 HG22 VAL 82 -5.016 -11.004 -6.045 594 HG23 VAL 82 HG23 VAL 82 -4.760 -12.034 -4.636 595 H GLU 83 H GLU 83 -2.843 -13.818 -3.974 596 HA GLU 83 HA GLU 83 -0.804 -14.695 -5.904 597 HB2 GLU 83 HB2 GLU 83 -2.291 -16.683 -4.277 598 HB3 GLU 83 HB1 GLU 83 -0.640 -16.704 -4.866 599 HG2 GLU 83 HG2 GLU 83 0.067 -15.248 -3.148 600 HG3 GLU 83 HG1 GLU 83 -1.586 -15.057 -2.557 601 H GLU 84 H GLU 84 -1.574 -16.736 -7.091 602 HA GLU 84 HA GLU 84 -3.538 -16.225 -8.896 603 HB2 GLU 84 HB2 GLU 84 -2.905 -18.983 -7.839 604 HB3 GLU 84 HB1 GLU 84 -3.568 -18.591 -9.417 605 HG2 GLU 84 HG2 GLU 84 -1.494 -17.456 -10.011 606 HG3 GLU 84 HG1 GLU 84 -0.832 -17.835 -8.422 607 H ASN 85 H ASN 85 -3.990 -18.083 -5.867 608 HA ASN 85 HA ASN 85 -6.879 -18.087 -6.439 609 HB2 ASN 85 HB2 ASN 85 -5.213 -20.049 -4.863 610 HB3 ASN 85 HB1 ASN 85 -6.970 -20.087 -4.933 611 HD21 ASN 85 HD21 ASN 85 -4.019 -20.684 -6.639 612 HD22 ASN 85 HD22 ASN 85 -4.724 -21.514 -7.982 613 H GLN 86 H GLN 86 -4.609 -16.731 -4.301 614 HA GLN 86 HA GLN 86 -6.708 -16.371 -2.282 615 HB2 GLN 86 HB2 GLN 86 -3.930 -17.432 -1.804 616 HB3 GLN 86 HB1 GLN 86 -4.889 -16.702 -0.523 617 HG2 GLN 86 HG2 GLN 86 -6.565 -18.388 -0.723 618 HG3 GLN 86 HG1 GLN 86 -5.797 -19.052 -2.163 619 HE21 GLN 86 HE21 GLN 86 -5.547 -18.665 1.288 620 HE22 GLN 86 HE22 GLN 86 -4.409 -19.933 1.551 621 H GLU 87 H GLU 87 -5.970 -14.789 -0.573 622 HA GLU 87 HA GLU 87 -4.222 -12.698 -1.678 623 HB2 GLU 87 HB2 GLU 87 -6.811 -12.278 -0.159 624 HB3 GLU 87 HB1 GLU 87 -5.712 -11.006 -0.669 625 HG2 GLU 87 HG2 GLU 87 -6.165 -11.477 -2.985 626 HG3 GLU 87 HG1 GLU 87 -7.159 -12.864 -2.543 627 H SER 88 H SER 88 -2.726 -11.949 -0.255 628 HA SER 88 HA SER 88 -2.436 -13.385 2.216 629 HB2 SER 88 HB2 SER 88 -0.765 -11.074 1.208 630 HB3 SER 88 HB1 SER 88 -0.304 -12.282 2.407 631 HG SER 88 HG SER 88 -0.680 -12.616 -0.378 632 H THR 89 H THR 89 -1.807 -12.139 4.224 633 HA THR 89 HA THR 89 -3.844 -10.497 5.152 634 HB THR 89 HB THR 89 -1.823 -9.824 6.805 635 HG1 THR 89 HG1 THR 89 -0.231 -11.341 6.781 636 HG21 THR 89 HG21 THR 89 -2.414 -11.809 8.135 637 HG22 THR 89 HG22 THR 89 -3.223 -12.499 6.729 638 HG23 THR 89 HG23 THR 89 -3.841 -11.019 7.464 639 HA PRO 90 HA PRO 90 -2.680 -6.553 3.614 640 HB2 PRO 90 HB2 PRO 90 -3.968 -4.913 5.296 641 HB3 PRO 90 HB1 PRO 90 -4.837 -6.016 4.222 642 HG2 PRO 90 HG2 PRO 90 -4.324 -6.230 7.146 643 HG3 PRO 90 HG1 PRO 90 -5.731 -6.757 6.209 644 HD2 PRO 90 HD2 PRO 90 -3.616 -8.364 7.094 645 HD3 PRO 90 HD1 PRO 90 -4.843 -8.808 5.893 646 H VAL 91 H VAL 91 -1.002 -5.271 3.669 647 HA VAL 91 HA VAL 91 0.614 -4.709 6.004 648 HB VAL 91 HB VAL 91 0.575 -3.735 3.161 649 HG11 VAL 91 HG11 VAL 91 2.248 -2.677 5.429 650 HG12 VAL 91 HG12 VAL 91 1.016 -1.797 4.526 651 HG13 VAL 91 HG13 VAL 91 2.498 -2.305 3.728 652 HG21 VAL 91 HG21 VAL 91 2.720 -5.099 4.774 653 HG22 VAL 91 HG22 VAL 91 2.810 -4.646 3.069 654 HG23 VAL 91 HG23 VAL 91 1.663 -5.883 3.595 655 H VAL 92 H VAL 92 -0.032 -3.126 7.447 656 HA VAL 92 HA VAL 92 -1.398 -0.818 6.238 657 HB VAL 92 HB VAL 92 -1.612 -1.506 9.160 658 HG11 VAL 92 HG11 VAL 92 -3.188 0.244 7.280 659 HG12 VAL 92 HG12 VAL 92 -2.126 0.772 8.589 660 HG13 VAL 92 HG13 VAL 92 -3.630 -0.072 8.959 661 HG21 VAL 92 HG21 VAL 92 -3.829 -2.469 8.672 662 HG22 VAL 92 HG22 VAL 92 -2.524 -3.407 7.946 663 HG23 VAL 92 HG23 VAL 92 -3.495 -2.328 6.947 664 H ILE 93 H ILE 93 0.127 0.624 5.902 665 HA ILE 93 HA ILE 93 1.809 1.401 8.186 666 HB ILE 93 HB ILE 93 3.476 2.241 6.440 667 HG12 ILE 93 HG12 ILE 93 2.304 0.166 4.634 668 HG13 ILE 93 HG11 ILE 93 1.722 1.811 4.574 669 HG21 ILE 93 HG21 ILE 93 3.945 0.342 7.860 670 HG22 ILE 93 HG22 ILE 93 4.545 0.038 6.229 671 HG23 ILE 93 HG23 ILE 93 3.049 -0.723 6.777 672 HD11 ILE 93 HD11 ILE 93 4.540 0.909 4.148 673 HD12 ILE 93 HD12 ILE 93 4.009 2.591 4.177 674 HD13 ILE 93 HD13 ILE 93 3.418 1.493 2.913 675 H GLN 94 H GLN 94 1.084 3.279 8.900 676 HA GLN 94 HA GLN 94 -0.156 5.094 6.976 677 HB2 GLN 94 HB2 GLN 94 -1.194 6.213 8.856 678 HB3 GLN 94 HB1 GLN 94 -1.514 4.494 8.937 679 HG2 GLN 94 HG2 GLN 94 0.657 5.851 10.516 680 HG3 GLN 94 HG1 GLN 94 -0.978 5.607 11.116 681 HE21 GLN 94 HE21 GLN 94 -1.347 2.996 9.974 682 HE22 GLN 94 HE22 GLN 94 -0.339 1.910 10.860 683 H GLN 95 H GLN 95 0.678 6.972 6.456 684 HA GLN 95 HA GLN 95 2.831 8.151 8.049 685 HB2 GLN 95 HB2 GLN 95 3.157 6.854 5.535 686 HB3 GLN 95 HB1 GLN 95 3.340 8.575 5.256 687 HG2 GLN 95 HG2 GLN 95 4.888 6.910 7.227 688 HG3 GLN 95 HG1 GLN 95 5.478 7.518 5.684 689 HE21 GLN 95 HE21 GLN 95 4.100 10.119 6.073 690 HE22 GLN 95 HE22 GLN 95 5.064 10.966 7.235 691 H GLU 96 H GLU 96 2.740 10.383 8.093 692 HA GLU 96 HA GLU 96 0.370 11.599 6.933 693 HB2 GLU 96 HB2 GLU 96 2.535 12.760 8.694 694 HB3 GLU 96 HB1 GLU 96 1.108 13.631 8.148 695 HG2 GLU 96 HG2 GLU 96 -0.330 12.194 9.383 696 HG3 GLU 96 HG1 GLU 96 1.008 11.125 9.801 697 H THR 97 H THR 97 0.372 13.275 5.464 698 HA THR 97 HA THR 97 2.641 13.346 3.683 699 HB THR 97 HB THR 97 1.189 14.888 2.352 700 HG1 THR 97 HG1 THR 97 -1.092 14.867 3.148 701 HG21 THR 97 HG21 THR 97 -0.170 12.322 3.187 702 HG22 THR 97 HG22 THR 97 1.181 12.413 2.057 703 HG23 THR 97 HG23 THR 97 -0.364 13.167 1.651 704 H THR 98 H THR 98 4.289 14.649 4.025 705 HA THR 98 HA THR 98 4.244 16.714 5.974 706 HB THR 98 HB THR 98 6.348 16.173 3.876 707 HG1 THR 98 HG1 THR 98 5.600 14.841 6.212 708 HG21 THR 98 HG21 THR 98 7.887 17.176 5.483 709 HG22 THR 98 HG22 THR 98 6.559 17.452 6.609 710 HG23 THR 98 HG23 THR 98 6.605 18.315 5.073 711 H GLY 99 H GLY 99 4.011 16.634 2.488 712 HA2 GLY 99 HA2 GLY 99 2.653 18.298 1.409 713 HA3 GLY 99 HA1 GLY 99 3.208 19.457 2.593 714 H THR 100 H THR 100 3.491 20.614 0.462 715 HA THR 100 HA THR 100 5.794 19.900 -1.107 716 HB THR 100 HB THR 100 4.156 22.446 -1.069 717 HG1 THR 100 HG1 THR 100 3.830 19.953 -2.275 718 HG21 THR 100 HG21 THR 100 6.150 21.437 -3.076 719 HG22 THR 100 HG22 THR 100 6.319 22.845 -2.031 720 HG23 THR 100 HG23 THR 100 5.093 22.830 -3.292 721 HA PRO 101 HA PRO 101 8.834 21.680 1.683 722 HB2 PRO 101 HB2 PRO 101 10.326 21.808 -0.895 723 HB3 PRO 101 HB1 PRO 101 10.836 21.154 0.665 724 HG2 PRO 101 HG2 PRO 101 10.144 19.526 -1.316 725 HG3 PRO 101 HG1 PRO 101 9.681 19.165 0.357 726 HD2 PRO 101 HD2 PRO 101 8.020 20.232 -1.883 727 HD3 PRO 101 HD1 PRO 101 7.576 19.108 -0.583 728 H ARG 102 H ARG 102 8.229 22.983 -1.561 729 HA ARG 102 HA ARG 102 7.972 25.100 -2.346 730 HB2 ARG 102 HB2 ARG 102 6.104 24.971 -0.682 731 HB3 ARG 102 HB1 ARG 102 7.163 25.721 0.501 732 HG2 ARG 102 HG2 ARG 102 7.351 27.690 -1.010 733 HG3 ARG 102 HG1 ARG 102 6.136 26.941 -2.050 734 HD2 ARG 102 HD2 ARG 102 5.085 28.544 -0.569 735 HD3 ARG 102 HD1 ARG 102 4.566 26.910 -0.158 736 HE ARG 102 HE ARG 102 6.820 27.816 1.379 737 HH11 ARG 102 HH11 ARG 102 3.325 27.805 1.168 738 HH12 ARG 102 HH12 ARG 102 3.098 28.053 2.869 739 HH21 ARG 102 HH21 ARG 102 6.518 28.156 3.622 740 HH22 ARG 102 HH22 ARG 102 4.908 28.270 4.262 741 H SER 103 H SER 103 10.422 24.940 -2.388 742 HA SER 103 HA SER 103 11.746 26.726 -0.501 743 HB2 SER 103 HB2 SER 103 12.909 25.099 -2.778 744 HB3 SER 103 HB1 SER 103 13.822 25.938 -1.524 745 HG SER 103 HG SER 103 12.718 23.484 -1.463 746 H ASP 104 H ASP 104 9.934 28.085 -1.940 747 HA ASP 104 HA ASP 104 11.082 29.187 -4.355 748 HB2 ASP 104 HB2 ASP 104 9.030 30.376 -4.592 749 HB3 ASP 104 HB1 ASP 104 8.601 28.785 -3.971 750 H GLY 105 H GLY 105 11.157 29.852 -1.016 751 HA2 GLY 105 HA2 GLY 105 11.592 32.708 -1.350 752 HA3 GLY 105 HA1 GLY 105 11.494 31.841 0.172 753 H THR 106 H THR 106 13.541 31.005 -2.550 754 HA THR 106 HA THR 106 15.885 31.127 -0.887 755 HB THR 106 HB THR 106 15.683 30.600 -3.861 756 HG1 THR 106 HG1 THR 106 14.814 29.130 -1.838 757 HG21 THR 106 HG21 THR 106 17.877 29.999 -1.869 758 HG22 THR 106 HG22 THR 106 17.938 31.213 -3.147 759 HG23 THR 106 HG23 THR 106 17.864 29.500 -3.562 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 -7.435 -34.834 9.095 2 H2 GLY 1 HT2 GLY 1 -5.855 -34.235 9.109 3 H3 GLY 1 HT3 GLY 1 -6.202 -35.712 9.849 4 HA2 GLY 1 HA1 GLY 1 -6.775 -36.679 7.711 5 HA3 GLY 1 HA2 GLY 1 -6.392 -35.143 6.950 6 H SER 2 H SER 2 -5.010 -36.955 5.831 7 HA SER 2 HA SER 2 -2.530 -37.441 7.297 8 HB2 SER 2 HB2 SER 2 -3.411 -38.432 4.575 9 HB3 SER 2 HB1 SER 2 -1.988 -38.971 5.465 10 HG SER 2 HG SER 2 -3.934 -39.280 7.143 11 H HIS 3 H HIS 3 -3.809 -35.155 5.226 12 HA HIS 3 HA HIS 3 -1.207 -34.494 4.036 13 HB2 HIS 3 HB2 HIS 3 -4.010 -33.602 3.347 14 HB3 HIS 3 HB1 HIS 3 -2.572 -32.878 2.640 15 HD1 HIS 3 HD1 HIS 3 -1.945 -33.852 0.457 16 HD2 HIS 3 HD2 HIS 3 -3.993 -36.580 2.835 17 HE1 HIS 3 HE1 HIS 3 -2.195 -35.919 -0.948 18 HE2 HIS 3 HE2 HIS 3 -3.566 -37.499 0.457 19 H MET 4 H MET 4 -1.309 -34.035 6.689 20 HA MET 4 HA MET 4 -2.277 -31.482 7.446 21 HB2 MET 4 HB2 MET 4 -1.773 -33.352 9.019 22 HB3 MET 4 HB1 MET 4 -0.060 -33.102 8.716 23 HG2 MET 4 HG2 MET 4 -0.678 -32.069 10.793 24 HG3 MET 4 HG1 MET 4 -0.254 -30.824 9.620 25 HE1 MET 4 HE1 MET 4 -1.405 -29.079 11.329 26 HE2 MET 4 HE2 MET 4 -1.888 -30.397 12.396 27 HE3 MET 4 HE3 MET 4 -3.081 -29.211 11.864 28 H GLY 5 H GLY 5 0.850 -32.654 6.306 29 HA2 GLY 5 HA2 GLY 5 2.086 -30.050 6.575 30 HA3 GLY 5 HA1 GLY 5 2.828 -31.495 5.906 31 H THR 6 H THR 6 0.639 -28.837 5.234 32 HA THR 6 HA THR 6 1.352 -29.030 2.395 33 HB THR 6 HB THR 6 -1.472 -28.563 3.391 34 HG1 THR 6 HG1 THR 6 -1.219 -30.719 3.561 35 HG21 THR 6 HG21 THR 6 -0.952 -27.374 1.307 36 HG22 THR 6 HG22 THR 6 -2.090 -28.692 1.025 37 HG23 THR 6 HG23 THR 6 -0.393 -28.882 0.585 38 H THR 7 H THR 7 2.707 -27.244 2.595 39 HA THR 7 HA THR 7 1.787 -24.831 3.864 40 HB THR 7 HB THR 7 4.254 -25.224 2.162 41 HG1 THR 7 HG1 THR 7 3.623 -26.295 4.523 42 HG21 THR 7 HG21 THR 7 3.668 -22.876 2.541 43 HG22 THR 7 HG22 THR 7 5.122 -23.311 3.439 44 HG23 THR 7 HG23 THR 7 3.578 -23.172 4.277 45 H THR 8 H THR 8 -0.063 -24.300 2.672 46 HA THR 8 HA THR 8 0.486 -23.262 -0.018 47 HB THR 8 HB THR 8 -1.199 -25.084 0.021 48 HG1 THR 8 HG1 THR 8 -1.814 -22.465 -0.802 49 HG21 THR 8 HG21 THR 8 -3.394 -24.655 1.038 50 HG22 THR 8 HG22 THR 8 -2.782 -23.142 1.706 51 HG23 THR 8 HG23 THR 8 -2.110 -24.679 2.246 52 H ALA 9 H ALA 9 0.008 -22.449 3.082 53 HA ALA 9 HA ALA 9 -1.601 -20.093 2.753 54 HB1 ALA 9 HB1 ALA 9 -1.607 -21.345 4.863 55 HB2 ALA 9 HB2 ALA 9 -1.136 -19.661 5.096 56 HB3 ALA 9 HB3 ALA 9 0.091 -20.929 5.105 57 HA PRO 10 HA PRO 10 1.922 -17.617 1.541 58 HB2 PRO 10 HB2 PRO 10 0.531 -15.506 0.694 59 HB3 PRO 10 HB1 PRO 10 0.523 -17.023 -0.216 60 HG2 PRO 10 HG2 PRO 10 -1.525 -15.938 1.680 61 HG3 PRO 10 HG1 PRO 10 -1.763 -16.718 0.106 62 HD2 PRO 10 HD2 PRO 10 -2.015 -18.008 2.505 63 HD3 PRO 10 HD1 PRO 10 -1.626 -18.808 1.012 64 H ASP 11 H ASP 11 2.518 -15.260 1.986 65 HA ASP 11 HA ASP 11 1.534 -14.359 4.601 66 HB2 ASP 11 HB2 ASP 11 4.432 -14.602 3.761 67 HB3 ASP 11 HB1 ASP 11 3.891 -13.709 5.175 68 H ALA 12 H ALA 12 2.007 -12.094 5.011 69 HA ALA 12 HA ALA 12 1.921 -10.493 2.556 70 HB1 ALA 12 HB1 ALA 12 0.204 -10.090 4.248 71 HB2 ALA 12 HB2 ALA 12 1.240 -8.673 4.068 72 HB3 ALA 12 HB3 ALA 12 1.449 -9.749 5.450 73 HA PRO 13 HA PRO 13 6.086 -9.046 2.986 74 HB2 PRO 13 HB2 PRO 13 5.177 -6.300 2.414 75 HB3 PRO 13 HB1 PRO 13 6.263 -7.335 1.483 76 HG2 PRO 13 HG2 PRO 13 3.807 -6.799 0.606 77 HG3 PRO 13 HG1 PRO 13 4.515 -8.416 0.401 78 HD2 PRO 13 HD2 PRO 13 2.578 -7.442 2.472 79 HD3 PRO 13 HD1 PRO 13 2.513 -8.934 1.501 80 HA PRO 14 HA PRO 14 6.373 -7.616 7.258 81 HB2 PRO 14 HB2 PRO 14 9.099 -7.043 6.165 82 HB3 PRO 14 HB1 PRO 14 8.643 -7.795 7.699 83 HG2 PRO 14 HG2 PRO 14 9.495 -9.284 5.668 84 HG3 PRO 14 HG1 PRO 14 8.169 -9.840 6.707 85 HD2 PRO 14 HD2 PRO 14 8.086 -8.788 3.928 86 HD3 PRO 14 HD1 PRO 14 7.031 -9.973 4.721 87 H ASP 15 H ASP 15 6.477 -5.683 8.272 88 HA ASP 15 HA ASP 15 5.135 -3.632 7.248 89 HB2 ASP 15 HB2 ASP 15 5.794 -3.912 9.622 90 HB3 ASP 15 HB1 ASP 15 7.387 -3.278 9.227 91 HA PRO 16 HA PRO 16 7.992 -2.070 4.112 92 HB2 PRO 16 HB2 PRO 16 5.569 -0.583 3.309 93 HB3 PRO 16 HB1 PRO 16 6.573 -1.690 2.338 94 HG2 PRO 16 HG2 PRO 16 4.160 -2.436 3.156 95 HG3 PRO 16 HG1 PRO 16 5.511 -3.579 3.211 96 HD2 PRO 16 HD2 PRO 16 4.354 -1.935 5.450 97 HD3 PRO 16 HD1 PRO 16 4.701 -3.686 5.425 98 H THR 17 H THR 17 8.975 -0.154 3.719 99 HA THR 17 HA THR 17 8.455 1.975 5.704 100 HB THR 17 HB THR 17 11.023 1.425 4.197 101 HG1 THR 17 HG1 THR 17 9.993 0.384 6.600 102 HG21 THR 17 HG21 THR 17 12.042 2.835 5.920 103 HG22 THR 17 HG22 THR 17 10.460 3.082 6.659 104 HG23 THR 17 HG23 THR 17 10.788 3.714 5.046 105 H VAL 18 H VAL 18 7.898 3.856 5.091 106 HA VAL 18 HA VAL 18 7.510 4.514 2.322 107 HB VAL 18 HB VAL 18 7.227 6.186 4.821 108 HG11 VAL 18 HG11 VAL 18 6.042 7.822 3.389 109 HG12 VAL 18 HG12 VAL 18 6.547 6.916 1.955 110 HG13 VAL 18 HG13 VAL 18 7.754 7.684 2.995 111 HG21 VAL 18 HG21 VAL 18 4.870 5.901 4.512 112 HG22 VAL 18 HG22 VAL 18 5.625 4.306 4.492 113 HG23 VAL 18 HG23 VAL 18 5.122 5.065 2.984 114 H ASP 19 H ASP 19 8.865 5.411 0.979 115 HA ASP 19 HA ASP 19 11.578 5.937 1.834 116 HB2 ASP 19 HB2 ASP 19 10.929 4.607 -0.225 117 HB3 ASP 19 HB1 ASP 19 10.430 6.128 -0.954 118 H GLN 20 H GLN 20 8.984 7.710 0.189 119 HA GLN 20 HA GLN 20 10.238 10.234 1.019 120 HB2 GLN 20 HB2 GLN 20 9.136 9.637 -1.736 121 HB3 GLN 20 HB1 GLN 20 9.615 11.229 -1.172 122 HG2 GLN 20 HG2 GLN 20 11.911 10.478 -0.944 123 HG3 GLN 20 HG1 GLN 20 11.443 8.856 -1.454 124 HE21 GLN 20 HE21 GLN 20 11.982 12.128 -2.468 125 HE22 GLN 20 HE22 GLN 20 11.966 11.831 -4.146 126 H VAL 21 H VAL 21 8.844 11.721 1.748 127 HA VAL 21 HA VAL 21 5.972 11.159 1.417 128 HB VAL 21 HB VAL 21 7.225 12.508 3.806 129 HG11 VAL 21 HG11 VAL 21 4.905 13.146 3.278 130 HG12 VAL 21 HG12 VAL 21 5.051 12.305 4.821 131 HG13 VAL 21 HG13 VAL 21 4.435 11.451 3.407 132 HG21 VAL 21 HG21 VAL 21 6.756 10.459 5.050 133 HG22 VAL 21 HG22 VAL 21 7.892 10.161 3.735 134 HG23 VAL 21 HG23 VAL 21 6.204 9.681 3.565 135 H ASP 22 H ASP 22 5.088 12.625 0.120 136 HA ASP 22 HA ASP 22 5.911 15.438 0.424 137 HB2 ASP 22 HB2 ASP 22 5.232 13.887 -2.067 138 HB3 ASP 22 HB1 ASP 22 5.088 15.637 -2.021 139 H ASP 23 H ASP 23 3.971 16.632 -1.068 140 HA ASP 23 HA ASP 23 1.702 16.581 0.629 141 HB2 ASP 23 HB2 ASP 23 0.770 18.124 -1.219 142 HB3 ASP 23 HB1 ASP 23 2.190 18.659 -0.341 143 H THR 24 H THR 24 1.840 16.022 -2.869 144 HA THR 24 HA THR 24 -0.663 14.485 -2.667 145 HB THR 24 HB THR 24 -0.866 15.075 -5.104 146 HG1 THR 24 HG1 THR 24 1.220 16.953 -4.584 147 HG21 THR 24 HG21 THR 24 -1.990 16.394 -3.372 148 HG22 THR 24 HG22 THR 24 -1.452 17.428 -4.697 149 HG23 THR 24 HG23 THR 24 -0.543 17.388 -3.181 150 H SER 25 H SER 25 1.873 13.296 -2.105 151 HA SER 25 HA SER 25 1.943 11.058 -3.779 152 HB2 SER 25 HB2 SER 25 4.290 11.476 -4.715 153 HB3 SER 25 HB1 SER 25 2.966 12.354 -5.482 154 HG SER 25 HG SER 25 4.196 13.606 -3.336 155 H ILE 26 H ILE 26 2.850 9.425 -2.688 156 HA ILE 26 HA ILE 26 5.019 9.921 -0.781 157 HB ILE 26 HB ILE 26 2.347 8.748 0.019 158 HG12 ILE 26 HG12 ILE 26 4.100 10.848 1.306 159 HG13 ILE 26 HG11 ILE 26 2.646 11.160 0.369 160 HG21 ILE 26 HG21 ILE 26 4.023 7.154 0.744 161 HG22 ILE 26 HG22 ILE 26 3.368 8.025 2.132 162 HG23 ILE 26 HG23 ILE 26 4.958 8.449 1.496 163 HD11 ILE 26 HD11 ILE 26 2.146 11.333 2.706 164 HD12 ILE 26 HD12 ILE 26 2.817 9.727 3.008 165 HD13 ILE 26 HD13 ILE 26 1.346 9.903 2.051 166 H VAL 27 H VAL 27 6.301 7.973 -0.427 167 HA VAL 27 HA VAL 27 5.617 5.899 -2.424 168 HB VAL 27 HB VAL 27 8.391 6.717 -1.580 169 HG11 VAL 27 HG11 VAL 27 9.198 5.185 -3.131 170 HG12 VAL 27 HG12 VAL 27 7.681 5.151 -4.030 171 HG13 VAL 27 HG13 VAL 27 7.791 4.343 -2.462 172 HG21 VAL 27 HG21 VAL 27 7.308 8.527 -2.819 173 HG22 VAL 27 HG22 VAL 27 6.934 7.405 -4.128 174 HG23 VAL 27 HG23 VAL 27 8.612 7.792 -3.751 175 H VAL 28 H VAL 28 5.722 3.772 -1.720 176 HA VAL 28 HA VAL 28 6.920 3.382 0.925 177 HB VAL 28 HB VAL 28 5.127 2.439 1.859 178 HG11 VAL 28 HG11 VAL 28 3.654 3.840 -0.323 179 HG12 VAL 28 HG12 VAL 28 4.307 4.585 1.135 180 HG13 VAL 28 HG13 VAL 28 3.025 3.386 1.261 181 HG21 VAL 28 HG21 VAL 28 3.478 1.030 0.764 182 HG22 VAL 28 HG22 VAL 28 5.140 0.497 0.454 183 HG23 VAL 28 HG23 VAL 28 4.246 1.379 -0.786 184 H ARG 29 H ARG 29 7.833 1.356 1.306 185 HA ARG 29 HA ARG 29 8.246 -0.320 -1.091 186 HB2 ARG 29 HB2 ARG 29 10.426 0.422 0.874 187 HB3 ARG 29 HB1 ARG 29 10.610 -0.445 -0.643 188 HG2 ARG 29 HG2 ARG 29 10.114 1.539 -1.900 189 HG3 ARG 29 HG1 ARG 29 9.716 2.423 -0.429 190 HD2 ARG 29 HD2 ARG 29 11.914 3.064 -1.134 191 HD3 ARG 29 HD1 ARG 29 12.056 2.100 0.333 192 HE ARG 29 HE ARG 29 12.401 0.259 -1.597 193 HH11 ARG 29 HH11 ARG 29 13.850 3.411 -1.057 194 HH12 ARG 29 HH12 ARG 29 15.355 2.977 -1.808 195 HH21 ARG 29 HH21 ARG 29 14.379 -0.298 -2.597 196 HH22 ARG 29 HH22 ARG 29 15.656 0.876 -2.691 197 H TRP 30 H TRP 30 7.794 -2.335 -0.718 198 HA TRP 30 HA TRP 30 7.678 -3.277 2.078 199 HB2 TRP 30 HB2 TRP 30 5.868 -4.838 1.296 200 HB3 TRP 30 HB1 TRP 30 5.438 -3.136 1.173 201 HD1 TRP 30 HD1 TRP 30 6.397 -6.096 -1.006 202 HE1 TRP 30 HE1 TRP 30 5.586 -5.672 -3.406 203 HE3 TRP 30 HE3 TRP 30 4.692 -1.362 -0.394 204 HZ2 TRP 30 HZ2 TRP 30 4.312 -3.601 -4.823 205 HZ3 TRP 30 HZ3 TRP 30 3.655 -0.236 -2.313 206 HH2 TRP 30 HH2 TRP 30 3.463 -1.321 -4.466 207 H SER 31 H SER 31 8.326 -5.384 2.552 208 HA SER 31 HA SER 31 10.240 -6.494 0.656 209 HB2 SER 31 HB2 SER 31 9.705 -7.343 3.510 210 HB3 SER 31 HB1 SER 31 11.114 -7.740 2.527 211 HG SER 31 HG SER 31 11.313 -5.291 2.434 212 H ARG 32 H ARG 32 9.212 -7.714 -0.820 213 HA ARG 32 HA ARG 32 6.766 -8.939 -0.577 214 HB2 ARG 32 HB2 ARG 32 8.941 -9.976 -2.370 215 HB3 ARG 32 HB1 ARG 32 7.211 -10.014 -2.641 216 HG2 ARG 32 HG2 ARG 32 7.776 -8.281 -4.005 217 HG3 ARG 32 HG1 ARG 32 7.463 -7.408 -2.503 218 HD2 ARG 32 HD2 ARG 32 9.536 -6.656 -2.406 219 HD3 ARG 32 HD1 ARG 32 10.192 -8.289 -2.588 220 HE ARG 32 HE ARG 32 9.262 -7.176 -5.066 221 HH11 ARG 32 HH11 ARG 32 11.974 -7.316 -2.856 222 HH12 ARG 32 HH12 ARG 32 13.147 -6.911 -4.069 223 HH21 ARG 32 HH21 ARG 32 10.799 -6.648 -6.667 224 HH22 ARG 32 HH22 ARG 32 12.479 -6.544 -6.235 225 HA PRO 33 HA PRO 33 7.293 -12.692 1.612 226 HB2 PRO 33 HB2 PRO 33 5.144 -13.983 0.202 227 HB3 PRO 33 HB1 PRO 33 5.067 -13.126 1.745 228 HG2 PRO 33 HG2 PRO 33 3.847 -12.280 -0.575 229 HG3 PRO 33 HG1 PRO 33 4.308 -11.208 0.768 230 HD2 PRO 33 HD2 PRO 33 5.750 -11.765 -1.792 231 HD3 PRO 33 HD1 PRO 33 5.498 -10.219 -0.970 232 H GLN 34 H GLN 34 7.572 -15.017 1.476 233 HA GLN 34 HA GLN 34 8.982 -15.909 -0.890 234 HB2 GLN 34 HB2 GLN 34 8.182 -17.496 1.552 235 HB3 GLN 34 HB1 GLN 34 9.378 -17.941 0.345 236 HG2 GLN 34 HG2 GLN 34 10.795 -16.098 1.030 237 HG3 GLN 34 HG1 GLN 34 9.588 -15.593 2.213 238 HE21 GLN 34 HE21 GLN 34 12.028 -17.919 1.419 239 HE22 GLN 34 HE22 GLN 34 12.112 -18.669 2.976 240 H ALA 35 H ALA 35 5.845 -15.867 0.322 241 HA ALA 35 HA ALA 35 4.628 -18.134 -0.744 242 HB1 ALA 35 HB1 ALA 35 2.579 -16.983 -0.471 243 HB2 ALA 35 HB2 ALA 35 3.361 -15.408 -0.625 244 HB3 ALA 35 HB3 ALA 35 3.639 -16.398 0.814 245 HA PRO 36 HA PRO 36 4.589 -17.136 -5.125 246 HB2 PRO 36 HB2 PRO 36 2.301 -18.933 -5.374 247 HB3 PRO 36 HB1 PRO 36 3.921 -19.107 -6.048 248 HG2 PRO 36 HG2 PRO 36 2.957 -20.683 -4.048 249 HG3 PRO 36 HG1 PRO 36 4.677 -20.316 -4.258 250 HD2 PRO 36 HD2 PRO 36 2.716 -19.176 -2.322 251 HD3 PRO 36 HD1 PRO 36 4.442 -19.535 -2.109 252 H ILE 37 H ILE 37 3.758 -15.206 -5.522 253 HA ILE 37 HA ILE 37 0.902 -14.725 -4.993 254 HB ILE 37 HB ILE 37 1.472 -12.353 -4.601 255 HG12 ILE 37 HG12 ILE 37 4.200 -13.341 -5.277 256 HG13 ILE 37 HG11 ILE 37 3.381 -11.873 -5.775 257 HG21 ILE 37 HG21 ILE 37 3.210 -13.982 -2.739 258 HG22 ILE 37 HG22 ILE 37 1.450 -14.074 -2.707 259 HG23 ILE 37 HG23 ILE 37 2.253 -12.528 -2.374 260 HD11 ILE 37 HD11 ILE 37 5.064 -11.133 -4.375 261 HD12 ILE 37 HD12 ILE 37 4.812 -12.450 -3.231 262 HD13 ILE 37 HD13 ILE 37 3.634 -11.144 -3.338 263 H THR 38 H THR 38 -0.210 -13.484 -6.583 264 HA THR 38 HA THR 38 1.053 -13.655 -9.212 265 HB THR 38 HB THR 38 -1.314 -13.247 -10.036 266 HG1 THR 38 HG1 THR 38 -2.952 -13.597 -8.522 267 HG21 THR 38 HG21 THR 38 -0.834 -15.709 -8.386 268 HG22 THR 38 HG22 THR 38 -0.193 -15.426 -10.006 269 HG23 THR 38 HG23 THR 38 -1.931 -15.541 -9.757 270 H GLY 39 H GLY 39 -0.011 -11.249 -6.947 271 HA2 GLY 39 HA2 GLY 39 1.239 -9.229 -8.488 272 HA3 GLY 39 HA1 GLY 39 -0.507 -9.103 -8.625 273 H TYR 40 H TYR 40 0.005 -6.967 -7.622 274 HA TYR 40 HA TYR 40 -0.479 -7.271 -4.744 275 HB2 TYR 40 HB2 TYR 40 1.609 -5.548 -6.031 276 HB3 TYR 40 HB1 TYR 40 0.774 -4.963 -4.596 277 HD1 TYR 40 HD1 TYR 40 2.170 -8.272 -5.606 278 HD2 TYR 40 HD2 TYR 40 2.051 -5.179 -2.702 279 HE1 TYR 40 HE1 TYR 40 3.758 -9.515 -4.224 280 HE2 TYR 40 HE2 TYR 40 3.606 -6.440 -1.295 281 HH TYR 40 HH TYR 40 5.344 -9.126 -2.462 282 H ARG 41 H ARG 41 -2.228 -6.211 -4.113 283 HA ARG 41 HA ARG 41 -3.142 -3.919 -5.726 284 HB2 ARG 41 HB2 ARG 41 -4.643 -4.944 -3.366 285 HB3 ARG 41 HB1 ARG 41 -5.233 -4.185 -4.841 286 HG2 ARG 41 HG2 ARG 41 -4.023 -6.934 -4.715 287 HG3 ARG 41 HG1 ARG 41 -5.765 -6.623 -4.615 288 HD2 ARG 41 HD2 ARG 41 -3.949 -5.920 -6.921 289 HD3 ARG 41 HD1 ARG 41 -5.108 -7.248 -6.880 290 HE ARG 41 HE ARG 41 -6.269 -4.649 -6.400 291 HH11 ARG 41 HH11 ARG 41 -5.368 -7.002 -8.837 292 HH12 ARG 41 HH12 ARG 41 -6.492 -6.391 -10.009 293 HH21 ARG 41 HH21 ARG 41 -7.733 -3.863 -7.913 294 HH22 ARG 41 HH22 ARG 41 -7.840 -4.597 -9.488 295 H ILE 42 H ILE 42 -3.454 -1.907 -4.698 296 HA ILE 42 HA ILE 42 -2.333 -1.727 -1.975 297 HB ILE 42 HB ILE 42 -1.519 0.113 -4.203 298 HG12 ILE 42 HG12 ILE 42 0.158 -2.020 -2.923 299 HG13 ILE 42 HG11 ILE 42 -0.727 -2.271 -4.418 300 HG21 ILE 42 HG21 ILE 42 -0.359 -0.231 -1.443 301 HG22 ILE 42 HG22 ILE 42 -1.485 1.045 -1.902 302 HG23 ILE 42 HG23 ILE 42 0.109 0.971 -2.649 303 HD11 ILE 42 HD11 ILE 42 0.537 -0.456 -5.450 304 HD12 ILE 42 HD12 ILE 42 1.574 -1.758 -4.866 305 HD13 ILE 42 HD13 ILE 42 1.439 -0.261 -3.949 306 H VAL 43 H VAL 43 -3.946 -0.919 -0.777 307 HA VAL 43 HA VAL 43 -5.495 1.275 -1.995 308 HB VAL 43 HB VAL 43 -6.326 -0.569 0.248 309 HG11 VAL 43 HG11 VAL 43 -7.100 1.656 0.712 310 HG12 VAL 43 HG12 VAL 43 -8.446 0.635 0.216 311 HG13 VAL 43 HG13 VAL 43 -7.757 1.799 -0.917 312 HG21 VAL 43 HG21 VAL 43 -6.490 -1.519 -2.020 313 HG22 VAL 43 HG22 VAL 43 -7.490 -0.145 -2.495 314 HG23 VAL 43 HG23 VAL 43 -8.070 -1.278 -1.276 315 H TYR 44 H TYR 44 -4.718 3.128 -1.414 316 HA TYR 44 HA TYR 44 -3.982 3.529 1.383 317 HB2 TYR 44 HB2 TYR 44 -2.853 5.662 0.372 318 HB3 TYR 44 HB1 TYR 44 -2.042 4.106 0.260 319 HD1 TYR 44 HD2 TYR 44 -2.391 2.776 -1.919 320 HD2 TYR 44 HD1 TYR 44 -3.211 6.929 -1.558 321 HE1 TYR 44 HE2 TYR 44 -2.230 2.988 -4.345 322 HE2 TYR 44 HE1 TYR 44 -3.051 7.173 -3.993 323 HH TYR 44 HH TYR 44 -2.168 6.105 -5.894 324 H SER 45 H SER 45 -5.110 4.731 2.554 325 HA SER 45 HA SER 45 -7.053 6.578 1.379 326 HB2 SER 45 HB2 SER 45 -8.812 5.624 2.898 327 HB3 SER 45 HB1 SER 45 -8.304 4.537 1.605 328 HG SER 45 HG SER 45 -6.868 3.569 3.196 329 HA PRO 46 HA PRO 46 -5.805 9.038 4.935 330 HB2 PRO 46 HB2 PRO 46 -8.134 10.635 4.367 331 HB3 PRO 46 HB1 PRO 46 -6.441 11.077 4.261 332 HG2 PRO 46 HG2 PRO 46 -8.027 10.800 2.084 333 HG3 PRO 46 HG1 PRO 46 -6.284 10.486 2.058 334 HD2 PRO 46 HD2 PRO 46 -8.561 8.563 2.168 335 HD3 PRO 46 HD1 PRO 46 -7.011 8.440 1.309 336 H SER 47 H SER 47 -6.355 8.751 7.016 337 HA SER 47 HA SER 47 -8.743 7.308 7.638 338 HB2 SER 47 HB2 SER 47 -7.873 7.671 10.039 339 HB3 SER 47 HB1 SER 47 -6.895 6.700 8.939 340 HG SER 47 HG SER 47 -5.364 8.055 9.371 341 H VAL 48 H VAL 48 -8.145 10.583 7.202 342 HA VAL 48 HA VAL 48 -10.446 11.263 8.904 343 HB VAL 48 HB VAL 48 -9.552 13.615 8.893 344 HG11 VAL 48 HG11 VAL 48 -7.827 11.475 10.133 345 HG12 VAL 48 HG12 VAL 48 -9.294 12.169 10.826 346 HG13 VAL 48 HG13 VAL 48 -7.858 13.171 10.615 347 HG21 VAL 48 HG21 VAL 48 -7.088 12.260 7.802 348 HG22 VAL 48 HG22 VAL 48 -7.168 13.919 8.397 349 HG23 VAL 48 HG23 VAL 48 -8.081 13.452 6.962 350 H GLU 49 H GLU 49 -8.908 11.909 5.763 351 HA GLU 49 HA GLU 49 -11.176 12.047 4.217 352 HB2 GLU 49 HB2 GLU 49 -11.892 13.955 5.595 353 HB3 GLU 49 HB1 GLU 49 -10.388 14.790 5.233 354 HG2 GLU 49 HG2 GLU 49 -11.007 14.895 2.877 355 HG3 GLU 49 HG1 GLU 49 -12.513 14.048 3.232 356 H GLY 50 H GLY 50 -10.570 12.183 2.084 357 HA2 GLY 50 HA2 GLY 50 -8.922 13.828 0.784 358 HA3 GLY 50 HA1 GLY 50 -7.765 12.741 1.535 359 H SER 51 H SER 51 -7.046 12.018 -0.489 360 HA SER 51 HA SER 51 -8.988 10.744 -2.255 361 HB2 SER 51 HB2 SER 51 -7.380 12.305 -3.240 362 HB3 SER 51 HB1 SER 51 -6.035 11.335 -2.641 363 HG SER 51 HG SER 51 -6.410 10.795 -4.775 364 H SER 52 H SER 52 -9.354 8.624 -2.117 365 HA SER 52 HA SER 52 -7.200 6.904 -1.087 366 HB2 SER 52 HB2 SER 52 -10.143 6.222 -1.373 367 HB3 SER 52 HB1 SER 52 -8.911 5.256 -0.560 368 HG SER 52 HG SER 52 -10.374 7.338 0.382 369 H THR 53 H THR 53 -6.379 5.300 -2.342 370 HA THR 53 HA THR 53 -7.664 4.752 -4.911 371 HB THR 53 HB THR 53 -4.834 5.815 -4.752 372 HG1 THR 53 HG1 THR 53 -7.192 7.079 -4.925 373 HG21 THR 53 HG21 THR 53 -5.073 4.158 -6.513 374 HG22 THR 53 HG22 THR 53 -4.914 5.772 -7.207 375 HG23 THR 53 HG23 THR 53 -6.496 4.995 -7.135 376 H GLU 54 H GLU 54 -6.960 2.840 -5.909 377 HA GLU 54 HA GLU 54 -5.152 1.154 -4.347 378 HB2 GLU 54 HB2 GLU 54 -7.517 0.357 -4.459 379 HB3 GLU 54 HB1 GLU 54 -7.360 0.261 -6.207 380 HG2 GLU 54 HG2 GLU 54 -5.511 -1.359 -5.905 381 HG3 GLU 54 HG1 GLU 54 -5.814 -1.325 -4.170 382 H LEU 55 H LEU 55 -3.229 0.955 -5.317 383 HA LEU 55 HA LEU 55 -3.138 1.067 -8.241 384 HB2 LEU 55 HB2 LEU 55 -0.854 1.216 -6.229 385 HB3 LEU 55 HB1 LEU 55 -0.650 1.157 -7.978 386 HG LEU 55 HG LEU 55 -1.859 3.334 -6.325 387 HD11 LEU 55 HD11 LEU 55 0.475 3.561 -6.538 388 HD12 LEU 55 HD12 LEU 55 -0.248 4.710 -7.661 389 HD13 LEU 55 HD13 LEU 55 0.424 3.195 -8.261 390 HD21 LEU 55 HD21 LEU 55 -2.430 4.482 -8.439 391 HD22 LEU 55 HD22 LEU 55 -3.398 3.038 -8.147 392 HD23 LEU 55 HD23 LEU 55 -2.070 2.990 -9.307 393 H ASN 56 H ASN 56 -1.837 -0.514 -9.385 394 HA ASN 56 HA ASN 56 -1.953 -3.140 -8.065 395 HB2 ASN 56 HB2 ASN 56 -3.791 -2.972 -9.663 396 HB3 ASN 56 HB1 ASN 56 -2.676 -2.469 -10.928 397 HD21 ASN 56 HD21 ASN 56 -3.770 -5.112 -8.961 398 HD22 ASN 56 HD22 ASN 56 -3.076 -6.377 -9.914 399 H LEU 57 H LEU 57 0.034 -3.859 -7.812 400 HA LEU 57 HA LEU 57 2.059 -3.079 -9.798 401 HB2 LEU 57 HB2 LEU 57 2.350 -3.704 -6.842 402 HB3 LEU 57 HB1 LEU 57 3.706 -3.583 -7.941 403 HG LEU 57 HG LEU 57 2.038 -1.468 -6.736 404 HD11 LEU 57 HD11 LEU 57 4.160 -0.325 -6.648 405 HD12 LEU 57 HD12 LEU 57 4.903 -1.581 -7.637 406 HD13 LEU 57 HD13 LEU 57 4.324 -1.963 -6.019 407 HD21 LEU 57 HD21 LEU 57 1.521 -1.151 -9.080 408 HD22 LEU 57 HD22 LEU 57 3.241 -1.173 -9.473 409 HD23 LEU 57 HD23 LEU 57 2.577 0.128 -8.483 410 HA PRO 58 HA PRO 58 2.600 -7.341 -10.738 411 HB2 PRO 58 HB2 PRO 58 5.353 -7.429 -10.977 412 HB3 PRO 58 HB1 PRO 58 4.248 -6.919 -12.255 413 HG2 PRO 58 HG2 PRO 58 5.919 -5.282 -10.426 414 HG3 PRO 58 HG1 PRO 58 5.446 -4.969 -12.102 415 HD2 PRO 58 HD2 PRO 58 4.311 -3.730 -9.951 416 HD3 PRO 58 HD1 PRO 58 3.464 -3.989 -11.484 417 H GLU 59 H GLU 59 3.070 -9.194 -9.741 418 HA GLU 59 HA GLU 59 3.155 -9.548 -7.064 419 HB2 GLU 59 HB2 GLU 59 4.099 -11.822 -7.548 420 HB3 GLU 59 HB1 GLU 59 2.707 -11.380 -8.528 421 HG2 GLU 59 HG2 GLU 59 4.120 -10.886 -10.406 422 HG3 GLU 59 HG1 GLU 59 5.566 -11.142 -9.432 423 H THR 60 H THR 60 5.875 -8.759 -9.031 424 HA THR 60 HA THR 60 7.744 -9.504 -6.904 425 HB THR 60 HB THR 60 8.177 -10.515 -9.078 426 HG1 THR 60 HG1 THR 60 10.233 -10.300 -8.692 427 HG21 THR 60 HG21 THR 60 8.874 -9.101 -10.988 428 HG22 THR 60 HG22 THR 60 8.382 -7.678 -10.072 429 HG23 THR 60 HG23 THR 60 7.182 -8.884 -10.539 430 H ALA 61 H ALA 61 6.029 -6.886 -7.600 431 HA ALA 61 HA ALA 61 8.072 -4.852 -7.666 432 HB1 ALA 61 HB1 ALA 61 5.892 -4.398 -8.641 433 HB2 ALA 61 HB2 ALA 61 6.203 -3.283 -7.310 434 HB3 ALA 61 HB3 ALA 61 5.120 -4.655 -7.079 435 H ASN 62 H ASN 62 8.351 -3.257 -5.918 436 HA ASN 62 HA ASN 62 7.686 -4.302 -3.267 437 HB2 ASN 62 HB2 ASN 62 9.943 -4.170 -2.458 438 HB3 ASN 62 HB1 ASN 62 9.917 -5.200 -3.882 439 HD21 ASN 62 HD21 ASN 62 12.096 -3.708 -2.644 440 HD22 ASN 62 HD22 ASN 62 12.731 -2.679 -3.879 441 H SER 63 H SER 63 7.122 -1.808 -5.036 442 HA SER 63 HA SER 63 7.012 -0.028 -2.821 443 HB2 SER 63 HB2 SER 63 8.519 1.741 -3.849 444 HB3 SER 63 HB1 SER 63 9.351 0.329 -3.196 445 HG SER 63 HG SER 63 8.744 -0.149 -5.743 446 H VAL 64 H VAL 64 5.443 1.440 -3.142 447 HA VAL 64 HA VAL 64 4.527 1.903 -5.912 448 HB VAL 64 HB VAL 64 2.738 0.737 -4.782 449 HG11 VAL 64 HG11 VAL 64 2.275 2.763 -2.735 450 HG12 VAL 64 HG12 VAL 64 3.692 1.743 -2.494 451 HG13 VAL 64 HG13 VAL 64 2.106 1.008 -2.678 452 HG21 VAL 64 HG21 VAL 64 2.108 3.643 -4.891 453 HG22 VAL 64 HG22 VAL 64 0.959 2.305 -4.914 454 HG23 VAL 64 HG23 VAL 64 2.094 2.512 -6.243 455 H THR 65 H THR 65 4.427 3.961 -6.613 456 HA THR 65 HA THR 65 4.832 6.143 -4.739 457 HB THR 65 HB THR 65 4.729 5.955 -7.740 458 HG1 THR 65 HG1 THR 65 6.630 5.120 -6.959 459 HG21 THR 65 HG21 THR 65 5.539 8.294 -7.761 460 HG22 THR 65 HG22 THR 65 5.344 8.365 -6.009 461 HG23 THR 65 HG23 THR 65 3.932 8.165 -7.047 462 H LEU 66 H LEU 66 2.948 6.515 -3.731 463 HA LEU 66 HA LEU 66 0.379 6.459 -5.035 464 HB2 LEU 66 HB2 LEU 66 0.579 7.845 -2.477 465 HB3 LEU 66 HB1 LEU 66 -0.488 6.545 -2.965 466 HG LEU 66 HG LEU 66 2.370 5.958 -2.345 467 HD11 LEU 66 HD11 LEU 66 0.230 5.880 -0.284 468 HD12 LEU 66 HD12 LEU 66 1.234 7.306 -0.528 469 HD13 LEU 66 HD13 LEU 66 1.983 5.774 -0.098 470 HD21 LEU 66 HD21 LEU 66 -0.221 4.449 -2.251 471 HD22 LEU 66 HD22 LEU 66 1.326 3.802 -1.694 472 HD23 LEU 66 HD23 LEU 66 1.101 4.217 -3.397 473 H SER 67 H SER 67 -0.923 8.315 -5.428 474 HA SER 67 HA SER 67 0.465 10.874 -5.313 475 HB2 SER 67 HB2 SER 67 0.986 9.729 -7.518 476 HB3 SER 67 HB1 SER 67 -0.728 9.869 -7.900 477 HG SER 67 HG SER 67 1.161 11.681 -8.231 478 H ASP 68 H ASP 68 -1.059 12.605 -6.264 479 HA ASP 68 HA ASP 68 -2.957 13.806 -6.070 480 HB2 ASP 68 HB2 ASP 68 -4.241 11.089 -6.360 481 HB3 ASP 68 HB1 ASP 68 -5.149 12.598 -6.329 482 H LEU 69 H LEU 69 -1.600 12.700 -3.692 483 HA LEU 69 HA LEU 69 -3.629 12.251 -1.721 484 HB2 LEU 69 HB2 LEU 69 -0.909 13.287 -1.007 485 HB3 LEU 69 HB1 LEU 69 -1.961 12.205 -0.115 486 HG LEU 69 HG LEU 69 -0.400 11.437 -2.573 487 HD11 LEU 69 HD11 LEU 69 0.942 10.157 -0.992 488 HD12 LEU 69 HD12 LEU 69 0.015 10.834 0.348 489 HD13 LEU 69 HD13 LEU 69 1.017 11.885 -0.652 490 HD21 LEU 69 HD21 LEU 69 -1.074 9.127 -1.563 491 HD22 LEU 69 HD22 LEU 69 -2.265 10.024 -2.515 492 HD23 LEU 69 HD23 LEU 69 -2.336 10.064 -0.750 493 H GLN 70 H GLN 70 -3.241 13.836 0.354 494 HA GLN 70 HA GLN 70 -3.446 16.596 -0.616 495 HB2 GLN 70 HB2 GLN 70 -5.717 15.675 -0.196 496 HB3 GLN 70 HB1 GLN 70 -5.245 15.321 1.461 497 HG2 GLN 70 HG2 GLN 70 -6.558 17.350 1.357 498 HG3 GLN 70 HG1 GLN 70 -4.911 17.705 1.876 499 HE21 GLN 70 HE21 GLN 70 -5.028 19.839 1.244 500 HE22 GLN 70 HE22 GLN 70 -5.036 20.321 -0.419 501 HA PRO 71 HA PRO 71 -0.197 16.973 2.415 502 HB2 PRO 71 HB2 PRO 71 -0.168 19.708 2.504 503 HB3 PRO 71 HB1 PRO 71 0.642 18.727 1.281 504 HG2 PRO 71 HG2 PRO 71 -1.986 20.142 1.137 505 HG3 PRO 71 HG1 PRO 71 -0.718 20.002 -0.094 506 HD2 PRO 71 HD2 PRO 71 -2.951 18.505 -0.175 507 HD3 PRO 71 HD1 PRO 71 -1.380 17.875 -0.715 508 H GLY 72 H GLY 72 -0.212 16.936 4.568 509 HA2 GLY 72 HA2 GLY 72 -0.756 17.607 6.741 510 HA3 GLY 72 HA1 GLY 72 -2.015 18.644 6.085 511 H VAL 73 H VAL 73 -1.741 15.337 5.091 512 HA VAL 73 HA VAL 73 -4.088 14.631 6.727 513 HB VAL 73 HB VAL 73 -3.740 14.104 3.769 514 HG11 VAL 73 HG11 VAL 73 -6.150 13.295 4.069 515 HG12 VAL 73 HG12 VAL 73 -5.698 13.064 5.763 516 HG13 VAL 73 HG13 VAL 73 -4.825 12.203 4.489 517 HG21 VAL 73 HG21 VAL 73 -6.037 15.256 3.791 518 HG22 VAL 73 HG22 VAL 73 -4.572 16.246 3.853 519 HG23 VAL 73 HG23 VAL 73 -5.497 15.938 5.328 520 H GLN 74 H GLN 74 -4.229 12.514 7.376 521 HA GLN 74 HA GLN 74 -1.730 11.067 7.415 522 HB2 GLN 74 HB2 GLN 74 -2.985 11.441 9.457 523 HB3 GLN 74 HB1 GLN 74 -4.400 10.686 8.742 524 HG2 GLN 74 HG2 GLN 74 -3.593 8.971 10.034 525 HG3 GLN 74 HG1 GLN 74 -2.780 8.633 8.505 526 HE21 GLN 74 HE21 GLN 74 -0.553 9.070 8.315 527 HE22 GLN 74 HE22 GLN 74 0.443 9.299 9.710 528 H TYR 75 H TYR 75 -1.364 9.807 5.671 529 HA TYR 75 HA TYR 75 -3.639 8.461 4.425 530 HB2 TYR 75 HB2 TYR 75 -0.951 9.328 3.474 531 HB3 TYR 75 HB1 TYR 75 -1.692 7.924 2.699 532 HD1 TYR 75 HD1 TYR 75 -2.093 11.538 3.361 533 HD2 TYR 75 HD2 TYR 75 -3.582 8.147 1.275 534 HE1 TYR 75 HE1 TYR 75 -3.529 13.004 2.003 535 HE2 TYR 75 HE2 TYR 75 -5.013 9.603 -0.085 536 HH TYR 75 HH TYR 75 -4.696 12.987 -0.154 537 H ASN 76 H ASN 76 -4.057 6.465 4.889 538 HA ASN 76 HA ASN 76 -2.018 4.744 6.069 539 HB2 ASN 76 HB2 ASN 76 -4.961 4.205 5.582 540 HB3 ASN 76 HB1 ASN 76 -3.865 3.202 6.523 541 HD21 ASN 76 HD21 ASN 76 -3.301 3.826 8.584 542 HD22 ASN 76 HD22 ASN 76 -4.100 5.110 9.424 543 H ILE 77 H ILE 77 -0.744 3.778 4.609 544 HA ILE 77 HA ILE 77 -1.849 2.940 2.044 545 HB ILE 77 HB ILE 77 0.984 2.761 3.074 546 HG12 ILE 77 HG12 ILE 77 1.249 4.422 1.097 547 HG13 ILE 77 HG11 ILE 77 -0.434 4.780 1.390 548 HG21 ILE 77 HG21 ILE 77 1.046 1.124 1.491 549 HG22 ILE 77 HG22 ILE 77 1.322 2.553 0.476 550 HG23 ILE 77 HG23 ILE 77 -0.285 1.834 0.568 551 HD11 ILE 77 HD11 ILE 77 1.804 5.043 3.384 552 HD12 ILE 77 HD12 ILE 77 0.102 5.382 3.703 553 HD13 ILE 77 HD13 ILE 77 0.994 6.359 2.535 554 H THR 78 H THR 78 -2.745 1.069 1.889 555 HA THR 78 HA THR 78 -1.870 -1.076 3.660 556 HB THR 78 HB THR 78 -4.449 -0.719 2.145 557 HG1 THR 78 HG1 THR 78 -4.490 -0.782 4.908 558 HG21 THR 78 HG21 THR 78 -3.648 -2.779 4.207 559 HG22 THR 78 HG22 THR 78 -3.878 -3.082 2.485 560 HG23 THR 78 HG23 THR 78 -5.248 -2.614 3.490 561 H ILE 79 H ILE 79 -0.586 -2.540 2.749 562 HA ILE 79 HA ILE 79 -0.624 -2.812 -0.192 563 HB ILE 79 HB ILE 79 1.356 -4.214 1.613 564 HG12 ILE 79 HG12 ILE 79 1.897 -1.941 2.044 565 HG13 ILE 79 HG11 ILE 79 3.013 -2.509 0.802 566 HG21 ILE 79 HG21 ILE 79 1.230 -3.615 -1.311 567 HG22 ILE 79 HG22 ILE 79 1.343 -5.187 -0.509 568 HG23 ILE 79 HG23 ILE 79 2.723 -4.078 -0.497 569 HD11 ILE 79 HD11 ILE 79 1.930 -0.185 0.616 570 HD12 ILE 79 HD12 ILE 79 0.538 -1.077 0.002 571 HD13 ILE 79 HD13 ILE 79 2.102 -1.205 -0.820 572 H TYR 80 H TYR 80 -1.118 -4.685 -1.207 573 HA TYR 80 HA TYR 80 -1.968 -6.969 0.450 574 HB2 TYR 80 HB2 TYR 80 -3.281 -6.017 -2.107 575 HB3 TYR 80 HB1 TYR 80 -3.798 -7.363 -1.108 576 HD1 TYR 80 HD1 TYR 80 -4.965 -6.971 0.991 577 HD2 TYR 80 HD2 TYR 80 -3.833 -3.710 -1.521 578 HE1 TYR 80 HE1 TYR 80 -6.554 -5.516 2.167 579 HE2 TYR 80 HE2 TYR 80 -5.418 -2.261 -0.337 580 HH TYR 80 HH TYR 80 -6.916 -3.132 2.591 581 H ALA 81 H ALA 81 -0.395 -8.495 0.003 582 HA ALA 81 HA ALA 81 0.542 -8.902 -2.705 583 HB1 ALA 81 HB1 ALA 81 1.510 -11.056 -1.752 584 HB2 ALA 81 HB2 ALA 81 0.853 -10.558 -0.177 585 HB3 ALA 81 HB3 ALA 81 2.076 -9.568 -0.973 586 H VAL 82 H VAL 82 -0.658 -9.880 -4.210 587 HA VAL 82 HA VAL 82 -2.947 -11.484 -3.227 588 HB VAL 82 HB VAL 82 -3.710 -9.582 -4.552 589 HG11 VAL 82 HG11 VAL 82 -1.799 -9.208 -5.966 590 HG12 VAL 82 HG12 VAL 82 -3.259 -9.407 -6.935 591 HG13 VAL 82 HG13 VAL 82 -2.101 -10.731 -6.802 592 HG21 VAL 82 HG21 VAL 82 -5.095 -10.769 -6.161 593 HG22 VAL 82 HG22 VAL 82 -4.982 -11.669 -4.648 594 HG23 VAL 82 HG23 VAL 82 -4.029 -12.170 -6.050 595 H GLU 83 H GLU 83 -3.176 -13.549 -3.799 596 HA GLU 83 HA GLU 83 -1.056 -14.661 -5.507 597 HB2 GLU 83 HB2 GLU 83 -2.603 -16.400 -3.628 598 HB3 GLU 83 HB1 GLU 83 -0.966 -16.555 -4.230 599 HG2 GLU 83 HG2 GLU 83 -0.665 -16.103 -2.012 600 HG3 GLU 83 HG1 GLU 83 -0.413 -14.562 -2.812 601 H GLU 84 H GLU 84 -1.752 -16.838 -6.400 602 HA GLU 84 HA GLU 84 -3.357 -16.427 -8.534 603 HB2 GLU 84 HB2 GLU 84 -2.987 -19.089 -7.156 604 HB3 GLU 84 HB1 GLU 84 -3.348 -18.827 -8.857 605 HG2 GLU 84 HG2 GLU 84 -1.201 -17.827 -9.225 606 HG3 GLU 84 HG1 GLU 84 -0.844 -17.858 -7.502 607 H ASN 85 H ASN 85 -4.427 -17.892 -5.455 608 HA ASN 85 HA ASN 85 -7.190 -17.604 -6.445 609 HB2 ASN 85 HB2 ASN 85 -6.087 -19.855 -4.752 610 HB3 ASN 85 HB1 ASN 85 -7.776 -19.657 -5.199 611 HD21 ASN 85 HD21 ASN 85 -4.615 -20.561 -6.266 612 HD22 ASN 85 HD22 ASN 85 -5.092 -21.223 -7.793 613 H GLN 86 H GLN 86 -5.218 -16.182 -4.341 614 HA GLN 86 HA GLN 86 -7.297 -15.798 -2.343 615 HB2 GLN 86 HB2 GLN 86 -4.590 -16.948 -1.671 616 HB3 GLN 86 HB1 GLN 86 -5.657 -16.225 -0.478 617 HG2 GLN 86 HG2 GLN 86 -7.349 -17.906 -0.951 618 HG3 GLN 86 HG1 GLN 86 -6.305 -18.620 -2.179 619 HE21 GLN 86 HE21 GLN 86 -5.067 -17.348 0.817 620 HE22 GLN 86 HE22 GLN 86 -4.636 -18.866 1.510 621 H GLU 87 H GLU 87 -6.390 -14.290 -0.556 622 HA GLU 87 HA GLU 87 -4.536 -12.289 -1.658 623 HB2 GLU 87 HB2 GLU 87 -7.130 -11.710 -0.203 624 HB3 GLU 87 HB1 GLU 87 -5.957 -10.507 -0.712 625 HG2 GLU 87 HG2 GLU 87 -6.421 -10.918 -3.011 626 HG3 GLU 87 HG1 GLU 87 -7.417 -12.319 -2.615 627 H SER 88 H SER 88 -2.904 -11.932 -0.250 628 HA SER 88 HA SER 88 -2.873 -13.213 2.289 629 HB2 SER 88 HB2 SER 88 -0.658 -12.189 2.558 630 HB3 SER 88 HB1 SER 88 -0.834 -12.877 0.943 631 HG SER 88 HG SER 88 -1.193 -10.826 0.132 632 H THR 89 H THR 89 -2.182 -12.003 4.309 633 HA THR 89 HA THR 89 -4.125 -10.150 5.114 634 HB THR 89 HB THR 89 -2.532 -9.708 7.054 635 HG1 THR 89 HG1 THR 89 -0.950 -11.305 5.405 636 HG21 THR 89 HG21 THR 89 -4.311 -11.355 7.206 637 HG22 THR 89 HG22 THR 89 -2.862 -11.948 8.017 638 HG23 THR 89 HG23 THR 89 -3.291 -12.559 6.420 639 HA PRO 90 HA PRO 90 -2.551 -6.385 3.563 640 HB2 PRO 90 HB2 PRO 90 -3.791 -4.598 5.116 641 HB3 PRO 90 HB1 PRO 90 -4.688 -5.668 4.033 642 HG2 PRO 90 HG2 PRO 90 -4.272 -5.880 6.987 643 HG3 PRO 90 HG1 PRO 90 -5.732 -6.197 6.035 644 HD2 PRO 90 HD2 PRO 90 -3.990 -8.121 6.951 645 HD3 PRO 90 HD1 PRO 90 -5.101 -8.329 5.585 646 H VAL 91 H VAL 91 -0.852 -5.096 3.684 647 HA VAL 91 HA VAL 91 0.650 -4.506 6.100 648 HB VAL 91 HB VAL 91 0.735 -3.516 3.255 649 HG11 VAL 91 HG11 VAL 91 2.474 -2.582 5.531 650 HG12 VAL 91 HG12 VAL 91 1.158 -1.656 4.815 651 HG13 VAL 91 HG13 VAL 91 2.568 -2.066 3.850 652 HG21 VAL 91 HG21 VAL 91 2.792 -4.965 4.911 653 HG22 VAL 91 HG22 VAL 91 2.944 -4.490 3.216 654 HG23 VAL 91 HG23 VAL 91 1.752 -5.704 3.691 655 H VAL 92 H VAL 92 0.062 -2.779 7.447 656 HA VAL 92 HA VAL 92 -1.383 -0.576 6.126 657 HB VAL 92 HB VAL 92 -1.757 -1.165 9.051 658 HG11 VAL 92 HG11 VAL 92 -2.368 1.049 8.266 659 HG12 VAL 92 HG12 VAL 92 -3.813 0.139 8.706 660 HG13 VAL 92 HG13 VAL 92 -3.383 0.345 7.008 661 HG21 VAL 92 HG21 VAL 92 -2.459 -3.185 7.882 662 HG22 VAL 92 HG22 VAL 92 -3.450 -2.224 6.785 663 HG23 VAL 92 HG23 VAL 92 -3.861 -2.310 8.498 664 H ILE 93 H ILE 93 0.093 0.951 5.873 665 HA ILE 93 HA ILE 93 1.710 1.723 8.213 666 HB ILE 93 HB ILE 93 3.419 2.570 6.493 667 HG12 ILE 93 HG12 ILE 93 2.157 0.520 4.696 668 HG13 ILE 93 HG11 ILE 93 1.777 2.218 4.571 669 HG21 ILE 93 HG21 ILE 93 2.979 -0.396 6.811 670 HG22 ILE 93 HG22 ILE 93 3.844 0.662 7.926 671 HG23 ILE 93 HG23 ILE 93 4.489 0.368 6.312 672 HD11 ILE 93 HD11 ILE 93 4.190 2.683 4.275 673 HD12 ILE 93 HD12 ILE 93 3.451 1.723 2.975 674 HD13 ILE 93 HD13 ILE 93 4.451 0.935 4.200 675 H GLN 94 H GLN 94 1.030 3.639 8.938 676 HA GLN 94 HA GLN 94 -0.303 5.423 7.041 677 HB2 GLN 94 HB2 GLN 94 -1.214 6.572 9.019 678 HB3 GLN 94 HB1 GLN 94 -1.638 4.869 8.967 679 HG2 GLN 94 HG2 GLN 94 0.079 4.379 10.620 680 HG3 GLN 94 HG1 GLN 94 0.538 6.081 10.653 681 HE21 GLN 94 HE21 GLN 94 -1.901 3.755 11.497 682 HE22 GLN 94 HE22 GLN 94 -2.760 4.763 12.610 683 H GLN 95 H GLN 95 0.621 7.152 6.312 684 HA GLN 95 HA GLN 95 2.635 8.525 7.952 685 HB2 GLN 95 HB2 GLN 95 3.103 7.180 5.511 686 HB3 GLN 95 HB1 GLN 95 3.127 8.893 5.133 687 HG2 GLN 95 HG2 GLN 95 4.808 7.491 7.199 688 HG3 GLN 95 HG1 GLN 95 5.354 8.092 5.637 689 HE21 GLN 95 HE21 GLN 95 3.730 10.542 5.878 690 HE22 GLN 95 HE22 GLN 95 4.573 11.543 7.006 691 H GLU 96 H GLU 96 2.136 10.622 8.245 692 HA GLU 96 HA GLU 96 -0.073 11.738 6.735 693 HB2 GLU 96 HB2 GLU 96 -0.046 12.060 9.154 694 HB3 GLU 96 HB1 GLU 96 1.497 12.898 9.045 695 HG2 GLU 96 HG2 GLU 96 0.518 14.742 7.942 696 HG3 GLU 96 HG1 GLU 96 -0.979 13.861 7.645 697 H THR 97 H THR 97 0.083 13.103 5.164 698 HA THR 97 HA THR 97 2.474 13.412 3.763 699 HB THR 97 HB THR 97 1.125 15.084 2.421 700 HG1 THR 97 HG1 THR 97 -1.271 14.529 3.300 701 HG21 THR 97 HG21 THR 97 1.200 12.670 1.890 702 HG22 THR 97 HG22 THR 97 -0.373 13.380 1.518 703 HG23 THR 97 HG23 THR 97 -0.165 12.406 2.974 704 H THR 98 H THR 98 4.124 14.655 4.202 705 HA THR 98 HA THR 98 4.101 16.728 6.129 706 HB THR 98 HB THR 98 6.219 16.247 4.033 707 HG1 THR 98 HG1 THR 98 5.736 14.860 6.487 708 HG21 THR 98 HG21 THR 98 7.744 17.029 5.796 709 HG22 THR 98 HG22 THR 98 6.370 17.272 6.874 710 HG23 THR 98 HG23 THR 98 6.526 18.245 5.413 711 H GLY 99 H GLY 99 3.855 16.601 2.656 712 HA2 GLY 99 HA2 GLY 99 2.605 18.343 1.536 713 HA3 GLY 99 HA1 GLY 99 3.314 19.494 2.645 714 H THR 100 H THR 100 3.710 20.509 0.437 715 HA THR 100 HA THR 100 5.886 19.476 -1.101 716 HB THR 100 HB THR 100 4.822 22.306 -0.998 717 HG1 THR 100 HG1 THR 100 3.888 19.956 -2.181 718 HG21 THR 100 HG21 THR 100 5.744 22.502 -3.231 719 HG22 THR 100 HG22 THR 100 6.395 20.868 -3.115 720 HG23 THR 100 HG23 THR 100 6.997 22.137 -2.050 721 HA PRO 101 HA PRO 101 8.998 20.419 1.938 722 HB2 PRO 101 HB2 PRO 101 10.790 20.296 -0.428 723 HB3 PRO 101 HB1 PRO 101 10.890 19.430 1.108 724 HG2 PRO 101 HG2 PRO 101 10.090 18.188 -1.102 725 HG3 PRO 101 HG1 PRO 101 9.329 17.841 0.461 726 HD2 PRO 101 HD2 PRO 101 8.318 19.494 -1.816 727 HD3 PRO 101 HD1 PRO 101 7.434 18.400 -0.732 728 H ARG 102 H ARG 102 8.376 22.556 2.315 729 HA ARG 102 HA ARG 102 9.480 24.695 0.704 730 HB2 ARG 102 HB2 ARG 102 7.294 24.974 1.758 731 HB3 ARG 102 HB1 ARG 102 7.993 24.681 3.340 732 HG2 ARG 102 HG2 ARG 102 9.300 26.742 3.139 733 HG3 ARG 102 HG1 ARG 102 8.570 27.039 1.559 734 HD2 ARG 102 HD2 ARG 102 6.373 27.172 2.555 735 HD3 ARG 102 HD1 ARG 102 7.029 26.744 4.133 736 HE ARG 102 HE ARG 102 8.377 29.017 3.362 737 HH11 ARG 102 HH11 ARG 102 5.050 28.098 3.925 738 HH12 ARG 102 HH12 ARG 102 4.551 29.684 4.419 739 HH21 ARG 102 HH21 ARG 102 7.733 31.116 4.039 740 HH22 ARG 102 HH22 ARG 102 6.081 31.402 4.477 741 H SER 103 H SER 103 10.100 22.975 3.664 742 HA SER 103 HA SER 103 12.461 24.597 4.224 743 HB2 SER 103 HB2 SER 103 10.989 24.032 6.120 744 HB3 SER 103 HB1 SER 103 11.213 22.318 5.784 745 HG SER 103 HG SER 103 12.608 22.950 7.429 746 H ASP 104 H ASP 104 14.527 23.720 4.240 747 HA ASP 104 HA ASP 104 14.820 21.036 3.084 748 HB2 ASP 104 HB2 ASP 104 16.558 21.814 1.582 749 HB3 ASP 104 HB1 ASP 104 15.092 22.746 1.303 750 H GLY 105 H GLY 105 15.336 22.828 5.680 751 HA2 GLY 105 HA2 GLY 105 17.461 21.161 6.632 752 HA3 GLY 105 HA1 GLY 105 17.985 22.816 6.362 753 H THR 106 H THR 106 14.749 21.987 7.393 754 HA THR 106 HA THR 106 15.317 22.453 10.182 755 HB THR 106 HB THR 106 13.590 24.419 8.655 756 HG1 THR 106 HG1 THR 106 16.206 24.407 9.326 757 HG21 THR 106 HG21 THR 106 13.260 25.525 10.820 758 HG22 THR 106 HG22 THR 106 14.159 24.235 11.619 759 HG23 THR 106 HG23 THR 106 12.617 23.883 10.841 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 6.709 -31.371 0.977 2 H2 GLY 1 HT2 GLY 1 7.981 -32.301 0.368 3 H3 GLY 1 HT3 GLY 1 8.203 -30.650 0.656 4 HA2 GLY 1 HA1 GLY 1 9.249 -31.959 2.385 5 HA3 GLY 1 HA2 GLY 1 7.935 -30.978 3.017 6 H SER 2 H SER 2 7.996 -32.558 4.797 7 HA SER 2 HA SER 2 6.567 -35.039 4.090 8 HB2 SER 2 HB2 SER 2 8.405 -34.618 6.457 9 HB3 SER 2 HB1 SER 2 7.666 -36.135 5.947 10 HG SER 2 HG SER 2 9.230 -36.400 4.582 11 H HIS 3 H HIS 3 4.632 -33.663 4.301 12 HA HIS 3 HA HIS 3 3.757 -33.577 7.096 13 HB2 HIS 3 HB2 HIS 3 3.693 -31.305 5.139 14 HB3 HIS 3 HB1 HIS 3 2.450 -31.429 6.377 15 HD1 HIS 3 HD1 HIS 3 3.012 -30.549 8.631 16 HD2 HIS 3 HD2 HIS 3 6.387 -31.044 6.257 17 HE1 HIS 3 HE1 HIS 3 4.907 -29.553 9.941 18 HE2 HIS 3 HE2 HIS 3 6.908 -29.717 8.417 19 H MET 4 H MET 4 2.165 -34.987 7.201 20 HA MET 4 HA MET 4 0.440 -35.654 5.033 21 HB2 MET 4 HB2 MET 4 0.077 -36.136 8.003 22 HB3 MET 4 HB1 MET 4 -0.843 -36.908 6.721 23 HG2 MET 4 HG2 MET 4 2.113 -37.209 7.196 24 HG3 MET 4 HG1 MET 4 0.870 -38.384 7.616 25 HE1 MET 4 HE1 MET 4 -0.542 -39.739 5.876 26 HE2 MET 4 HE2 MET 4 -0.399 -39.566 4.128 27 HE3 MET 4 HE3 MET 4 -1.084 -38.257 5.089 28 H GLY 5 H GLY 5 -0.874 -34.130 4.230 29 HA2 GLY 5 HA2 GLY 5 -2.681 -32.638 4.255 30 HA3 GLY 5 HA1 GLY 5 -2.643 -32.664 6.017 31 H THR 6 H THR 6 -0.516 -31.763 3.337 32 HA THR 6 HA THR 6 1.062 -29.970 4.802 33 HB THR 6 HB THR 6 0.567 -29.912 1.822 34 HG1 THR 6 HG1 THR 6 1.514 -31.907 3.275 35 HG21 THR 6 HG21 THR 6 2.950 -29.068 3.479 36 HG22 THR 6 HG22 THR 6 1.808 -27.981 2.689 37 HG23 THR 6 HG23 THR 6 2.850 -29.022 1.719 38 H THR 7 H THR 7 0.646 -28.002 5.526 39 HA THR 7 HA THR 7 -1.747 -26.609 4.705 40 HB THR 7 HB THR 7 -1.132 -26.622 7.077 41 HG1 THR 7 HG1 THR 7 -2.143 -24.772 6.986 42 HG21 THR 7 HG21 THR 7 1.309 -25.063 6.217 43 HG22 THR 7 HG22 THR 7 1.300 -26.707 6.854 44 HG23 THR 7 HG23 THR 7 0.811 -25.360 7.883 45 H THR 8 H THR 8 -1.774 -24.517 3.781 46 HA THR 8 HA THR 8 0.738 -23.368 2.898 47 HB THR 8 HB THR 8 -1.421 -23.992 0.870 48 HG1 THR 8 HG1 THR 8 0.739 -25.447 1.790 49 HG21 THR 8 HG21 THR 8 1.386 -22.930 0.517 50 HG22 THR 8 HG22 THR 8 -0.074 -21.945 0.472 51 HG23 THR 8 HG23 THR 8 0.189 -23.186 -0.754 52 H ALA 9 H ALA 9 0.647 -21.315 3.369 53 HA ALA 9 HA ALA 9 -1.763 -19.751 2.922 54 HB1 ALA 9 HB1 ALA 9 -2.030 -20.586 5.219 55 HB2 ALA 9 HB2 ALA 9 -1.784 -18.840 5.188 56 HB3 ALA 9 HB3 ALA 9 -0.458 -19.909 5.642 57 HA PRO 10 HA PRO 10 1.613 -17.226 1.562 58 HB2 PRO 10 HB2 PRO 10 0.195 -15.048 0.801 59 HB3 PRO 10 HB1 PRO 10 0.246 -16.546 -0.139 60 HG2 PRO 10 HG2 PRO 10 -1.858 -15.574 1.764 61 HG3 PRO 10 HG1 PRO 10 -2.056 -16.340 0.177 62 HD2 PRO 10 HD2 PRO 10 -2.332 -17.706 2.493 63 HD3 PRO 10 HD1 PRO 10 -1.742 -18.452 1.038 64 H ASP 11 H ASP 11 2.961 -15.973 2.617 65 HA ASP 11 HA ASP 11 2.093 -14.514 4.956 66 HB2 ASP 11 HB2 ASP 11 4.533 -13.953 5.160 67 HB3 ASP 11 HB1 ASP 11 4.182 -15.675 5.170 68 H ALA 12 H ALA 12 2.463 -12.258 5.218 69 HA ALA 12 HA ALA 12 2.133 -10.735 2.723 70 HB1 ALA 12 HB1 ALA 12 0.487 -10.394 4.514 71 HB2 ALA 12 HB2 ALA 12 1.413 -8.921 4.219 72 HB3 ALA 12 HB3 ALA 12 1.778 -9.927 5.621 73 HA PRO 13 HA PRO 13 6.208 -8.940 3.124 74 HB2 PRO 13 HB2 PRO 13 5.127 -6.269 2.531 75 HB3 PRO 13 HB1 PRO 13 6.244 -7.256 1.583 76 HG2 PRO 13 HG2 PRO 13 3.733 -6.840 0.767 77 HG3 PRO 13 HG1 PRO 13 4.531 -8.408 0.527 78 HD2 PRO 13 HD2 PRO 13 2.602 -7.575 2.662 79 HD3 PRO 13 HD1 PRO 13 2.591 -9.052 1.667 80 HA PRO 14 HA PRO 14 6.261 -7.416 7.390 81 HB2 PRO 14 HB2 PRO 14 8.998 -6.733 6.396 82 HB3 PRO 14 HB1 PRO 14 8.518 -7.494 7.917 83 HG2 PRO 14 HG2 PRO 14 9.537 -8.947 5.931 84 HG3 PRO 14 HG1 PRO 14 8.223 -9.572 6.941 85 HD2 PRO 14 HD2 PRO 14 8.149 -8.581 4.142 86 HD3 PRO 14 HD1 PRO 14 7.147 -9.810 4.934 87 H ASP 15 H ASP 15 6.241 -5.428 8.321 88 HA ASP 15 HA ASP 15 4.839 -3.512 7.120 89 HB2 ASP 15 HB2 ASP 15 5.452 -3.635 9.548 90 HB3 ASP 15 HB1 ASP 15 6.969 -2.840 9.145 91 HA PRO 16 HA PRO 16 7.719 -1.978 4.010 92 HB2 PRO 16 HB2 PRO 16 5.256 -0.576 3.149 93 HB3 PRO 16 HB1 PRO 16 6.319 -1.649 2.205 94 HG2 PRO 16 HG2 PRO 16 3.933 -2.500 2.982 95 HG3 PRO 16 HG1 PRO 16 5.335 -3.577 3.098 96 HD2 PRO 16 HD2 PRO 16 4.054 -1.933 5.269 97 HD3 PRO 16 HD1 PRO 16 4.471 -3.670 5.297 98 H THR 17 H THR 17 8.711 -0.060 3.680 99 HA THR 17 HA THR 17 8.048 2.038 5.650 100 HB THR 17 HB THR 17 10.696 1.562 4.265 101 HG1 THR 17 HG1 THR 17 9.584 0.526 6.645 102 HG21 THR 17 HG21 THR 17 10.395 3.839 5.106 103 HG22 THR 17 HG22 THR 17 11.592 2.972 6.068 104 HG23 THR 17 HG23 THR 17 9.960 3.206 6.693 105 H VAL 18 H VAL 18 7.468 3.904 5.049 106 HA VAL 18 HA VAL 18 7.279 4.659 2.288 107 HB VAL 18 HB VAL 18 6.875 6.321 4.782 108 HG11 VAL 18 HG11 VAL 18 5.705 7.895 3.243 109 HG12 VAL 18 HG12 VAL 18 6.327 6.963 1.874 110 HG13 VAL 18 HG13 VAL 18 7.441 7.790 2.967 111 HG21 VAL 18 HG21 VAL 18 4.827 5.153 2.907 112 HG22 VAL 18 HG22 VAL 18 4.528 6.007 4.422 113 HG23 VAL 18 HG23 VAL 18 5.296 4.418 4.438 114 H ASP 19 H ASP 19 8.899 5.255 1.123 115 HA ASP 19 HA ASP 19 11.473 5.756 2.316 116 HB2 ASP 19 HB2 ASP 19 11.310 4.303 0.391 117 HB3 ASP 19 HB1 ASP 19 10.549 5.576 -0.555 118 H GLN 20 H GLN 20 9.200 7.548 0.295 119 HA GLN 20 HA GLN 20 10.491 10.033 1.122 120 HB2 GLN 20 HB2 GLN 20 10.071 9.110 -1.708 121 HB3 GLN 20 HB1 GLN 20 10.155 10.820 -1.311 122 HG2 GLN 20 HG2 GLN 20 12.380 10.620 -0.518 123 HG3 GLN 20 HG1 GLN 20 12.304 8.859 -0.565 124 HE21 GLN 20 HE21 GLN 20 12.587 7.805 -2.482 125 HE22 GLN 20 HE22 GLN 20 13.103 8.580 -3.920 126 H VAL 21 H VAL 21 9.160 11.727 1.351 127 HA VAL 21 HA VAL 21 6.295 11.266 0.839 128 HB VAL 21 HB VAL 21 7.473 12.488 3.336 129 HG11 VAL 21 HG11 VAL 21 4.606 11.866 2.668 130 HG12 VAL 21 HG12 VAL 21 5.329 13.472 2.706 131 HG13 VAL 21 HG13 VAL 21 5.202 12.527 4.189 132 HG21 VAL 21 HG21 VAL 21 6.122 9.823 2.961 133 HG22 VAL 21 HG22 VAL 21 6.615 10.521 4.505 134 HG23 VAL 21 HG23 VAL 21 7.832 10.089 3.303 135 H ASP 22 H ASP 22 5.289 12.917 -0.128 136 HA ASP 22 HA ASP 22 6.371 15.629 0.191 137 HB2 ASP 22 HB2 ASP 22 5.624 14.222 -2.356 138 HB3 ASP 22 HB1 ASP 22 5.434 15.965 -2.237 139 H ASP 23 H ASP 23 4.388 16.914 -1.310 140 HA ASP 23 HA ASP 23 2.204 16.929 0.493 141 HB2 ASP 23 HB2 ASP 23 1.230 18.503 -1.296 142 HB3 ASP 23 HB1 ASP 23 2.710 18.989 -0.487 143 H THR 24 H THR 24 2.147 16.350 -3.011 144 HA THR 24 HA THR 24 -0.354 14.849 -2.639 145 HB THR 24 HB THR 24 -0.763 15.427 -5.021 146 HG1 THR 24 HG1 THR 24 1.420 17.226 -4.846 147 HG21 THR 24 HG21 THR 24 -1.158 17.822 -4.639 148 HG22 THR 24 HG22 THR 24 -0.078 17.780 -3.242 149 HG23 THR 24 HG23 THR 24 -1.593 16.875 -3.214 150 H SER 25 H SER 25 2.046 13.490 -2.157 151 HA SER 25 HA SER 25 2.020 11.303 -3.881 152 HB2 SER 25 HB2 SER 25 4.343 11.592 -4.868 153 HB3 SER 25 HB1 SER 25 3.089 12.627 -5.556 154 HG SER 25 HG SER 25 3.845 14.316 -4.229 155 H ILE 26 H ILE 26 3.091 9.592 -2.995 156 HA ILE 26 HA ILE 26 5.146 10.003 -0.952 157 HB ILE 26 HB ILE 26 2.448 8.770 -0.373 158 HG12 ILE 26 HG12 ILE 26 4.127 10.733 1.183 159 HG13 ILE 26 HG11 ILE 26 2.767 11.155 0.148 160 HG21 ILE 26 HG21 ILE 26 3.316 7.865 1.712 161 HG22 ILE 26 HG22 ILE 26 4.942 8.399 1.280 162 HG23 ILE 26 HG23 ILE 26 4.142 7.142 0.330 163 HD11 ILE 26 HD11 ILE 26 1.294 9.819 1.592 164 HD12 ILE 26 HD12 ILE 26 2.078 11.143 2.454 165 HD13 ILE 26 HD13 ILE 26 2.666 9.490 2.651 166 H VAL 27 H VAL 27 6.328 7.902 -0.518 167 HA VAL 27 HA VAL 27 5.651 5.867 -2.549 168 HB VAL 27 HB VAL 27 8.446 6.637 -1.737 169 HG11 VAL 27 HG11 VAL 27 7.711 4.250 -2.559 170 HG12 VAL 27 HG12 VAL 27 9.203 4.987 -3.158 171 HG13 VAL 27 HG13 VAL 27 7.743 5.022 -4.148 172 HG21 VAL 27 HG21 VAL 27 7.455 8.434 -3.036 173 HG22 VAL 27 HG22 VAL 27 6.962 7.286 -4.281 174 HG23 VAL 27 HG23 VAL 27 8.673 7.590 -3.989 175 H VAL 28 H VAL 28 5.606 3.791 -1.782 176 HA VAL 28 HA VAL 28 6.775 3.391 0.883 177 HB VAL 28 HB VAL 28 4.918 2.540 1.775 178 HG11 VAL 28 HG11 VAL 28 3.584 3.866 -0.536 179 HG12 VAL 28 HG12 VAL 28 4.132 4.639 0.951 180 HG13 VAL 28 HG13 VAL 28 2.840 3.446 1.006 181 HG21 VAL 28 HG21 VAL 28 4.945 0.520 0.525 182 HG22 VAL 28 HG22 VAL 28 4.205 1.334 -0.853 183 HG23 VAL 28 HG23 VAL 28 3.280 1.113 0.634 184 H ARG 29 H ARG 29 7.663 1.353 1.292 185 HA ARG 29 HA ARG 29 8.104 -0.327 -1.099 186 HB2 ARG 29 HB2 ARG 29 10.265 0.457 0.872 187 HB3 ARG 29 HB1 ARG 29 10.467 -0.448 -0.620 188 HG2 ARG 29 HG2 ARG 29 9.899 1.508 -1.924 189 HG3 ARG 29 HG1 ARG 29 9.585 2.426 -0.452 190 HD2 ARG 29 HD2 ARG 29 11.753 3.019 -1.274 191 HD3 ARG 29 HD1 ARG 29 11.955 2.080 0.202 192 HE ARG 29 HE ARG 29 12.460 0.156 -1.299 193 HH11 ARG 29 HH11 ARG 29 12.895 3.442 -2.452 194 HH12 ARG 29 HH12 ARG 29 14.134 3.012 -3.581 195 HH21 ARG 29 HH21 ARG 29 14.105 -0.397 -2.785 196 HH22 ARG 29 HH22 ARG 29 14.827 0.836 -3.772 197 H TRP 30 H TRP 30 7.670 -2.350 -0.732 198 HA TRP 30 HA TRP 30 7.529 -3.299 2.059 199 HB2 TRP 30 HB2 TRP 30 5.791 -4.926 1.225 200 HB3 TRP 30 HB1 TRP 30 5.313 -3.235 1.116 201 HD1 TRP 30 HD1 TRP 30 6.408 -6.132 -1.120 202 HE1 TRP 30 HE1 TRP 30 5.584 -5.679 -3.512 203 HE3 TRP 30 HE3 TRP 30 4.536 -1.468 -0.404 204 HZ2 TRP 30 HZ2 TRP 30 4.244 -3.614 -4.887 205 HZ3 TRP 30 HZ3 TRP 30 3.470 -0.331 -2.302 206 HH2 TRP 30 HH2 TRP 30 3.321 -1.370 -4.480 207 H SER 31 H SER 31 8.312 -5.290 2.615 208 HA SER 31 HA SER 31 10.165 -6.531 0.749 209 HB2 SER 31 HB2 SER 31 10.857 -6.128 3.100 210 HB3 SER 31 HB1 SER 31 9.573 -7.204 3.648 211 HG SER 31 HG SER 31 10.605 -8.918 2.688 212 H ARG 32 H ARG 32 8.844 -7.481 -0.714 213 HA ARG 32 HA ARG 32 6.423 -8.708 -0.397 214 HB2 ARG 32 HB2 ARG 32 7.121 -9.971 -2.553 215 HB3 ARG 32 HB1 ARG 32 7.013 -8.215 -2.587 216 HG2 ARG 32 HG2 ARG 32 9.625 -9.297 -1.851 217 HG3 ARG 32 HG1 ARG 32 9.114 -9.629 -3.505 218 HD2 ARG 32 HD2 ARG 32 8.841 -7.276 -3.932 219 HD3 ARG 32 HD1 ARG 32 9.149 -6.878 -2.238 220 HE ARG 32 HE ARG 32 11.159 -8.028 -4.081 221 HH11 ARG 32 HH11 ARG 32 10.320 -5.932 -1.389 222 HH12 ARG 32 HH12 ARG 32 11.955 -5.426 -1.124 223 HH21 ARG 32 HH21 ARG 32 13.291 -7.340 -3.734 224 HH22 ARG 32 HH22 ARG 32 13.639 -6.217 -2.453 225 HA PRO 33 HA PRO 33 6.838 -12.465 1.642 226 HB2 PRO 33 HB2 PRO 33 4.919 -13.843 -0.041 227 HB3 PRO 33 HB1 PRO 33 4.691 -13.159 1.572 228 HG2 PRO 33 HG2 PRO 33 3.517 -12.152 -0.672 229 HG3 PRO 33 HG1 PRO 33 3.921 -11.168 0.754 230 HD2 PRO 33 HD2 PRO 33 5.389 -11.462 -1.827 231 HD3 PRO 33 HD1 PRO 33 5.084 -10.007 -0.868 232 H GLN 34 H GLN 34 7.193 -14.752 1.613 233 HA GLN 34 HA GLN 34 8.825 -15.739 -0.551 234 HB2 GLN 34 HB2 GLN 34 9.293 -16.330 1.783 235 HB3 GLN 34 HB1 GLN 34 7.735 -17.134 1.901 236 HG2 GLN 34 HG2 GLN 34 8.498 -18.678 0.087 237 HG3 GLN 34 HG1 GLN 34 10.095 -17.940 0.219 238 HE21 GLN 34 HE21 GLN 34 7.749 -19.990 1.733 239 HE22 GLN 34 HE22 GLN 34 8.789 -20.620 2.963 240 H ALA 35 H ALA 35 5.553 -15.758 0.450 241 HA ALA 35 HA ALA 35 4.455 -17.978 -0.808 242 HB1 ALA 35 HB1 ALA 35 3.122 -15.283 -0.728 243 HB2 ALA 35 HB2 ALA 35 3.331 -16.274 0.719 244 HB3 ALA 35 HB3 ALA 35 2.366 -16.878 -0.631 245 HA PRO 36 HA PRO 36 4.876 -16.819 -5.140 246 HB2 PRO 36 HB2 PRO 36 2.843 -18.864 -5.664 247 HB3 PRO 36 HB1 PRO 36 4.524 -18.807 -6.200 248 HG2 PRO 36 HG2 PRO 36 3.641 -20.585 -4.360 249 HG3 PRO 36 HG1 PRO 36 5.291 -19.938 -4.355 250 HD2 PRO 36 HD2 PRO 36 2.948 -19.173 -2.655 251 HD3 PRO 36 HD1 PRO 36 4.661 -19.336 -2.211 252 H ILE 37 H ILE 37 3.864 -14.990 -5.620 253 HA ILE 37 HA ILE 37 0.952 -14.815 -5.210 254 HB ILE 37 HB ILE 37 1.301 -12.381 -4.824 255 HG12 ILE 37 HG12 ILE 37 4.079 -13.158 -5.459 256 HG13 ILE 37 HG11 ILE 37 3.221 -11.667 -5.789 257 HG21 ILE 37 HG21 ILE 37 2.945 -14.041 -2.890 258 HG22 ILE 37 HG22 ILE 37 1.182 -13.976 -2.908 259 HG23 ILE 37 HG23 ILE 37 2.113 -12.509 -2.537 260 HD11 ILE 37 HD11 ILE 37 4.621 -12.494 -3.286 261 HD12 ILE 37 HD12 ILE 37 3.467 -11.165 -3.318 262 HD13 ILE 37 HD13 ILE 37 4.926 -11.090 -4.309 263 H THR 38 H THR 38 -0.199 -13.495 -6.765 264 HA THR 38 HA THR 38 1.014 -13.612 -9.409 265 HB THR 38 HB THR 38 -1.364 -12.983 -10.131 266 HG1 THR 38 HG1 THR 38 -2.730 -12.672 -8.560 267 HG21 THR 38 HG21 THR 38 -0.848 -15.607 -8.775 268 HG22 THR 38 HG22 THR 38 -0.410 -15.179 -10.427 269 HG23 THR 38 HG23 THR 38 -2.104 -15.285 -9.967 270 H GLY 39 H GLY 39 -0.240 -11.255 -7.127 271 HA2 GLY 39 HA2 GLY 39 0.989 -9.148 -8.618 272 HA3 GLY 39 HA1 GLY 39 -0.766 -9.106 -8.676 273 H TYR 40 H TYR 40 -0.197 -6.970 -7.684 274 HA TYR 40 HA TYR 40 -0.596 -7.296 -4.797 275 HB2 TYR 40 HB2 TYR 40 1.443 -5.613 -6.165 276 HB3 TYR 40 HB1 TYR 40 0.610 -4.925 -4.775 277 HD1 TYR 40 HD2 TYR 40 1.981 -8.307 -5.564 278 HD2 TYR 40 HD1 TYR 40 1.876 -5.017 -2.877 279 HE1 TYR 40 HE2 TYR 40 3.526 -9.475 -4.071 280 HE2 TYR 40 HE1 TYR 40 3.390 -6.200 -1.367 281 HH TYR 40 HH TYR 40 5.073 -9.000 -2.317 282 H ARG 41 H ARG 41 -2.325 -6.256 -4.084 283 HA ARG 41 HA ARG 41 -3.349 -4.001 -5.684 284 HB2 ARG 41 HB2 ARG 41 -4.743 -5.003 -3.253 285 HB3 ARG 41 HB1 ARG 41 -5.395 -4.288 -4.727 286 HG2 ARG 41 HG2 ARG 41 -4.115 -7.005 -4.620 287 HG3 ARG 41 HG1 ARG 41 -5.850 -6.751 -4.381 288 HD2 ARG 41 HD2 ARG 41 -4.251 -6.060 -6.842 289 HD3 ARG 41 HD1 ARG 41 -5.399 -7.390 -6.675 290 HE ARG 41 HE ARG 41 -6.420 -4.698 -6.218 291 HH11 ARG 41 HH11 ARG 41 -6.128 -7.442 -8.372 292 HH12 ARG 41 HH12 ARG 41 -7.421 -6.920 -9.405 293 HH21 ARG 41 HH21 ARG 41 -8.107 -4.001 -7.578 294 HH22 ARG 41 HH22 ARG 41 -8.540 -4.968 -8.962 295 H ILE 42 H ILE 42 -3.582 -1.979 -4.704 296 HA ILE 42 HA ILE 42 -2.468 -1.764 -1.983 297 HB ILE 42 HB ILE 42 -1.669 0.095 -4.197 298 HG12 ILE 42 HG12 ILE 42 -0.044 -2.153 -3.038 299 HG13 ILE 42 HG11 ILE 42 -0.889 -2.245 -4.575 300 HG21 ILE 42 HG21 ILE 42 -0.364 -0.373 -1.522 301 HG22 ILE 42 HG22 ILE 42 -1.585 0.866 -1.797 302 HG23 ILE 42 HG23 ILE 42 -0.053 0.936 -2.664 303 HD11 ILE 42 HD11 ILE 42 1.435 -1.781 -4.918 304 HD12 ILE 42 HD12 ILE 42 1.331 -0.369 -3.870 305 HD13 ILE 42 HD13 ILE 42 0.464 -0.390 -5.405 306 H VAL 43 H VAL 43 -4.092 -0.957 -0.801 307 HA VAL 43 HA VAL 43 -5.582 1.286 -2.020 308 HB VAL 43 HB VAL 43 -6.537 -0.634 0.109 309 HG11 VAL 43 HG11 VAL 43 -7.837 1.871 -0.928 310 HG12 VAL 43 HG12 VAL 43 -7.265 1.562 0.713 311 HG13 VAL 43 HG13 VAL 43 -8.627 0.650 0.073 312 HG21 VAL 43 HG21 VAL 43 -7.618 -0.004 -2.626 313 HG22 VAL 43 HG22 VAL 43 -8.265 -1.187 -1.492 314 HG23 VAL 43 HG23 VAL 43 -6.676 -1.438 -2.216 315 H TYR 44 H TYR 44 -4.781 3.091 -1.352 316 HA TYR 44 HA TYR 44 -4.111 3.364 1.475 317 HB2 TYR 44 HB2 TYR 44 -2.842 5.467 0.541 318 HB3 TYR 44 HB1 TYR 44 -2.106 3.875 0.478 319 HD1 TYR 44 HD1 TYR 44 -2.442 2.542 -1.746 320 HD2 TYR 44 HD2 TYR 44 -2.944 6.755 -1.390 321 HE1 TYR 44 HE1 TYR 44 -2.057 2.780 -4.153 322 HE2 TYR 44 HE2 TYR 44 -2.572 7.005 -3.799 323 HH TYR 44 HH TYR 44 -1.440 5.765 -5.615 324 H SER 45 H SER 45 -5.207 4.597 2.655 325 HA SER 45 HA SER 45 -7.032 6.558 1.461 326 HB2 SER 45 HB2 SER 45 -8.205 4.360 1.586 327 HB3 SER 45 HB1 SER 45 -7.947 4.358 3.329 328 HG SER 45 HG SER 45 -9.410 6.295 1.840 329 HA PRO 46 HA PRO 46 -5.913 8.876 5.145 330 HB2 PRO 46 HB2 PRO 46 -8.293 10.432 4.605 331 HB3 PRO 46 HB1 PRO 46 -6.612 10.940 4.594 332 HG2 PRO 46 HG2 PRO 46 -8.071 10.741 2.337 333 HG3 PRO 46 HG1 PRO 46 -6.329 10.419 2.380 334 HD2 PRO 46 HD2 PRO 46 -8.615 8.497 2.320 335 HD3 PRO 46 HD1 PRO 46 -7.041 8.414 1.499 336 H SER 47 H SER 47 -6.723 9.236 7.216 337 HA SER 47 HA SER 47 -8.623 7.253 8.035 338 HB2 SER 47 HB2 SER 47 -7.202 9.335 9.704 339 HB3 SER 47 HB1 SER 47 -7.977 7.861 10.289 340 HG SER 47 HG SER 47 -6.445 6.710 8.924 341 H VAL 48 H VAL 48 -8.708 10.702 7.490 342 HA VAL 48 HA VAL 48 -11.410 10.748 8.668 343 HB VAL 48 HB VAL 48 -9.446 13.021 8.385 344 HG11 VAL 48 HG11 VAL 48 -11.707 13.808 7.983 345 HG12 VAL 48 HG12 VAL 48 -11.117 14.387 9.541 346 HG13 VAL 48 HG13 VAL 48 -12.256 13.042 9.473 347 HG21 VAL 48 HG21 VAL 48 -9.486 13.053 10.826 348 HG22 VAL 48 HG22 VAL 48 -8.937 11.493 10.216 349 HG23 VAL 48 HG23 VAL 48 -10.580 11.672 10.830 350 H GLU 49 H GLU 49 -9.434 11.939 5.963 351 HA GLU 49 HA GLU 49 -11.457 11.686 4.041 352 HB2 GLU 49 HB2 GLU 49 -12.460 13.556 5.385 353 HB3 GLU 49 HB1 GLU 49 -11.065 14.539 4.969 354 HG2 GLU 49 HG2 GLU 49 -11.650 14.343 2.597 355 HG3 GLU 49 HG1 GLU 49 -13.067 13.391 3.038 356 H GLY 50 H GLY 50 -10.676 12.111 1.963 357 HA2 GLY 50 HA2 GLY 50 -8.928 13.847 0.988 358 HA3 GLY 50 HA1 GLY 50 -7.836 12.754 1.823 359 H SER 51 H SER 51 -6.812 12.067 -0.030 360 HA SER 51 HA SER 51 -8.410 10.945 -2.183 361 HB2 SER 51 HB2 SER 51 -5.406 11.327 -1.985 362 HB3 SER 51 HB1 SER 51 -6.319 10.912 -3.439 363 HG SER 51 HG SER 51 -5.853 13.142 -3.347 364 H SER 52 H SER 52 -8.883 8.860 -2.233 365 HA SER 52 HA SER 52 -7.000 6.951 -1.008 366 HB2 SER 52 HB2 SER 52 -9.957 6.516 -1.524 367 HB3 SER 52 HB1 SER 52 -8.862 5.422 -0.671 368 HG SER 52 HG SER 52 -10.032 7.824 0.179 369 H THR 53 H THR 53 -6.236 5.309 -2.263 370 HA THR 53 HA THR 53 -7.351 4.993 -4.943 371 HB THR 53 HB THR 53 -4.493 5.866 -4.476 372 HG1 THR 53 HG1 THR 53 -6.760 7.227 -4.886 373 HG21 THR 53 HG21 THR 53 -4.277 5.850 -6.914 374 HG22 THR 53 HG22 THR 53 -5.898 5.171 -7.058 375 HG23 THR 53 HG23 THR 53 -4.612 4.237 -6.287 376 H GLU 54 H GLU 54 -6.873 3.050 -5.917 377 HA GLU 54 HA GLU 54 -5.265 1.136 -4.402 378 HB2 GLU 54 HB2 GLU 54 -7.645 0.502 -4.534 379 HB3 GLU 54 HB1 GLU 54 -7.570 0.597 -6.288 380 HG2 GLU 54 HG2 GLU 54 -5.843 -1.189 -6.251 381 HG3 GLU 54 HG1 GLU 54 -6.107 -1.345 -4.516 382 H LEU 55 H LEU 55 -3.326 0.938 -5.350 383 HA LEU 55 HA LEU 55 -3.223 1.013 -8.278 384 HB2 LEU 55 HB2 LEU 55 -0.961 1.172 -6.250 385 HB3 LEU 55 HB1 LEU 55 -0.725 1.023 -7.990 386 HG LEU 55 HG LEU 55 -1.903 3.311 -6.464 387 HD11 LEU 55 HD11 LEU 55 -0.236 4.553 -7.922 388 HD12 LEU 55 HD12 LEU 55 0.440 2.966 -8.294 389 HD13 LEU 55 HD13 LEU 55 0.407 3.545 -6.626 390 HD21 LEU 55 HD21 LEU 55 -3.422 2.991 -8.292 391 HD22 LEU 55 HD22 LEU 55 -2.085 2.812 -9.428 392 HD23 LEU 55 HD23 LEU 55 -2.386 4.370 -8.660 393 H ASN 56 H ASN 56 -2.189 -0.630 -9.455 394 HA ASN 56 HA ASN 56 -2.132 -3.218 -8.051 395 HB2 ASN 56 HB2 ASN 56 -3.962 -3.081 -9.696 396 HB3 ASN 56 HB1 ASN 56 -2.803 -2.659 -10.952 397 HD21 ASN 56 HD21 ASN 56 -4.093 -5.183 -8.975 398 HD22 ASN 56 HD22 ASN 56 -3.337 -6.502 -9.800 399 H LEU 57 H LEU 57 -0.171 -4.074 -7.903 400 HA LEU 57 HA LEU 57 1.862 -3.161 -9.826 401 HB2 LEU 57 HB2 LEU 57 2.133 -3.778 -6.868 402 HB3 LEU 57 HB1 LEU 57 3.506 -3.679 -7.947 403 HG LEU 57 HG LEU 57 1.830 -1.548 -6.791 404 HD11 LEU 57 HD11 LEU 57 4.107 -2.050 -6.047 405 HD12 LEU 57 HD12 LEU 57 3.946 -0.412 -6.673 406 HD13 LEU 57 HD13 LEU 57 4.704 -1.663 -7.658 407 HD21 LEU 57 HD21 LEU 57 3.073 -1.277 -9.512 408 HD22 LEU 57 HD22 LEU 57 2.418 0.036 -8.536 409 HD23 LEU 57 HD23 LEU 57 1.349 -1.230 -9.142 410 HA PRO 58 HA PRO 58 2.554 -7.407 -10.801 411 HB2 PRO 58 HB2 PRO 58 5.308 -7.414 -11.007 412 HB3 PRO 58 HB1 PRO 58 4.205 -6.910 -12.287 413 HG2 PRO 58 HG2 PRO 58 5.821 -5.267 -10.422 414 HG3 PRO 58 HG1 PRO 58 5.343 -4.933 -12.093 415 HD2 PRO 58 HD2 PRO 58 4.175 -3.777 -9.904 416 HD3 PRO 58 HD1 PRO 58 3.353 -3.992 -11.456 417 H GLU 59 H GLU 59 3.099 -9.286 -9.828 418 HA GLU 59 HA GLU 59 3.226 -9.630 -7.133 419 HB2 GLU 59 HB2 GLU 59 4.049 -11.891 -7.562 420 HB3 GLU 59 HB1 GLU 59 2.818 -11.441 -8.733 421 HG2 GLU 59 HG2 GLU 59 4.458 -11.081 -10.426 422 HG3 GLU 59 HG1 GLU 59 5.773 -11.256 -9.266 423 H THR 60 H THR 60 5.847 -8.811 -9.208 424 HA THR 60 HA THR 60 7.826 -9.443 -7.147 425 HB THR 60 HB THR 60 8.237 -10.446 -9.336 426 HG1 THR 60 HG1 THR 60 9.994 -8.517 -8.311 427 HG21 THR 60 HG21 THR 60 7.133 -8.859 -10.778 428 HG22 THR 60 HG22 THR 60 8.820 -9.013 -11.270 429 HG23 THR 60 HG23 THR 60 8.296 -7.604 -10.347 430 H ALA 61 H ALA 61 5.963 -6.984 -7.534 431 HA ALA 61 HA ALA 61 7.883 -4.821 -7.764 432 HB1 ALA 61 HB1 ALA 61 5.957 -3.362 -7.303 433 HB2 ALA 61 HB2 ALA 61 4.959 -4.789 -7.030 434 HB3 ALA 61 HB3 ALA 61 5.638 -4.480 -8.625 435 H ASN 62 H ASN 62 7.985 -3.164 -5.976 436 HA ASN 62 HA ASN 62 7.567 -4.290 -3.333 437 HB2 ASN 62 HB2 ASN 62 9.874 -4.147 -2.652 438 HB3 ASN 62 HB1 ASN 62 9.748 -5.191 -4.060 439 HD21 ASN 62 HD21 ASN 62 11.084 -2.331 -2.752 440 HD22 ASN 62 HD22 ASN 62 12.005 -1.861 -4.140 441 H SER 63 H SER 63 7.033 -1.759 -5.127 442 HA SER 63 HA SER 63 6.998 0.058 -2.898 443 HB2 SER 63 HB2 SER 63 8.730 0.806 -5.288 444 HB3 SER 63 HB1 SER 63 8.400 1.806 -3.878 445 HG SER 63 HG SER 63 9.381 -0.558 -3.086 446 H VAL 64 H VAL 64 5.317 1.470 -3.166 447 HA VAL 64 HA VAL 64 4.306 1.882 -5.911 448 HB VAL 64 HB VAL 64 2.572 0.710 -4.708 449 HG11 VAL 64 HG11 VAL 64 3.547 1.659 -2.463 450 HG12 VAL 64 HG12 VAL 64 1.898 1.080 -2.616 451 HG13 VAL 64 HG13 VAL 64 2.231 2.812 -2.681 452 HG21 VAL 64 HG21 VAL 64 1.866 2.438 -6.188 453 HG22 VAL 64 HG22 VAL 64 1.896 3.603 -4.863 454 HG23 VAL 64 HG23 VAL 64 0.766 2.248 -4.829 455 H THR 65 H THR 65 4.079 3.931 -6.631 456 HA THR 65 HA THR 65 4.650 6.133 -4.816 457 HB THR 65 HB THR 65 4.455 5.883 -7.804 458 HG1 THR 65 HG1 THR 65 6.357 5.082 -6.707 459 HG21 THR 65 HG21 THR 65 3.650 8.109 -7.163 460 HG22 THR 65 HG22 THR 65 5.240 8.232 -7.915 461 HG23 THR 65 HG23 THR 65 5.081 8.357 -6.163 462 H LEU 66 H LEU 66 2.850 6.586 -3.736 463 HA LEU 66 HA LEU 66 0.211 6.600 -4.852 464 HB2 LEU 66 HB2 LEU 66 0.741 8.135 -2.409 465 HB3 LEU 66 HB1 LEU 66 -0.486 6.931 -2.730 466 HG LEU 66 HG LEU 66 2.387 6.249 -2.146 467 HD11 LEU 66 HD11 LEU 66 1.120 7.428 -0.318 468 HD12 LEU 66 HD12 LEU 66 1.832 5.864 0.052 469 HD13 LEU 66 HD13 LEU 66 0.099 5.992 -0.256 470 HD21 LEU 66 HD21 LEU 66 1.432 4.011 -1.736 471 HD22 LEU 66 HD22 LEU 66 1.208 4.542 -3.405 472 HD23 LEU 66 HD23 LEU 66 -0.139 4.619 -2.269 473 H SER 67 H SER 67 -0.975 8.404 -5.508 474 HA SER 67 HA SER 67 0.586 10.870 -5.805 475 HB2 SER 67 HB2 SER 67 -0.336 10.975 -8.179 476 HB3 SER 67 HB1 SER 67 0.919 9.773 -7.885 477 HG SER 67 HG SER 67 -1.830 9.422 -8.333 478 H ASP 68 H ASP 68 -0.658 12.740 -6.328 479 HA ASP 68 HA ASP 68 -2.387 14.183 -6.205 480 HB2 ASP 68 HB2 ASP 68 -3.992 11.683 -6.736 481 HB3 ASP 68 HB1 ASP 68 -4.706 13.288 -6.647 482 H LEU 69 H LEU 69 -1.314 13.016 -3.819 483 HA LEU 69 HA LEU 69 -3.437 12.668 -1.932 484 HB2 LEU 69 HB2 LEU 69 -0.667 13.572 -1.177 485 HB3 LEU 69 HB1 LEU 69 -1.807 12.609 -0.259 486 HG LEU 69 HG LEU 69 -0.310 11.635 -2.677 487 HD11 LEU 69 HD11 LEU 69 1.153 12.059 -0.789 488 HD12 LEU 69 HD12 LEU 69 0.950 10.328 -1.057 489 HD13 LEU 69 HD13 LEU 69 0.088 11.125 0.260 490 HD21 LEU 69 HD21 LEU 69 -2.312 10.488 -0.765 491 HD22 LEU 69 HD22 LEU 69 -1.150 9.428 -1.574 492 HD23 LEU 69 HD23 LEU 69 -2.296 10.381 -2.528 493 H GLN 70 H GLN 70 -3.158 14.248 0.128 494 HA GLN 70 HA GLN 70 -3.061 17.027 -0.849 495 HB2 GLN 70 HB2 GLN 70 -4.729 16.140 1.492 496 HB3 GLN 70 HB1 GLN 70 -4.830 17.643 0.590 497 HG2 GLN 70 HG2 GLN 70 -5.608 16.266 -1.373 498 HG3 GLN 70 HG1 GLN 70 -5.751 14.914 -0.248 499 HE21 GLN 70 HE21 GLN 70 -7.276 15.061 1.453 500 HE22 GLN 70 HE22 GLN 70 -8.625 16.136 1.355 501 HA PRO 71 HA PRO 71 0.166 17.395 2.173 502 HB2 PRO 71 HB2 PRO 71 0.056 20.078 2.604 503 HB3 PRO 71 HB1 PRO 71 0.792 19.330 1.184 504 HG2 PRO 71 HG2 PRO 71 -1.921 20.556 1.484 505 HG3 PRO 71 HG1 PRO 71 -0.765 20.717 0.150 506 HD2 PRO 71 HD2 PRO 71 -2.887 19.058 0.019 507 HD3 PRO 71 HD1 PRO 71 -1.339 18.671 -0.761 508 H GLY 72 H GLY 72 0.035 16.825 4.255 509 HA2 GLY 72 HA2 GLY 72 -0.370 17.200 6.528 510 HA3 GLY 72 HA1 GLY 72 -1.547 18.430 6.096 511 H VAL 73 H VAL 73 -1.429 15.098 4.928 512 HA VAL 73 HA VAL 73 -3.883 14.514 6.457 513 HB VAL 73 HB VAL 73 -3.403 13.729 3.570 514 HG11 VAL 73 HG11 VAL 73 -5.916 13.248 3.785 515 HG12 VAL 73 HG12 VAL 73 -5.583 13.148 5.519 516 HG13 VAL 73 HG13 VAL 73 -4.760 12.059 4.397 517 HG21 VAL 73 HG21 VAL 73 -5.043 15.900 4.786 518 HG22 VAL 73 HG22 VAL 73 -5.518 15.129 3.273 519 HG23 VAL 73 HG23 VAL 73 -3.959 15.961 3.391 520 H GLN 74 H GLN 74 -4.086 12.416 7.197 521 HA GLN 74 HA GLN 74 -1.661 10.830 7.201 522 HB2 GLN 74 HB2 GLN 74 -2.731 11.131 9.315 523 HB3 GLN 74 HB1 GLN 74 -4.291 10.688 8.643 524 HG2 GLN 74 HG2 GLN 74 -3.574 8.398 8.387 525 HG3 GLN 74 HG1 GLN 74 -1.940 8.819 8.889 526 HE21 GLN 74 HE21 GLN 74 -3.795 6.883 10.011 527 HE22 GLN 74 HE22 GLN 74 -4.010 7.325 11.669 528 H TYR 75 H TYR 75 -1.372 9.138 5.882 529 HA TYR 75 HA TYR 75 -3.752 8.017 4.564 530 HB2 TYR 75 HB2 TYR 75 -0.942 8.268 3.481 531 HB3 TYR 75 HB1 TYR 75 -2.269 7.443 2.664 532 HD1 TYR 75 HD2 TYR 75 -4.250 8.743 1.929 533 HD2 TYR 75 HD1 TYR 75 -0.741 10.617 3.424 534 HE1 TYR 75 HE2 TYR 75 -4.995 10.881 0.980 535 HE2 TYR 75 HE1 TYR 75 -1.475 12.759 2.495 536 HH TYR 75 HH TYR 75 -4.584 13.345 1.551 537 H ASN 76 H ASN 76 -4.222 6.068 5.174 538 HA ASN 76 HA ASN 76 -2.176 4.262 6.165 539 HB2 ASN 76 HB2 ASN 76 -5.166 3.972 5.795 540 HB3 ASN 76 HB1 ASN 76 -4.133 2.651 6.325 541 HD21 ASN 76 HD21 ASN 76 -5.146 2.452 8.283 542 HD22 ASN 76 HD22 ASN 76 -4.977 3.621 9.548 543 H ILE 77 H ILE 77 -0.899 3.491 4.570 544 HA ILE 77 HA ILE 77 -2.070 2.742 2.013 545 HB ILE 77 HB ILE 77 0.799 2.525 2.930 546 HG12 ILE 77 HG12 ILE 77 0.987 4.305 1.028 547 HG13 ILE 77 HG11 ILE 77 -0.671 4.653 1.442 548 HG21 ILE 77 HG21 ILE 77 -0.547 1.766 0.405 549 HG22 ILE 77 HG22 ILE 77 0.791 0.975 1.259 550 HG23 ILE 77 HG23 ILE 77 1.071 2.463 0.334 551 HD11 ILE 77 HD11 ILE 77 0.812 6.149 2.610 552 HD12 ILE 77 HD12 ILE 77 1.683 4.783 3.306 553 HD13 ILE 77 HD13 ILE 77 0.005 5.085 3.760 554 H THR 78 H THR 78 -2.939 0.883 1.785 555 HA THR 78 HA THR 78 -2.156 -1.292 3.555 556 HB THR 78 HB THR 78 -4.604 -0.986 1.830 557 HG1 THR 78 HG1 THR 78 -4.254 0.523 3.705 558 HG21 THR 78 HG21 THR 78 -4.059 -3.315 2.383 559 HG22 THR 78 HG22 THR 78 -5.514 -2.791 3.233 560 HG23 THR 78 HG23 THR 78 -3.976 -2.891 4.092 561 H ILE 79 H ILE 79 -0.761 -2.702 2.682 562 HA ILE 79 HA ILE 79 -0.707 -3.002 -0.256 563 HB ILE 79 HB ILE 79 1.245 -4.354 1.619 564 HG12 ILE 79 HG12 ILE 79 1.764 -2.080 2.046 565 HG13 ILE 79 HG11 ILE 79 2.899 -2.633 0.814 566 HG21 ILE 79 HG21 ILE 79 1.185 -3.777 -1.307 567 HG22 ILE 79 HG22 ILE 79 1.297 -5.342 -0.490 568 HG23 ILE 79 HG23 ILE 79 2.661 -4.215 -0.451 569 HD11 ILE 79 HD11 ILE 79 0.414 -1.191 0.039 570 HD12 ILE 79 HD12 ILE 79 1.947 -1.367 -0.832 571 HD13 ILE 79 HD13 ILE 79 1.844 -0.328 0.600 572 H TYR 80 H TYR 80 -1.339 -4.802 -1.256 573 HA TYR 80 HA TYR 80 -2.166 -7.116 0.379 574 HB2 TYR 80 HB2 TYR 80 -3.388 -6.160 -2.224 575 HB3 TYR 80 HB1 TYR 80 -3.941 -7.513 -1.251 576 HD1 TYR 80 HD2 TYR 80 -3.805 -3.798 -1.467 577 HD2 TYR 80 HD1 TYR 80 -5.361 -7.184 0.625 578 HE1 TYR 80 HE2 TYR 80 -5.453 -2.366 -0.353 579 HE2 TYR 80 HE1 TYR 80 -7.008 -5.741 1.736 580 HH TYR 80 HH TYR 80 -7.407 -3.471 2.275 581 H ALA 81 H ALA 81 -0.608 -8.654 -0.001 582 HA ALA 81 HA ALA 81 0.502 -9.051 -2.656 583 HB1 ALA 81 HB1 ALA 81 0.833 -10.576 -0.053 584 HB2 ALA 81 HB2 ALA 81 2.019 -9.573 -0.889 585 HB3 ALA 81 HB3 ALA 81 1.534 -11.129 -1.589 586 H VAL 82 H VAL 82 -0.679 -10.028 -4.193 587 HA VAL 82 HA VAL 82 -2.845 -11.806 -3.215 588 HB VAL 82 HB VAL 82 -3.759 -9.867 -4.380 589 HG11 VAL 82 HG11 VAL 82 -3.423 -9.497 -6.746 590 HG12 VAL 82 HG12 VAL 82 -2.223 -10.789 -6.779 591 HG13 VAL 82 HG13 VAL 82 -1.917 -9.325 -5.844 592 HG21 VAL 82 HG21 VAL 82 -4.030 -12.351 -6.054 593 HG22 VAL 82 HG22 VAL 82 -5.172 -11.003 -5.982 594 HG23 VAL 82 HG23 VAL 82 -4.921 -12.022 -4.564 595 H GLU 83 H GLU 83 -2.927 -13.873 -3.836 596 HA GLU 83 HA GLU 83 -1.020 -14.763 -5.889 597 HB2 GLU 83 HB2 GLU 83 -2.441 -16.722 -4.148 598 HB3 GLU 83 HB1 GLU 83 -0.850 -16.796 -4.877 599 HG2 GLU 83 HG2 GLU 83 0.031 -15.311 -3.253 600 HG3 GLU 83 HG1 GLU 83 -1.554 -15.137 -2.496 601 H GLU 84 H GLU 84 -1.863 -16.776 -7.080 602 HA GLU 84 HA GLU 84 -3.916 -16.215 -8.764 603 HB2 GLU 84 HB2 GLU 84 -3.158 -18.965 -7.767 604 HB3 GLU 84 HB1 GLU 84 -4.095 -18.638 -9.216 605 HG2 GLU 84 HG2 GLU 84 -2.177 -17.434 -10.165 606 HG3 GLU 84 HG1 GLU 84 -1.246 -17.827 -8.723 607 H ASN 85 H ASN 85 -4.239 -17.843 -5.623 608 HA ASN 85 HA ASN 85 -7.156 -17.756 -6.001 609 HB2 ASN 85 HB2 ASN 85 -7.339 -19.839 -4.735 610 HB3 ASN 85 HB1 ASN 85 -6.329 -20.051 -6.158 611 HD21 ASN 85 HD21 ASN 85 -6.480 -21.530 -3.604 612 HD22 ASN 85 HD22 ASN 85 -4.863 -21.531 -2.982 613 H GLN 86 H GLN 86 -4.558 -16.841 -3.924 614 HA GLN 86 HA GLN 86 -6.473 -16.439 -1.720 615 HB2 GLN 86 HB2 GLN 86 -3.605 -17.363 -1.541 616 HB3 GLN 86 HB1 GLN 86 -4.539 -16.818 -0.156 617 HG2 GLN 86 HG2 GLN 86 -5.238 -19.158 -1.917 618 HG3 GLN 86 HG1 GLN 86 -4.456 -19.257 -0.339 619 HE21 GLN 86 HE21 GLN 86 -5.650 -18.796 1.512 620 HE22 GLN 86 HE22 GLN 86 -7.375 -18.778 1.505 621 H GLU 87 H GLU 87 -5.440 -14.913 -0.015 622 HA GLU 87 HA GLU 87 -3.840 -12.788 -1.246 623 HB2 GLU 87 HB2 GLU 87 -6.444 -12.357 0.234 624 HB3 GLU 87 HB1 GLU 87 -5.320 -11.080 -0.193 625 HG2 GLU 87 HG2 GLU 87 -5.709 -11.420 -2.520 626 HG3 GLU 87 HG1 GLU 87 -6.668 -12.865 -2.196 627 H SER 88 H SER 88 -2.202 -12.271 0.065 628 HA SER 88 HA SER 88 -1.941 -13.303 2.689 629 HB2 SER 88 HB2 SER 88 -0.433 -11.007 1.413 630 HB3 SER 88 HB1 SER 88 0.093 -11.969 2.794 631 HG SER 88 HG SER 88 1.073 -13.024 1.228 632 H THR 89 H THR 89 -1.838 -12.102 4.683 633 HA THR 89 HA THR 89 -3.958 -10.356 5.148 634 HB THR 89 HB THR 89 -2.795 -9.821 7.308 635 HG1 THR 89 HG1 THR 89 -0.741 -11.197 5.980 636 HG21 THR 89 HG21 THR 89 -2.982 -12.743 6.566 637 HG22 THR 89 HG22 THR 89 -4.317 -11.723 7.106 638 HG23 THR 89 HG23 THR 89 -2.989 -12.093 8.206 639 HA PRO 90 HA PRO 90 -2.570 -6.629 3.514 640 HB2 PRO 90 HB2 PRO 90 -4.070 -4.832 4.857 641 HB3 PRO 90 HB1 PRO 90 -4.752 -5.969 3.691 642 HG2 PRO 90 HG2 PRO 90 -4.766 -6.071 6.670 643 HG3 PRO 90 HG1 PRO 90 -6.028 -6.549 5.522 644 HD2 PRO 90 HD2 PRO 90 -4.316 -8.280 6.796 645 HD3 PRO 90 HD1 PRO 90 -5.166 -8.635 5.283 646 H VAL 91 H VAL 91 -0.998 -5.241 3.659 647 HA VAL 91 HA VAL 91 0.414 -4.561 6.100 648 HB VAL 91 HB VAL 91 0.564 -3.647 3.236 649 HG11 VAL 91 HG11 VAL 91 2.190 -2.636 5.558 650 HG12 VAL 91 HG12 VAL 91 0.945 -1.732 4.701 651 HG13 VAL 91 HG13 VAL 91 2.417 -2.206 3.867 652 HG21 VAL 91 HG21 VAL 91 2.779 -4.615 3.282 653 HG22 VAL 91 HG22 VAL 91 1.574 -5.820 3.747 654 HG23 VAL 91 HG23 VAL 91 2.578 -5.054 4.980 655 H VAL 92 H VAL 92 -0.170 -2.782 7.370 656 HA VAL 92 HA VAL 92 -1.575 -0.620 5.954 657 HB VAL 92 HB VAL 92 -2.104 -1.307 8.846 658 HG11 VAL 92 HG11 VAL 92 -2.451 1.024 8.257 659 HG12 VAL 92 HG12 VAL 92 -4.001 0.230 8.543 660 HG13 VAL 92 HG13 VAL 92 -3.460 0.543 6.891 661 HG21 VAL 92 HG21 VAL 92 -4.269 -2.180 8.102 662 HG22 VAL 92 HG22 VAL 92 -2.936 -3.113 7.424 663 HG23 VAL 92 HG23 VAL 92 -3.790 -1.939 6.423 664 H ILE 93 H ILE 93 -0.092 0.896 5.733 665 HA ILE 93 HA ILE 93 1.527 1.605 8.094 666 HB ILE 93 HB ILE 93 3.283 2.410 6.511 667 HG12 ILE 93 HG12 ILE 93 1.666 1.001 4.395 668 HG13 ILE 93 HG11 ILE 93 1.781 2.737 4.583 669 HG21 ILE 93 HG21 ILE 93 2.516 -0.490 6.228 670 HG22 ILE 93 HG22 ILE 93 3.464 0.215 7.537 671 HG23 ILE 93 HG23 ILE 93 4.108 0.190 5.896 672 HD11 ILE 93 HD11 ILE 93 3.275 1.909 2.856 673 HD12 ILE 93 HD12 ILE 93 4.076 0.894 4.058 674 HD13 ILE 93 HD13 ILE 93 4.154 2.654 4.205 675 H GLN 94 H GLN 94 0.817 3.452 8.940 676 HA GLN 94 HA GLN 94 -0.528 5.355 7.183 677 HB2 GLN 94 HB2 GLN 94 -1.330 6.437 9.258 678 HB3 GLN 94 HB1 GLN 94 -1.822 4.759 9.109 679 HG2 GLN 94 HG2 GLN 94 0.550 5.607 10.749 680 HG3 GLN 94 HG1 GLN 94 -1.087 5.560 11.399 681 HE21 GLN 94 HE21 GLN 94 -2.107 3.572 11.669 682 HE22 GLN 94 HE22 GLN 94 -1.233 2.079 11.675 683 H GLN 95 H GLN 95 0.348 7.150 6.537 684 HA GLN 95 HA GLN 95 2.527 8.361 8.085 685 HB2 GLN 95 HB2 GLN 95 3.306 6.892 6.122 686 HB3 GLN 95 HB1 GLN 95 2.612 8.122 5.086 687 HG2 GLN 95 HG2 GLN 95 4.726 8.703 7.136 688 HG3 GLN 95 HG1 GLN 95 5.086 8.266 5.470 689 HE21 GLN 95 HE21 GLN 95 2.770 9.714 4.436 690 HE22 GLN 95 HE22 GLN 95 3.160 11.394 4.533 691 H GLU 96 H GLU 96 2.275 10.527 8.307 692 HA GLU 96 HA GLU 96 0.067 11.821 6.900 693 HB2 GLU 96 HB2 GLU 96 1.823 12.829 9.150 694 HB3 GLU 96 HB1 GLU 96 0.424 13.669 8.492 695 HG2 GLU 96 HG2 GLU 96 -1.022 11.864 9.223 696 HG3 GLU 96 HG1 GLU 96 0.369 10.990 9.856 697 H THR 97 H THR 97 0.367 13.052 5.169 698 HA THR 97 HA THR 97 2.830 13.367 3.906 699 HB THR 97 HB THR 97 1.549 15.274 2.652 700 HG1 THR 97 HG1 THR 97 -0.792 14.827 2.893 701 HG21 THR 97 HG21 THR 97 1.992 13.095 1.693 702 HG22 THR 97 HG22 THR 97 0.331 13.573 1.339 703 HG23 THR 97 HG23 THR 97 0.661 12.391 2.608 704 H THR 98 H THR 98 4.467 14.684 4.166 705 HA THR 98 HA THR 98 4.569 16.636 6.214 706 HB THR 98 HB THR 98 6.514 16.474 3.924 707 HG1 THR 98 HG1 THR 98 6.147 14.651 6.085 708 HG21 THR 98 HG21 THR 98 6.858 16.988 6.885 709 HG22 THR 98 HG22 THR 98 6.873 18.214 5.617 710 HG23 THR 98 HG23 THR 98 8.147 16.996 5.682 711 H GLY 99 H GLY 99 4.040 16.727 2.761 712 HA2 GLY 99 HA2 GLY 99 2.659 18.422 1.804 713 HA3 GLY 99 HA1 GLY 99 3.215 19.524 3.044 714 H THR 100 H THR 100 3.674 21.041 1.401 715 HA THR 100 HA THR 100 5.988 20.402 -0.288 716 HB THR 100 HB THR 100 4.201 22.836 -0.429 717 HG1 THR 100 HG1 THR 100 4.090 20.349 -1.822 718 HG21 THR 100 HG21 THR 100 5.138 23.117 -2.639 719 HG22 THR 100 HG22 THR 100 6.156 21.696 -2.406 720 HG23 THR 100 HG23 THR 100 6.399 23.132 -1.413 721 HA PRO 101 HA PRO 101 8.553 22.681 2.635 722 HB2 PRO 101 HB2 PRO 101 10.297 22.804 0.228 723 HB3 PRO 101 HB1 PRO 101 10.685 22.271 1.868 724 HG2 PRO 101 HG2 PRO 101 10.376 20.508 -0.108 725 HG3 PRO 101 HG1 PRO 101 9.800 20.158 1.532 726 HD2 PRO 101 HD2 PRO 101 8.251 20.953 -0.893 727 HD3 PRO 101 HD1 PRO 101 7.813 19.829 0.410 728 H ARG 102 H ARG 102 8.182 24.772 3.027 729 HA ARG 102 HA ARG 102 7.492 26.559 0.850 730 HB2 ARG 102 HB2 ARG 102 7.550 26.987 3.838 731 HB3 ARG 102 HB1 ARG 102 7.039 28.199 2.673 732 HG2 ARG 102 HG2 ARG 102 5.239 26.696 1.931 733 HG3 ARG 102 HG1 ARG 102 5.736 25.531 3.160 734 HD2 ARG 102 HD2 ARG 102 4.770 28.342 3.660 735 HD3 ARG 102 HD1 ARG 102 3.847 26.864 3.926 736 HE ARG 102 HE ARG 102 6.042 26.474 5.444 737 HH11 ARG 102 HH11 ARG 102 3.749 29.107 5.210 738 HH12 ARG 102 HH12 ARG 102 3.943 29.589 6.863 739 HH21 ARG 102 HH21 ARG 102 6.295 27.101 7.620 740 HH22 ARG 102 HH22 ARG 102 5.394 28.451 8.236 741 H SER 103 H SER 103 9.682 26.362 -0.039 742 HA SER 103 HA SER 103 11.780 27.789 1.352 743 HB2 SER 103 HB2 SER 103 12.980 27.331 -0.887 744 HB3 SER 103 HB1 SER 103 12.567 25.942 0.119 745 HG SER 103 HG SER 103 11.430 26.812 -2.294 746 H ASP 104 H ASP 104 9.182 28.513 -0.633 747 HA ASP 104 HA ASP 104 10.377 31.048 -1.523 748 HB2 ASP 104 HB2 ASP 104 7.907 29.597 -2.504 749 HB3 ASP 104 HB1 ASP 104 8.436 31.171 -3.084 750 H GLY 105 H GLY 105 9.225 32.993 -1.173 751 HA2 GLY 105 HA2 GLY 105 6.806 32.979 0.397 752 HA3 GLY 105 HA1 GLY 105 8.228 33.470 1.308 753 H THR 106 H THR 106 9.642 35.012 -0.285 754 HA THR 106 HA THR 106 7.834 36.993 -1.450 755 HB THR 106 HB THR 106 9.469 38.737 -0.389 756 HG1 THR 106 HG1 THR 106 10.740 37.995 1.124 757 HG21 THR 106 HG21 THR 106 8.000 38.923 1.578 758 HG22 THR 106 HG22 THR 106 7.350 37.322 1.230 759 HG23 THR 106 HG23 THR 106 7.089 38.646 0.095 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 0.909 -35.254 8.951 2 H2 GLY 1 HT2 GLY 1 0.064 -33.793 8.911 3 H3 GLY 1 HT3 GLY 1 0.847 -34.276 10.328 4 HA2 GLY 1 HA1 GLY 1 2.117 -32.562 9.229 5 HA3 GLY 1 HA2 GLY 1 2.991 -34.087 9.252 6 H SER 2 H SER 2 2.021 -31.544 7.344 7 HA SER 2 HA SER 2 2.997 -32.901 4.974 8 HB2 SER 2 HB2 SER 2 0.272 -31.576 5.019 9 HB3 SER 2 HB1 SER 2 1.086 -32.190 3.581 10 HG SER 2 HG SER 2 1.030 -34.116 5.444 11 H HIS 3 H HIS 3 4.390 -31.091 6.315 12 HA HIS 3 HA HIS 3 3.922 -28.477 5.072 13 HB2 HIS 3 HB2 HIS 3 4.245 -28.562 7.535 14 HB3 HIS 3 HB1 HIS 3 5.850 -29.238 7.283 15 HD1 HIS 3 HD1 HIS 3 7.720 -27.604 7.019 16 HD2 HIS 3 HD2 HIS 3 3.996 -25.828 6.541 17 HE1 HIS 3 HE1 HIS 3 8.163 -25.132 6.889 18 HE2 HIS 3 HE2 HIS 3 5.912 -24.099 6.421 19 H MET 4 H MET 4 4.591 -29.530 3.018 20 HA MET 4 HA MET 4 7.526 -29.497 2.771 21 HB2 MET 4 HB2 MET 4 7.288 -31.030 0.851 22 HB3 MET 4 HB1 MET 4 6.692 -31.734 2.345 23 HG2 MET 4 HG2 MET 4 4.409 -31.291 1.679 24 HG3 MET 4 HG1 MET 4 4.972 -30.490 0.214 25 HE1 MET 4 HE1 MET 4 5.520 -35.005 1.032 26 HE2 MET 4 HE2 MET 4 4.778 -33.883 2.173 27 HE3 MET 4 HE3 MET 4 6.501 -33.770 1.819 28 H GLY 5 H GLY 5 4.527 -28.238 1.707 29 HA2 GLY 5 HA2 GLY 5 5.974 -26.388 -0.058 30 HA3 GLY 5 HA1 GLY 5 4.506 -27.169 -0.632 31 H THR 6 H THR 6 2.742 -27.064 1.212 32 HA THR 6 HA THR 6 1.127 -25.750 2.096 33 HB THR 6 HB THR 6 1.987 -24.319 4.051 34 HG1 THR 6 HG1 THR 6 4.118 -24.034 3.595 35 HG21 THR 6 HG21 THR 6 2.380 -26.326 5.410 36 HG22 THR 6 HG22 THR 6 2.572 -27.280 3.942 37 HG23 THR 6 HG23 THR 6 1.016 -26.540 4.315 38 H THR 7 H THR 7 1.152 -24.671 -0.134 39 HA THR 7 HA THR 7 1.953 -21.932 -0.245 40 HB THR 7 HB THR 7 -0.129 -23.335 -1.938 41 HG1 THR 7 HG1 THR 7 1.519 -24.087 -3.156 42 HG21 THR 7 HG21 THR 7 1.627 -20.943 -2.515 43 HG22 THR 7 HG22 THR 7 -0.102 -20.889 -2.175 44 HG23 THR 7 HG23 THR 7 0.484 -21.682 -3.636 45 H THR 8 H THR 8 -0.662 -23.618 1.150 46 HA THR 8 HA THR 8 -2.634 -21.586 1.149 47 HB THR 8 HB THR 8 -2.247 -23.791 3.186 48 HG1 THR 8 HG1 THR 8 -3.998 -24.019 0.994 49 HG21 THR 8 HG21 THR 8 -4.728 -22.308 2.304 50 HG22 THR 8 HG22 THR 8 -3.891 -22.090 3.840 51 HG23 THR 8 HG23 THR 8 -4.672 -23.626 3.473 52 H ALA 9 H ALA 9 -3.071 -19.983 2.607 53 HA ALA 9 HA ALA 9 -2.755 -18.404 4.194 54 HB1 ALA 9 HB1 ALA 9 -2.878 -20.267 5.774 55 HB2 ALA 9 HB2 ALA 9 -1.764 -19.019 6.330 56 HB3 ALA 9 HB3 ALA 9 -1.137 -20.509 5.625 57 HA PRO 10 HA PRO 10 1.437 -17.333 2.551 58 HB2 PRO 10 HB2 PRO 10 0.697 -15.360 0.894 59 HB3 PRO 10 HB1 PRO 10 0.564 -17.056 0.411 60 HG2 PRO 10 HG2 PRO 10 -1.558 -15.192 1.384 61 HG3 PRO 10 HG1 PRO 10 -1.631 -16.391 0.081 62 HD2 PRO 10 HD2 PRO 10 -2.596 -16.799 2.622 63 HD3 PRO 10 HD1 PRO 10 -2.143 -18.071 1.531 64 H ASP 11 H ASP 11 2.671 -15.441 3.102 65 HA ASP 11 HA ASP 11 1.251 -13.772 5.071 66 HB2 ASP 11 HB2 ASP 11 3.386 -13.389 6.157 67 HB3 ASP 11 HB1 ASP 11 3.105 -15.116 5.993 68 H ALA 12 H ALA 12 1.364 -11.594 5.004 69 HA ALA 12 HA ALA 12 1.904 -10.351 2.484 70 HB1 ALA 12 HB1 ALA 12 1.273 -8.287 3.641 71 HB2 ALA 12 HB2 ALA 12 1.325 -9.128 5.190 72 HB3 ALA 12 HB3 ALA 12 0.120 -9.578 3.981 73 HA PRO 13 HA PRO 13 6.093 -8.924 3.053 74 HB2 PRO 13 HB2 PRO 13 5.173 -6.174 2.437 75 HB3 PRO 13 HB1 PRO 13 6.384 -7.163 1.614 76 HG2 PRO 13 HG2 PRO 13 4.021 -6.724 0.489 77 HG3 PRO 13 HG1 PRO 13 4.787 -8.323 0.383 78 HD2 PRO 13 HD2 PRO 13 2.601 -7.383 2.207 79 HD3 PRO 13 HD1 PRO 13 2.710 -8.902 1.286 80 HA PRO 14 HA PRO 14 6.175 -7.359 7.296 81 HB2 PRO 14 HB2 PRO 14 8.948 -6.711 6.398 82 HB3 PRO 14 HB1 PRO 14 8.413 -7.518 7.876 83 HG2 PRO 14 HG2 PRO 14 9.482 -8.913 5.875 84 HG3 PRO 14 HG1 PRO 14 8.123 -9.558 6.814 85 HD2 PRO 14 HD2 PRO 14 8.155 -8.424 4.060 86 HD3 PRO 14 HD1 PRO 14 7.147 -9.711 4.745 87 H ASP 15 H ASP 15 6.169 -5.342 8.224 88 HA ASP 15 HA ASP 15 4.885 -3.384 6.952 89 HB2 ASP 15 HB2 ASP 15 6.892 -3.027 9.173 90 HB3 ASP 15 HB1 ASP 15 5.788 -1.762 8.647 91 HA PRO 16 HA PRO 16 7.898 -2.033 3.900 92 HB2 PRO 16 HB2 PRO 16 5.508 -0.511 3.010 93 HB3 PRO 16 HB1 PRO 16 6.544 -1.620 2.075 94 HG2 PRO 16 HG2 PRO 16 4.119 -2.378 2.814 95 HG3 PRO 16 HG1 PRO 16 5.477 -3.509 2.945 96 HD2 PRO 16 HD2 PRO 16 4.204 -1.851 5.103 97 HD3 PRO 16 HD1 PRO 16 4.601 -3.590 5.123 98 H THR 17 H THR 17 8.997 -0.176 3.537 99 HA THR 17 HA THR 17 8.495 1.979 5.486 100 HB THR 17 HB THR 17 11.049 1.379 3.975 101 HG1 THR 17 HG1 THR 17 10.077 0.517 6.499 102 HG21 THR 17 HG21 THR 17 12.094 2.808 5.671 103 HG22 THR 17 HG22 THR 17 10.518 3.093 6.409 104 HG23 THR 17 HG23 THR 17 10.851 3.693 4.785 105 H VAL 18 H VAL 18 7.997 3.868 4.910 106 HA VAL 18 HA VAL 18 7.622 4.543 2.120 107 HB VAL 18 HB VAL 18 7.124 6.158 4.625 108 HG11 VAL 18 HG11 VAL 18 7.529 7.660 2.779 109 HG12 VAL 18 HG12 VAL 18 5.807 7.645 3.155 110 HG13 VAL 18 HG13 VAL 18 6.410 6.763 1.747 111 HG21 VAL 18 HG21 VAL 18 4.784 5.674 4.241 112 HG22 VAL 18 HG22 VAL 18 5.694 4.169 4.383 113 HG23 VAL 18 HG23 VAL 18 5.188 4.749 2.797 114 H ASP 19 H ASP 19 9.037 5.528 0.888 115 HA ASP 19 HA ASP 19 11.591 6.333 2.024 116 HB2 ASP 19 HB2 ASP 19 11.517 4.834 0.064 117 HB3 ASP 19 HB1 ASP 19 10.708 6.093 -0.862 118 H GLN 20 H GLN 20 8.889 7.752 0.283 119 HA GLN 20 HA GLN 20 9.991 10.422 0.813 120 HB2 GLN 20 HB2 GLN 20 8.857 9.466 -1.821 121 HB3 GLN 20 HB1 GLN 20 9.130 11.156 -1.427 122 HG2 GLN 20 HG2 GLN 20 11.514 10.733 -1.208 123 HG3 GLN 20 HG1 GLN 20 11.251 9.026 -1.560 124 HE21 GLN 20 HE21 GLN 20 12.854 11.017 -2.983 125 HE22 GLN 20 HE22 GLN 20 12.267 11.034 -4.584 126 H VAL 21 H VAL 21 8.552 11.864 1.508 127 HA VAL 21 HA VAL 21 5.700 11.208 1.307 128 HB VAL 21 HB VAL 21 7.050 12.217 3.812 129 HG11 VAL 21 HG11 VAL 21 4.806 13.141 3.455 130 HG12 VAL 21 HG12 VAL 21 4.869 12.066 4.851 131 HG13 VAL 21 HG13 VAL 21 4.163 11.504 3.336 132 HG21 VAL 21 HG21 VAL 21 5.726 9.565 3.291 133 HG22 VAL 21 HG22 VAL 21 6.425 10.101 4.820 134 HG23 VAL 21 HG23 VAL 21 7.463 9.835 3.418 135 H ASP 22 H ASP 22 4.781 12.803 0.195 136 HA ASP 22 HA ASP 22 5.421 15.568 0.942 137 HB2 ASP 22 HB2 ASP 22 5.186 14.517 -1.888 138 HB3 ASP 22 HB1 ASP 22 5.221 16.225 -1.466 139 H ASP 23 H ASP 23 3.656 16.920 -0.613 140 HA ASP 23 HA ASP 23 1.255 16.625 0.754 141 HB2 ASP 23 HB2 ASP 23 0.345 18.097 -1.177 142 HB3 ASP 23 HB1 ASP 23 1.597 18.736 -0.136 143 H THR 24 H THR 24 1.662 16.060 -2.720 144 HA THR 24 HA THR 24 -0.754 14.371 -2.627 145 HB THR 24 HB THR 24 -0.931 14.990 -5.061 146 HG1 THR 24 HG1 THR 24 1.068 16.918 -4.364 147 HG21 THR 24 HG21 THR 24 -1.742 17.266 -4.621 148 HG22 THR 24 HG22 THR 24 -0.872 17.280 -3.083 149 HG23 THR 24 HG23 THR 24 -2.218 16.163 -3.329 150 H SER 25 H SER 25 1.824 13.289 -2.026 151 HA SER 25 HA SER 25 2.052 11.132 -3.838 152 HB2 SER 25 HB2 SER 25 4.306 13.162 -3.951 153 HB3 SER 25 HB1 SER 25 4.347 11.553 -4.672 154 HG SER 25 HG SER 25 2.140 12.885 -5.474 155 H ILE 26 H ILE 26 2.815 9.457 -2.725 156 HA ILE 26 HA ILE 26 4.919 9.841 -0.713 157 HB ILE 26 HB ILE 26 2.214 8.641 -0.098 158 HG12 ILE 26 HG12 ILE 26 3.965 10.599 1.395 159 HG13 ILE 26 HG11 ILE 26 2.531 11.005 0.463 160 HG21 ILE 26 HG21 ILE 26 3.837 6.961 0.548 161 HG22 ILE 26 HG22 ILE 26 3.145 7.728 1.979 162 HG23 ILE 26 HG23 ILE 26 4.763 8.173 1.437 163 HD11 ILE 26 HD11 ILE 26 1.195 9.628 2.025 164 HD12 ILE 26 HD12 ILE 26 1.986 11.004 2.792 165 HD13 ILE 26 HD13 ILE 26 2.649 9.379 2.992 166 H VAL 27 H VAL 27 6.258 7.959 -0.510 167 HA VAL 27 HA VAL 27 5.601 5.917 -2.546 168 HB VAL 27 HB VAL 27 8.357 6.861 -1.772 169 HG11 VAL 27 HG11 VAL 27 9.200 5.312 -3.245 170 HG12 VAL 27 HG12 VAL 27 7.728 5.280 -4.213 171 HG13 VAL 27 HG13 VAL 27 7.771 4.445 -2.657 172 HG21 VAL 27 HG21 VAL 27 8.450 7.917 -3.966 173 HG22 VAL 27 HG22 VAL 27 7.141 8.594 -2.998 174 HG23 VAL 27 HG23 VAL 27 6.784 7.436 -4.279 175 H VAL 28 H VAL 28 5.704 3.806 -1.877 176 HA VAL 28 HA VAL 28 6.946 3.368 0.743 177 HB VAL 28 HB VAL 28 5.154 2.425 1.682 178 HG11 VAL 28 HG11 VAL 28 4.376 4.604 0.938 179 HG12 VAL 28 HG12 VAL 28 3.088 3.431 1.170 180 HG13 VAL 28 HG13 VAL 28 3.630 3.829 -0.460 181 HG21 VAL 28 HG21 VAL 28 3.490 1.039 0.607 182 HG22 VAL 28 HG22 VAL 28 5.140 0.508 0.231 183 HG23 VAL 28 HG23 VAL 28 4.209 1.419 -0.961 184 H ARG 29 H ARG 29 7.840 1.341 1.106 185 HA ARG 29 HA ARG 29 8.194 -0.354 -1.283 186 HB2 ARG 29 HB2 ARG 29 10.418 0.433 0.616 187 HB3 ARG 29 HB1 ARG 29 10.570 -0.542 -0.838 188 HG2 ARG 29 HG2 ARG 29 9.882 1.455 -2.162 189 HG3 ARG 29 HG1 ARG 29 9.936 2.393 -0.672 190 HD2 ARG 29 HD2 ARG 29 12.282 1.901 -0.399 191 HD3 ARG 29 HD1 ARG 29 12.255 0.838 -1.804 192 HE ARG 29 HE ARG 29 11.391 3.339 -2.650 193 HH11 ARG 29 HH11 ARG 29 14.290 1.869 -1.360 194 HH12 ARG 29 HH12 ARG 29 15.362 2.985 -2.143 195 HH21 ARG 29 HH21 ARG 29 12.793 4.817 -3.687 196 HH22 ARG 29 HH22 ARG 29 14.507 4.665 -3.471 197 H TRP 30 H TRP 30 7.769 -2.364 -0.898 198 HA TRP 30 HA TRP 30 7.680 -3.294 1.903 199 HB2 TRP 30 HB2 TRP 30 5.885 -4.866 1.131 200 HB3 TRP 30 HB1 TRP 30 5.442 -3.169 1.008 201 HD1 TRP 30 HD1 TRP 30 6.385 -6.133 -1.166 202 HE1 TRP 30 HE1 TRP 30 5.556 -5.721 -3.558 203 HE3 TRP 30 HE3 TRP 30 4.705 -1.389 -0.567 204 HZ2 TRP 30 HZ2 TRP 30 4.276 -3.653 -4.978 205 HZ3 TRP 30 HZ3 TRP 30 3.659 -0.273 -2.486 206 HH2 TRP 30 HH2 TRP 30 3.443 -1.366 -4.627 207 H SER 31 H SER 31 8.239 -5.479 2.341 208 HA SER 31 HA SER 31 10.142 -6.576 0.403 209 HB2 SER 31 HB2 SER 31 10.917 -6.103 2.742 210 HB3 SER 31 HB1 SER 31 9.783 -7.323 3.316 211 HG SER 31 HG SER 31 12.080 -7.952 2.881 212 H ARG 32 H ARG 32 9.113 -7.844 -0.957 213 HA ARG 32 HA ARG 32 6.681 -9.055 -0.723 214 HB2 ARG 32 HB2 ARG 32 8.913 -10.174 -2.396 215 HB3 ARG 32 HB1 ARG 32 7.193 -10.213 -2.732 216 HG2 ARG 32 HG2 ARG 32 7.887 -8.545 -4.151 217 HG3 ARG 32 HG1 ARG 32 7.412 -7.626 -2.722 218 HD2 ARG 32 HD2 ARG 32 9.462 -6.847 -2.400 219 HD3 ARG 32 HD1 ARG 32 10.173 -8.459 -2.575 220 HE ARG 32 HE ARG 32 9.380 -7.201 -5.057 221 HH11 ARG 32 HH11 ARG 32 11.958 -7.719 -2.743 222 HH12 ARG 32 HH12 ARG 32 13.218 -7.353 -3.877 223 HH21 ARG 32 HH21 ARG 32 11.035 -6.734 -6.555 224 HH22 ARG 32 HH22 ARG 32 12.694 -6.798 -6.050 225 HA PRO 33 HA PRO 33 7.091 -12.738 1.617 226 HB2 PRO 33 HB2 PRO 33 4.991 -14.063 0.173 227 HB3 PRO 33 HB1 PRO 33 4.863 -13.150 1.683 228 HG2 PRO 33 HG2 PRO 33 3.738 -12.369 -0.701 229 HG3 PRO 33 HG1 PRO 33 4.179 -11.252 0.610 230 HD2 PRO 33 HD2 PRO 33 5.697 -11.948 -1.875 231 HD3 PRO 33 HD1 PRO 33 5.431 -10.361 -1.140 232 H GLN 34 H GLN 34 7.394 -15.009 1.646 233 HA GLN 34 HA GLN 34 8.850 -16.134 -0.540 234 HB2 GLN 34 HB2 GLN 34 9.377 -16.743 1.744 235 HB3 GLN 34 HB1 GLN 34 7.754 -17.370 1.990 236 HG2 GLN 34 HG2 GLN 34 8.196 -19.095 0.290 237 HG3 GLN 34 HG1 GLN 34 9.840 -18.482 0.128 238 HE21 GLN 34 HE21 GLN 34 8.879 -21.105 0.961 239 HE22 GLN 34 HE22 GLN 34 9.558 -21.382 2.528 240 H ALA 35 H ALA 35 5.563 -16.032 0.516 241 HA ALA 35 HA ALA 35 4.415 -18.197 -0.781 242 HB1 ALA 35 HB1 ALA 35 3.315 -16.481 0.743 243 HB2 ALA 35 HB2 ALA 35 2.368 -17.039 -0.635 244 HB3 ALA 35 HB3 ALA 35 3.162 -15.464 -0.696 245 HA PRO 36 HA PRO 36 4.816 -17.028 -5.121 246 HB2 PRO 36 HB2 PRO 36 2.690 -19.001 -5.567 247 HB3 PRO 36 HB1 PRO 36 4.342 -18.989 -6.189 248 HG2 PRO 36 HG2 PRO 36 3.496 -20.757 -4.318 249 HG3 PRO 36 HG1 PRO 36 5.165 -20.166 -4.399 250 HD2 PRO 36 HD2 PRO 36 2.956 -19.362 -2.556 251 HD3 PRO 36 HD1 PRO 36 4.691 -19.550 -2.226 252 H ILE 37 H ILE 37 3.846 -15.164 -5.557 253 HA ILE 37 HA ILE 37 0.958 -14.898 -5.056 254 HB ILE 37 HB ILE 37 1.366 -12.485 -4.700 255 HG12 ILE 37 HG12 ILE 37 4.078 -13.288 -5.529 256 HG13 ILE 37 HG11 ILE 37 3.236 -11.766 -5.748 257 HG21 ILE 37 HG21 ILE 37 2.192 -12.589 -2.469 258 HG22 ILE 37 HG22 ILE 37 3.162 -14.032 -2.820 259 HG23 ILE 37 HG23 ILE 37 1.405 -14.144 -2.779 260 HD11 ILE 37 HD11 ILE 37 4.796 -12.703 -3.381 261 HD12 ILE 37 HD12 ILE 37 3.682 -11.343 -3.293 262 HD13 ILE 37 HD13 ILE 37 5.066 -11.279 -4.388 263 H THR 38 H THR 38 -0.215 -13.613 -6.606 264 HA THR 38 HA THR 38 0.984 -13.804 -9.258 265 HB THR 38 HB THR 38 -1.400 -13.296 -10.016 266 HG1 THR 38 HG1 THR 38 -2.942 -13.253 -8.526 267 HG21 THR 38 HG21 THR 38 -2.063 -15.580 -9.775 268 HG22 THR 38 HG22 THR 38 -0.925 -15.811 -8.446 269 HG23 THR 38 HG23 THR 38 -0.331 -15.502 -10.080 270 H GLY 39 H GLY 39 -0.208 -11.344 -7.042 271 HA2 GLY 39 HA2 GLY 39 1.169 -9.363 -8.547 272 HA3 GLY 39 HA1 GLY 39 -0.568 -9.213 -8.741 273 H TYR 40 H TYR 40 -0.030 -7.060 -7.733 274 HA TYR 40 HA TYR 40 -0.467 -7.334 -4.842 275 HB2 TYR 40 HB2 TYR 40 1.639 -5.706 -6.194 276 HB3 TYR 40 HB1 TYR 40 0.835 -5.038 -4.776 277 HD1 TYR 40 HD1 TYR 40 2.064 -8.456 -5.650 278 HD2 TYR 40 HD2 TYR 40 2.144 -5.213 -2.905 279 HE1 TYR 40 HE1 TYR 40 3.600 -9.709 -4.219 280 HE2 TYR 40 HE2 TYR 40 3.653 -6.482 -1.454 281 HH TYR 40 HH TYR 40 5.226 -9.314 -2.505 282 H ARG 41 H ARG 41 -2.156 -6.252 -4.169 283 HA ARG 41 HA ARG 41 -3.134 -3.981 -5.759 284 HB2 ARG 41 HB2 ARG 41 -4.554 -5.206 -3.424 285 HB3 ARG 41 HB1 ARG 41 -5.214 -4.334 -4.807 286 HG2 ARG 41 HG2 ARG 41 -4.868 -6.170 -6.254 287 HG3 ARG 41 HG1 ARG 41 -3.815 -6.971 -5.075 288 HD2 ARG 41 HD2 ARG 41 -6.756 -6.460 -4.704 289 HD3 ARG 41 HD1 ARG 41 -6.072 -7.987 -5.237 290 HE ARG 41 HE ARG 41 -4.826 -7.295 -2.856 291 HH11 ARG 41 HH11 ARG 41 -8.046 -8.077 -3.956 292 HH12 ARG 41 HH12 ARG 41 -8.537 -8.781 -2.448 293 HH21 ARG 41 HH21 ARG 41 -5.464 -8.253 -0.851 294 HH22 ARG 41 HH22 ARG 41 -7.077 -8.876 -0.690 295 H ILE 42 H ILE 42 -3.512 -1.996 -4.716 296 HA ILE 42 HA ILE 42 -2.319 -1.733 -2.038 297 HB ILE 42 HB ILE 42 -1.572 0.064 -4.321 298 HG12 ILE 42 HG12 ILE 42 0.150 -2.044 -3.054 299 HG13 ILE 42 HG11 ILE 42 -0.761 -2.310 -4.533 300 HG21 ILE 42 HG21 ILE 42 -0.293 -0.233 -1.608 301 HG22 ILE 42 HG22 ILE 42 -1.488 1.000 -2.002 302 HG23 ILE 42 HG23 ILE 42 0.065 0.986 -2.833 303 HD11 ILE 42 HD11 ILE 42 1.534 -1.789 -5.022 304 HD12 ILE 42 HD12 ILE 42 1.407 -0.285 -4.115 305 HD13 ILE 42 HD13 ILE 42 0.481 -0.498 -5.599 306 H VAL 43 H VAL 43 -3.917 -0.902 -0.823 307 HA VAL 43 HA VAL 43 -5.470 1.290 -2.043 308 HB VAL 43 HB VAL 43 -6.276 -0.543 0.220 309 HG11 VAL 43 HG11 VAL 43 -7.698 1.864 -0.881 310 HG12 VAL 43 HG12 VAL 43 -7.018 1.678 0.736 311 HG13 VAL 43 HG13 VAL 43 -8.388 0.689 0.240 312 HG21 VAL 43 HG21 VAL 43 -7.516 -0.080 -2.484 313 HG22 VAL 43 HG22 VAL 43 -8.061 -1.228 -1.260 314 HG23 VAL 43 HG23 VAL 43 -6.506 -1.463 -2.060 315 H TYR 44 H TYR 44 -4.679 3.155 -1.485 316 HA TYR 44 HA TYR 44 -3.853 3.562 1.289 317 HB2 TYR 44 HB2 TYR 44 -2.696 5.656 0.218 318 HB3 TYR 44 HB1 TYR 44 -1.922 4.081 0.122 319 HD1 TYR 44 HD2 TYR 44 -2.323 2.719 -2.022 320 HD2 TYR 44 HD1 TYR 44 -3.074 6.892 -1.743 321 HE1 TYR 44 HE2 TYR 44 -2.190 2.880 -4.456 322 HE2 TYR 44 HE1 TYR 44 -2.938 7.079 -4.188 323 HH TYR 44 HH TYR 44 -2.034 5.928 -6.075 324 H SER 45 H SER 45 -4.945 4.805 2.473 325 HA SER 45 HA SER 45 -6.917 6.610 1.250 326 HB2 SER 45 HB2 SER 45 -7.555 4.690 3.499 327 HB3 SER 45 HB1 SER 45 -8.674 5.778 2.679 328 HG SER 45 HG SER 45 -7.583 3.361 1.828 329 HA PRO 46 HA PRO 46 -5.569 9.393 4.497 330 HB2 PRO 46 HB2 PRO 46 -7.480 11.251 4.122 331 HB3 PRO 46 HB1 PRO 46 -6.151 11.038 2.975 332 HG2 PRO 46 HG2 PRO 46 -8.962 10.007 2.823 333 HG3 PRO 46 HG1 PRO 46 -7.997 10.805 1.565 334 HD2 PRO 46 HD2 PRO 46 -8.291 8.125 1.679 335 HD3 PRO 46 HD1 PRO 46 -6.800 8.895 1.096 336 H SER 47 H SER 47 -6.010 9.415 6.592 337 HA SER 47 HA SER 47 -8.118 7.909 7.681 338 HB2 SER 47 HB2 SER 47 -5.926 8.257 8.783 339 HB3 SER 47 HB1 SER 47 -6.351 9.943 9.062 340 HG SER 47 HG SER 47 -8.011 7.853 9.981 341 H VAL 48 H VAL 48 -7.803 11.375 7.069 342 HA VAL 48 HA VAL 48 -10.419 11.740 8.362 343 HB VAL 48 HB VAL 48 -9.765 14.145 8.662 344 HG11 VAL 48 HG11 VAL 48 -8.362 13.694 10.628 345 HG12 VAL 48 HG12 VAL 48 -8.086 12.054 10.042 346 HG13 VAL 48 HG13 VAL 48 -9.710 12.564 10.505 347 HG21 VAL 48 HG21 VAL 48 -7.961 14.221 7.003 348 HG22 VAL 48 HG22 VAL 48 -7.017 13.099 7.983 349 HG23 VAL 48 HG23 VAL 48 -7.391 14.708 8.600 350 H GLU 49 H GLU 49 -8.494 12.704 5.525 351 HA GLU 49 HA GLU 49 -10.774 12.917 3.873 352 HB2 GLU 49 HB2 GLU 49 -11.120 14.976 5.223 353 HB3 GLU 49 HB1 GLU 49 -9.549 15.561 4.696 354 HG2 GLU 49 HG2 GLU 49 -11.376 16.583 3.443 355 HG3 GLU 49 HG1 GLU 49 -10.314 15.636 2.402 356 H GLY 50 H GLY 50 -10.219 13.197 1.691 357 HA2 GLY 50 HA2 GLY 50 -8.282 14.187 0.291 358 HA3 GLY 50 HA1 GLY 50 -7.322 13.024 1.194 359 H SER 51 H SER 51 -6.819 12.253 -1.007 360 HA SER 51 HA SER 51 -8.967 10.829 -2.373 361 HB2 SER 51 HB2 SER 51 -6.051 11.164 -3.141 362 HB3 SER 51 HB1 SER 51 -7.344 10.539 -4.175 363 HG SER 51 HG SER 51 -6.580 13.013 -3.947 364 H SER 52 H SER 52 -9.325 8.699 -2.068 365 HA SER 52 HA SER 52 -7.112 7.017 -1.098 366 HB2 SER 52 HB2 SER 52 -10.005 6.187 -1.438 367 HB3 SER 52 HB1 SER 52 -8.755 5.379 -0.491 368 HG SER 52 HG SER 52 -10.470 7.018 0.450 369 H THR 53 H THR 53 -6.311 5.364 -2.375 370 HA THR 53 HA THR 53 -7.594 4.872 -4.954 371 HB THR 53 HB THR 53 -4.740 5.864 -4.785 372 HG1 THR 53 HG1 THR 53 -7.072 7.193 -4.891 373 HG21 THR 53 HG21 THR 53 -4.850 5.917 -7.234 374 HG22 THR 53 HG22 THR 53 -6.466 5.211 -7.175 375 HG23 THR 53 HG23 THR 53 -5.075 4.282 -6.613 376 H GLU 54 H GLU 54 -6.837 2.987 -6.023 377 HA GLU 54 HA GLU 54 -5.152 1.204 -4.441 378 HB2 GLU 54 HB2 GLU 54 -7.464 0.409 -4.502 379 HB3 GLU 54 HB1 GLU 54 -7.473 0.522 -6.256 380 HG2 GLU 54 HG2 GLU 54 -5.767 -1.227 -6.387 381 HG3 GLU 54 HG1 GLU 54 -5.758 -1.338 -4.623 382 H LEU 55 H LEU 55 -3.232 0.918 -5.396 383 HA LEU 55 HA LEU 55 -3.147 0.967 -8.330 384 HB2 LEU 55 HB2 LEU 55 -0.846 1.177 -6.344 385 HB3 LEU 55 HB1 LEU 55 -0.650 1.008 -8.087 386 HG LEU 55 HG LEU 55 -1.817 3.304 -6.572 387 HD11 LEU 55 HD11 LEU 55 -0.192 4.569 -8.000 388 HD12 LEU 55 HD12 LEU 55 0.466 3.007 -8.491 389 HD13 LEU 55 HD13 LEU 55 0.515 3.494 -6.795 390 HD21 LEU 55 HD21 LEU 55 -3.364 2.931 -8.369 391 HD22 LEU 55 HD22 LEU 55 -2.042 2.769 -9.525 392 HD23 LEU 55 HD23 LEU 55 -2.363 4.327 -8.764 393 H ASN 56 H ASN 56 -1.672 -0.678 -9.328 394 HA ASN 56 HA ASN 56 -1.794 -3.212 -7.876 395 HB2 ASN 56 HB2 ASN 56 -3.803 -3.200 -9.230 396 HB3 ASN 56 HB1 ASN 56 -2.886 -2.725 -10.654 397 HD21 ASN 56 HD21 ASN 56 -1.761 -4.228 -11.776 398 HD22 ASN 56 HD22 ASN 56 -1.876 -5.931 -11.487 399 H LEU 57 H LEU 57 0.126 -4.084 -7.868 400 HA LEU 57 HA LEU 57 2.041 -3.282 -9.958 401 HB2 LEU 57 HB2 LEU 57 2.499 -3.868 -7.011 402 HB3 LEU 57 HB1 LEU 57 3.785 -3.689 -8.182 403 HG LEU 57 HG LEU 57 2.043 -1.643 -6.935 404 HD11 LEU 57 HD11 LEU 57 4.312 -2.038 -6.161 405 HD12 LEU 57 HD12 LEU 57 4.133 -0.422 -6.841 406 HD13 LEU 57 HD13 LEU 57 4.929 -1.692 -7.774 407 HD21 LEU 57 HD21 LEU 57 2.542 -0.028 -8.667 408 HD22 LEU 57 HD22 LEU 57 1.560 -1.351 -9.295 409 HD23 LEU 57 HD23 LEU 57 3.288 -1.291 -9.647 410 HA PRO 58 HA PRO 58 2.666 -7.576 -10.789 411 HB2 PRO 58 HB2 PRO 58 5.427 -7.671 -10.969 412 HB3 PRO 58 HB1 PRO 58 4.344 -7.208 -12.282 413 HG2 PRO 58 HG2 PRO 58 5.995 -5.510 -10.499 414 HG3 PRO 58 HG1 PRO 58 5.512 -5.245 -12.181 415 HD2 PRO 58 HD2 PRO 58 4.386 -3.964 -10.038 416 HD3 PRO 58 HD1 PRO 58 3.549 -4.227 -11.575 417 H GLU 59 H GLU 59 3.174 -9.436 -9.763 418 HA GLU 59 HA GLU 59 3.210 -9.725 -7.068 419 HB2 GLU 59 HB2 GLU 59 4.099 -12.000 -7.452 420 HB3 GLU 59 HB1 GLU 59 2.828 -11.572 -8.590 421 HG2 GLU 59 HG2 GLU 59 4.451 -11.152 -10.312 422 HG3 GLU 59 HG1 GLU 59 5.774 -11.410 -9.178 423 H THR 60 H THR 60 5.947 -9.019 -9.050 424 HA THR 60 HA THR 60 7.843 -9.696 -6.939 425 HB THR 60 HB THR 60 8.361 -10.575 -9.133 426 HG1 THR 60 HG1 THR 60 10.095 -9.618 -7.741 427 HG21 THR 60 HG21 THR 60 7.173 -9.007 -10.523 428 HG22 THR 60 HG22 THR 60 8.864 -9.058 -11.025 429 HG23 THR 60 HG23 THR 60 8.270 -7.706 -10.060 430 H ALA 61 H ALA 61 6.035 -7.077 -7.667 431 HA ALA 61 HA ALA 61 7.986 -4.990 -7.755 432 HB1 ALA 61 HB1 ALA 61 6.081 -3.487 -7.361 433 HB2 ALA 61 HB2 ALA 61 5.058 -4.889 -7.054 434 HB3 ALA 61 HB3 ALA 61 5.761 -4.643 -8.652 435 H ASN 62 H ASN 62 8.259 -3.351 -6.054 436 HA ASN 62 HA ASN 62 7.728 -4.339 -3.364 437 HB2 ASN 62 HB2 ASN 62 10.007 -4.178 -2.639 438 HB3 ASN 62 HB1 ASN 62 9.954 -5.226 -4.051 439 HD21 ASN 62 HD21 ASN 62 11.094 -2.249 -2.739 440 HD22 ASN 62 HD22 ASN 62 12.084 -1.787 -4.083 441 H SER 63 H SER 63 7.138 -1.870 -5.231 442 HA SER 63 HA SER 63 7.061 -0.032 -3.053 443 HB2 SER 63 HB2 SER 63 8.573 1.690 -4.118 444 HB3 SER 63 HB1 SER 63 9.400 0.266 -3.489 445 HG SER 63 HG SER 63 8.596 0.271 -6.171 446 H VAL 64 H VAL 64 5.488 1.431 -3.365 447 HA VAL 64 HA VAL 64 4.539 1.906 -6.121 448 HB VAL 64 HB VAL 64 2.776 0.699 -4.971 449 HG11 VAL 64 HG11 VAL 64 2.370 2.769 -2.931 450 HG12 VAL 64 HG12 VAL 64 3.713 1.653 -2.695 451 HG13 VAL 64 HG13 VAL 64 2.080 1.029 -2.881 452 HG21 VAL 64 HG21 VAL 64 2.117 3.597 -5.124 453 HG22 VAL 64 HG22 VAL 64 0.975 2.253 -5.104 454 HG23 VAL 64 HG23 VAL 64 2.095 2.434 -6.449 455 H THR 65 H THR 65 4.337 3.989 -6.783 456 HA THR 65 HA THR 65 4.789 6.135 -4.864 457 HB THR 65 HB THR 65 4.734 5.981 -7.864 458 HG1 THR 65 HG1 THR 65 6.941 6.984 -6.491 459 HG21 THR 65 HG21 THR 65 5.146 8.431 -6.125 460 HG22 THR 65 HG22 THR 65 3.791 8.141 -7.219 461 HG23 THR 65 HG23 THR 65 5.414 8.369 -7.868 462 H LEU 66 H LEU 66 2.926 6.576 -3.859 463 HA LEU 66 HA LEU 66 0.351 6.528 -5.173 464 HB2 LEU 66 HB2 LEU 66 0.538 7.836 -2.576 465 HB3 LEU 66 HB1 LEU 66 -0.525 6.551 -3.107 466 HG LEU 66 HG LEU 66 2.337 5.983 -2.449 467 HD11 LEU 66 HD11 LEU 66 1.058 7.190 -0.606 468 HD12 LEU 66 HD12 LEU 66 1.898 5.690 -0.241 469 HD13 LEU 66 HD13 LEU 66 0.146 5.687 -0.470 470 HD21 LEU 66 HD21 LEU 66 1.341 3.763 -1.955 471 HD22 LEU 66 HD22 LEU 66 1.173 4.262 -3.641 472 HD23 LEU 66 HD23 LEU 66 -0.204 4.389 -2.545 473 H SER 67 H SER 67 -0.947 8.364 -5.553 474 HA SER 67 HA SER 67 0.406 10.949 -5.380 475 HB2 SER 67 HB2 SER 67 0.897 9.852 -7.612 476 HB3 SER 67 HB1 SER 67 -0.829 9.953 -7.957 477 HG SER 67 HG SER 67 0.864 11.761 -8.520 478 H ASP 68 H ASP 68 -1.121 12.708 -6.145 479 HA ASP 68 HA ASP 68 -3.029 13.890 -5.929 480 HB2 ASP 68 HB2 ASP 68 -4.223 11.178 -6.423 481 HB3 ASP 68 HB1 ASP 68 -5.239 12.579 -6.101 482 H LEU 69 H LEU 69 -1.702 12.541 -3.567 483 HA LEU 69 HA LEU 69 -3.733 12.065 -1.638 484 HB2 LEU 69 HB2 LEU 69 -1.081 13.166 -0.813 485 HB3 LEU 69 HB1 LEU 69 -2.076 11.944 -0.047 486 HG LEU 69 HG LEU 69 -0.447 11.487 -2.538 487 HD11 LEU 69 HD11 LEU 69 0.995 10.205 -1.055 488 HD12 LEU 69 HD12 LEU 69 0.021 10.702 0.330 489 HD13 LEU 69 HD13 LEU 69 0.936 11.903 -0.581 490 HD21 LEU 69 HD21 LEU 69 -2.234 9.955 -2.564 491 HD22 LEU 69 HD22 LEU 69 -2.241 9.830 -0.804 492 HD23 LEU 69 HD23 LEU 69 -0.943 9.070 -1.734 493 H GLN 70 H GLN 70 -3.544 13.583 0.481 494 HA GLN 70 HA GLN 70 -3.706 16.369 -0.440 495 HB2 GLN 70 HB2 GLN 70 -5.949 15.480 0.002 496 HB3 GLN 70 HB1 GLN 70 -5.459 15.029 1.631 497 HG2 GLN 70 HG2 GLN 70 -5.142 17.358 2.211 498 HG3 GLN 70 HG1 GLN 70 -5.525 17.843 0.561 499 HE21 GLN 70 HE21 GLN 70 -6.793 16.659 3.568 500 HE22 GLN 70 HE22 GLN 70 -8.459 16.944 3.207 501 HA PRO 71 HA PRO 71 -0.414 16.925 2.460 502 HB2 PRO 71 HB2 PRO 71 -0.617 19.646 2.685 503 HB3 PRO 71 HB1 PRO 71 0.197 18.796 1.369 504 HG2 PRO 71 HG2 PRO 71 -2.551 19.973 1.450 505 HG3 PRO 71 HG1 PRO 71 -1.355 20.014 0.142 506 HD2 PRO 71 HD2 PRO 71 -3.438 18.321 0.104 507 HD3 PRO 71 HD1 PRO 71 -1.851 17.863 -0.551 508 H GLY 72 H GLY 72 -0.297 16.804 4.616 509 HA2 GLY 72 HA2 GLY 72 -0.723 17.370 6.833 510 HA3 GLY 72 HA1 GLY 72 -2.056 18.384 6.297 511 H VAL 73 H VAL 73 -1.700 15.054 5.299 512 HA VAL 73 HA VAL 73 -3.948 14.320 7.056 513 HB VAL 73 HB VAL 73 -3.707 13.565 4.136 514 HG11 VAL 73 HG11 VAL 73 -6.149 12.910 4.627 515 HG12 VAL 73 HG12 VAL 73 -5.604 12.811 6.306 516 HG13 VAL 73 HG13 VAL 73 -4.848 11.799 5.070 517 HG21 VAL 73 HG21 VAL 73 -5.339 15.625 5.544 518 HG22 VAL 73 HG22 VAL 73 -5.958 14.809 4.109 519 HG23 VAL 73 HG23 VAL 73 -4.455 15.742 4.015 520 H GLN 74 H GLN 74 -4.041 12.200 7.711 521 HA GLN 74 HA GLN 74 -1.536 10.762 7.684 522 HB2 GLN 74 HB2 GLN 74 -2.738 11.020 9.770 523 HB3 GLN 74 HB1 GLN 74 -4.188 10.345 9.046 524 HG2 GLN 74 HG2 GLN 74 -3.425 8.517 10.183 525 HG3 GLN 74 HG1 GLN 74 -2.593 8.277 8.648 526 HE21 GLN 74 HE21 GLN 74 -0.351 8.700 8.522 527 HE22 GLN 74 HE22 GLN 74 0.621 8.795 9.950 528 H TYR 75 H TYR 75 -1.180 9.528 5.955 529 HA TYR 75 HA TYR 75 -3.451 8.282 4.619 530 HB2 TYR 75 HB2 TYR 75 -0.805 9.249 3.763 531 HB3 TYR 75 HB1 TYR 75 -1.330 7.737 3.013 532 HD1 TYR 75 HD1 TYR 75 -2.314 11.268 3.584 533 HD2 TYR 75 HD2 TYR 75 -2.997 7.703 1.370 534 HE1 TYR 75 HE1 TYR 75 -3.815 12.498 2.073 535 HE2 TYR 75 HE2 TYR 75 -4.490 8.921 -0.146 536 HH TYR 75 HH TYR 75 -5.755 10.844 -0.303 537 H ASN 76 H ASN 76 -3.948 6.323 5.125 538 HA ASN 76 HA ASN 76 -1.973 4.459 6.156 539 HB2 ASN 76 HB2 ASN 76 -4.925 4.089 5.574 540 HB3 ASN 76 HB1 ASN 76 -3.892 2.913 6.377 541 HD21 ASN 76 HD21 ASN 76 -6.319 4.216 7.305 542 HD22 ASN 76 HD22 ASN 76 -5.894 5.023 8.779 543 H ILE 77 H ILE 77 -0.666 3.651 4.614 544 HA ILE 77 HA ILE 77 -1.791 2.893 2.032 545 HB ILE 77 HB ILE 77 1.057 2.724 3.022 546 HG12 ILE 77 HG12 ILE 77 1.272 4.377 1.031 547 HG13 ILE 77 HG11 ILE 77 -0.407 4.716 1.351 548 HG21 ILE 77 HG21 ILE 77 -0.224 1.806 0.509 549 HG22 ILE 77 HG22 ILE 77 1.091 1.071 1.438 550 HG23 ILE 77 HG23 ILE 77 1.392 2.505 0.441 551 HD11 ILE 77 HD11 ILE 77 1.027 6.316 2.456 552 HD12 ILE 77 HD12 ILE 77 1.857 5.011 3.308 553 HD13 ILE 77 HD13 ILE 77 0.157 5.345 3.644 554 H THR 78 H THR 78 -2.734 1.054 1.895 555 HA THR 78 HA THR 78 -1.897 -1.130 3.630 556 HB THR 78 HB THR 78 -4.421 -0.797 2.020 557 HG1 THR 78 HG1 THR 78 -4.922 -0.606 4.608 558 HG21 THR 78 HG21 THR 78 -3.898 -3.130 2.585 559 HG22 THR 78 HG22 THR 78 -5.298 -2.565 3.495 560 HG23 THR 78 HG23 THR 78 -3.724 -2.683 4.282 561 H ILE 79 H ILE 79 -0.556 -2.559 2.682 562 HA ILE 79 HA ILE 79 -0.632 -2.826 -0.264 563 HB ILE 79 HB ILE 79 1.396 -4.212 1.506 564 HG12 ILE 79 HG12 ILE 79 1.939 -1.935 1.897 565 HG13 ILE 79 HG11 ILE 79 3.034 -2.522 0.645 566 HG21 ILE 79 HG21 ILE 79 2.722 -4.110 -0.624 567 HG22 ILE 79 HG22 ILE 79 1.214 -3.651 -1.421 568 HG23 ILE 79 HG23 ILE 79 1.340 -5.211 -0.601 569 HD11 ILE 79 HD11 ILE 79 2.097 -1.238 -0.978 570 HD12 ILE 79 HD12 ILE 79 1.939 -0.197 0.451 571 HD13 ILE 79 HD13 ILE 79 0.547 -1.103 -0.137 572 H TYR 80 H TYR 80 -1.057 -4.743 -1.262 573 HA TYR 80 HA TYR 80 -1.974 -6.978 0.432 574 HB2 TYR 80 HB2 TYR 80 -3.239 -5.962 -2.131 575 HB3 TYR 80 HB1 TYR 80 -3.784 -7.344 -1.197 576 HD1 TYR 80 HD2 TYR 80 -4.981 -7.018 0.907 577 HD2 TYR 80 HD1 TYR 80 -3.780 -3.692 -1.480 578 HE1 TYR 80 HE2 TYR 80 -6.572 -5.584 2.108 579 HE2 TYR 80 HE1 TYR 80 -5.375 -2.264 -0.283 580 HH TYR 80 HH TYR 80 -7.454 -2.504 1.000 581 H ALA 81 H ALA 81 -0.390 -8.561 -0.029 582 HA ALA 81 HA ALA 81 0.405 -8.959 -2.784 583 HB1 ALA 81 HB1 ALA 81 0.920 -10.562 -0.260 584 HB2 ALA 81 HB2 ALA 81 2.071 -9.596 -1.186 585 HB3 ALA 81 HB3 ALA 81 1.449 -11.112 -1.864 586 H VAL 82 H VAL 82 -0.680 -10.105 -4.227 587 HA VAL 82 HA VAL 82 -2.918 -11.734 -3.180 588 HB VAL 82 HB VAL 82 -3.819 -9.862 -4.419 589 HG11 VAL 82 HG11 VAL 82 -2.218 -10.827 -6.763 590 HG12 VAL 82 HG12 VAL 82 -1.944 -9.340 -5.855 591 HG13 VAL 82 HG13 VAL 82 -3.425 -9.541 -6.792 592 HG21 VAL 82 HG21 VAL 82 -4.037 -12.402 -6.019 593 HG22 VAL 82 HG22 VAL 82 -5.179 -11.055 -6.050 594 HG23 VAL 82 HG23 VAL 82 -4.981 -12.008 -4.579 595 H GLU 83 H GLU 83 -3.096 -13.789 -3.767 596 HA GLU 83 HA GLU 83 -1.000 -14.847 -5.536 597 HB2 GLU 83 HB2 GLU 83 -2.538 -16.411 -3.458 598 HB3 GLU 83 HB1 GLU 83 -1.105 -16.876 -4.345 599 HG2 GLU 83 HG2 GLU 83 -0.507 -16.443 -2.108 600 HG3 GLU 83 HG1 GLU 83 0.191 -15.246 -3.173 601 H GLU 84 H GLU 84 -1.779 -17.063 -6.459 602 HA GLU 84 HA GLU 84 -3.394 -16.512 -8.556 603 HB2 GLU 84 HB2 GLU 84 -3.070 -19.213 -7.257 604 HB3 GLU 84 HB1 GLU 84 -3.646 -18.936 -8.894 605 HG2 GLU 84 HG2 GLU 84 -1.462 -17.829 -9.386 606 HG3 GLU 84 HG1 GLU 84 -0.908 -18.357 -7.800 607 H ASN 85 H ASN 85 -4.553 -17.976 -5.500 608 HA ASN 85 HA ASN 85 -7.261 -17.318 -6.447 609 HB2 ASN 85 HB2 ASN 85 -8.153 -19.387 -5.599 610 HB3 ASN 85 HB1 ASN 85 -6.830 -19.747 -6.699 611 HD21 ASN 85 HD21 ASN 85 -7.912 -19.783 -3.404 612 HD22 ASN 85 HD22 ASN 85 -6.635 -20.772 -2.785 613 H GLN 86 H GLN 86 -5.065 -16.608 -4.128 614 HA GLN 86 HA GLN 86 -7.167 -16.067 -2.169 615 HB2 GLN 86 HB2 GLN 86 -5.703 -16.800 -0.362 616 HB3 GLN 86 HB1 GLN 86 -6.007 -18.104 -1.508 617 HG2 GLN 86 HG2 GLN 86 -3.830 -17.604 -2.571 618 HG3 GLN 86 HG1 GLN 86 -3.512 -16.453 -1.277 619 HE21 GLN 86 HE21 GLN 86 -2.057 -18.831 -2.015 620 HE22 GLN 86 HE22 GLN 86 -2.026 -19.841 -0.621 621 H GLU 87 H GLU 87 -6.200 -14.585 -0.390 622 HA GLU 87 HA GLU 87 -4.203 -12.754 -1.518 623 HB2 GLU 87 HB2 GLU 87 -6.608 -11.918 0.107 624 HB3 GLU 87 HB1 GLU 87 -5.408 -10.859 -0.612 625 HG2 GLU 87 HG2 GLU 87 -7.125 -10.656 -2.085 626 HG3 GLU 87 HG1 GLU 87 -6.199 -11.939 -2.844 627 H SER 88 H SER 88 -2.593 -12.215 -0.152 628 HA SER 88 HA SER 88 -2.351 -13.514 2.363 629 HB2 SER 88 HB2 SER 88 -0.260 -12.198 2.568 630 HB3 SER 88 HB1 SER 88 -0.395 -12.978 0.991 631 HG SER 88 HG SER 88 -0.822 -11.082 0.051 632 H THR 89 H THR 89 -1.466 -11.968 4.254 633 HA THR 89 HA THR 89 -3.673 -10.504 5.228 634 HB THR 89 HB THR 89 -1.815 -9.676 6.897 635 HG1 THR 89 HG1 THR 89 0.094 -10.575 6.666 636 HG21 THR 89 HG21 THR 89 -3.558 -11.279 7.466 637 HG22 THR 89 HG22 THR 89 -2.008 -11.791 8.135 638 HG23 THR 89 HG23 THR 89 -2.645 -12.571 6.686 639 HA PRO 90 HA PRO 90 -2.658 -6.496 3.627 640 HB2 PRO 90 HB2 PRO 90 -3.929 -4.878 5.346 641 HB3 PRO 90 HB1 PRO 90 -4.809 -5.997 4.300 642 HG2 PRO 90 HG2 PRO 90 -4.229 -6.187 7.210 643 HG3 PRO 90 HG1 PRO 90 -5.634 -6.768 6.302 644 HD2 PRO 90 HD2 PRO 90 -3.424 -8.282 7.155 645 HD3 PRO 90 HD1 PRO 90 -4.688 -8.797 6.024 646 H VAL 91 H VAL 91 -0.945 -5.221 3.642 647 HA VAL 91 HA VAL 91 0.663 -4.589 5.971 648 HB VAL 91 HB VAL 91 0.628 -3.658 3.110 649 HG11 VAL 91 HG11 VAL 91 2.298 -2.568 5.367 650 HG12 VAL 91 HG12 VAL 91 1.073 -1.701 4.443 651 HG13 VAL 91 HG13 VAL 91 2.561 -2.222 3.662 652 HG21 VAL 91 HG21 VAL 91 1.723 -5.802 3.569 653 HG22 VAL 91 HG22 VAL 91 2.786 -4.998 4.726 654 HG23 VAL 91 HG23 VAL 91 2.857 -4.568 3.015 655 H VAL 92 H VAL 92 0.072 -2.920 7.353 656 HA VAL 92 HA VAL 92 -1.355 -0.679 6.086 657 HB VAL 92 HB VAL 92 -1.688 -1.385 9.000 658 HG11 VAL 92 HG11 VAL 92 -3.200 0.406 7.102 659 HG12 VAL 92 HG12 VAL 92 -2.150 0.916 8.426 660 HG13 VAL 92 HG13 VAL 92 -3.666 0.083 8.773 661 HG21 VAL 92 HG21 VAL 92 -2.564 -3.248 7.682 662 HG22 VAL 92 HG22 VAL 92 -3.514 -2.126 6.710 663 HG23 VAL 92 HG23 VAL 92 -3.876 -2.333 8.423 664 H ILE 93 H ILE 93 0.151 0.810 5.811 665 HA ILE 93 HA ILE 93 1.820 1.511 8.133 666 HB ILE 93 HB ILE 93 3.491 2.401 6.402 667 HG12 ILE 93 HG12 ILE 93 2.182 0.406 4.580 668 HG13 ILE 93 HG11 ILE 93 1.806 2.109 4.511 669 HG21 ILE 93 HG21 ILE 93 3.929 0.456 7.780 670 HG22 ILE 93 HG22 ILE 93 4.539 0.195 6.147 671 HG23 ILE 93 HG23 ILE 93 3.033 -0.568 6.659 672 HD11 ILE 93 HD11 ILE 93 3.457 1.613 2.865 673 HD12 ILE 93 HD12 ILE 93 4.483 0.850 4.083 674 HD13 ILE 93 HD13 ILE 93 4.189 2.591 4.150 675 H GLN 94 H GLN 94 1.162 3.370 8.949 676 HA GLN 94 HA GLN 94 -0.234 5.244 7.197 677 HB2 GLN 94 HB2 GLN 94 -0.984 6.301 9.345 678 HB3 GLN 94 HB1 GLN 94 -1.550 4.662 9.071 679 HG2 GLN 94 HG2 GLN 94 0.163 3.816 10.587 680 HG3 GLN 94 HG1 GLN 94 0.732 5.462 10.864 681 HE21 GLN 94 HE21 GLN 94 -2.639 4.671 10.480 682 HE22 GLN 94 HE22 GLN 94 -3.091 4.953 12.123 683 H GLN 95 H GLN 95 0.750 6.910 6.445 684 HA GLN 95 HA GLN 95 2.847 8.231 8.035 685 HB2 GLN 95 HB2 GLN 95 3.085 6.938 5.502 686 HB3 GLN 95 HB1 GLN 95 3.265 8.662 5.239 687 HG2 GLN 95 HG2 GLN 95 4.872 6.960 7.127 688 HG3 GLN 95 HG1 GLN 95 5.413 7.611 5.584 689 HE21 GLN 95 HE21 GLN 95 3.977 10.177 6.133 690 HE22 GLN 95 HE22 GLN 95 5.009 11.013 7.244 691 H GLU 96 H GLU 96 2.525 10.411 8.277 692 HA GLU 96 HA GLU 96 0.184 11.564 7.005 693 HB2 GLU 96 HB2 GLU 96 2.123 12.695 9.022 694 HB3 GLU 96 HB1 GLU 96 0.789 13.609 8.339 695 HG2 GLU 96 HG2 GLU 96 -0.704 11.738 9.231 696 HG3 GLU 96 HG1 GLU 96 0.698 11.266 10.192 697 H THR 97 H THR 97 0.167 12.995 5.409 698 HA THR 97 HA THR 97 2.504 13.346 3.827 699 HB THR 97 HB THR 97 1.022 14.865 2.481 700 HG1 THR 97 HG1 THR 97 -1.283 14.678 3.159 701 HG21 THR 97 HG21 THR 97 1.167 12.448 2.021 702 HG22 THR 97 HG22 THR 97 -0.445 13.080 1.686 703 HG23 THR 97 HG23 THR 97 -0.147 12.161 3.161 704 H THR 98 H THR 98 4.074 14.715 4.283 705 HA THR 98 HA THR 98 3.858 16.774 6.213 706 HB THR 98 HB THR 98 6.033 16.440 4.141 707 HG1 THR 98 HG1 THR 98 5.569 15.099 6.613 708 HG21 THR 98 HG21 THR 98 6.035 17.639 6.917 709 HG22 THR 98 HG22 THR 98 6.177 18.520 5.396 710 HG23 THR 98 HG23 THR 98 7.462 17.424 5.904 711 H GLY 99 H GLY 99 3.689 16.645 2.734 712 HA2 GLY 99 HA2 GLY 99 2.333 18.126 1.501 713 HA3 GLY 99 HA1 GLY 99 2.498 19.308 2.777 714 H THR 100 H THR 100 3.605 21.005 2.203 715 HA THR 100 HA THR 100 5.891 20.666 0.381 716 HB THR 100 HB THR 100 4.039 23.054 0.449 717 HG1 THR 100 HG1 THR 100 3.986 20.668 -1.055 718 HG21 THR 100 HG21 THR 100 5.128 23.660 -1.635 719 HG22 THR 100 HG22 THR 100 6.199 22.268 -1.488 720 HG23 THR 100 HG23 THR 100 6.274 23.573 -0.303 721 HA PRO 101 HA PRO 101 8.115 22.372 3.877 722 HB2 PRO 101 HB2 PRO 101 10.136 22.959 1.784 723 HB3 PRO 101 HB1 PRO 101 10.311 22.064 3.295 724 HG2 PRO 101 HG2 PRO 101 10.246 20.798 0.948 725 HG3 PRO 101 HG1 PRO 101 9.472 20.108 2.386 726 HD2 PRO 101 HD2 PRO 101 8.233 21.494 0.047 727 HD3 PRO 101 HD1 PRO 101 7.649 20.096 0.971 728 H ARG 102 H ARG 102 6.793 24.186 4.178 729 HA ARG 102 HA ARG 102 6.385 26.381 4.433 730 HB2 ARG 102 HB2 ARG 102 8.790 26.606 4.834 731 HB3 ARG 102 HB1 ARG 102 9.064 26.798 3.108 732 HG2 ARG 102 HG2 ARG 102 7.733 28.844 3.123 733 HG3 ARG 102 HG1 ARG 102 7.461 28.651 4.854 734 HD2 ARG 102 HD2 ARG 102 9.881 28.801 5.234 735 HD3 ARG 102 HD1 ARG 102 10.127 29.038 3.503 736 HE ARG 102 HE ARG 102 8.379 30.996 4.152 737 HH11 ARG 102 HH11 ARG 102 11.487 30.033 5.444 738 HH12 ARG 102 HH12 ARG 102 11.897 31.632 5.979 739 HH21 ARG 102 HH21 ARG 102 8.925 33.092 4.829 740 HH22 ARG 102 HH22 ARG 102 10.444 33.375 5.615 741 H SER 103 H SER 103 8.169 26.678 1.362 742 HA SER 103 HA SER 103 5.633 27.452 0.090 743 HB2 SER 103 HB2 SER 103 8.232 28.972 -0.207 744 HB3 SER 103 HB1 SER 103 6.686 29.382 -0.949 745 HG SER 103 HG SER 103 5.911 29.466 1.338 746 H ASP 104 H ASP 104 9.057 26.688 -0.456 747 HA ASP 104 HA ASP 104 8.447 25.747 -3.146 748 HB2 ASP 104 HB2 ASP 104 10.909 26.521 -1.698 749 HB3 ASP 104 HB1 ASP 104 11.082 25.211 -2.861 750 H GLY 105 H GLY 105 9.425 23.657 -3.831 751 HA2 GLY 105 HA2 GLY 105 10.109 21.424 -3.169 752 HA3 GLY 105 HA1 GLY 105 9.223 21.661 -1.669 753 H THR 106 H THR 106 8.346 22.260 -5.037 754 HA THR 106 HA THR 106 6.380 20.137 -4.951 755 HB THR 106 HB THR 106 5.021 21.871 -4.064 756 HG1 THR 106 HG1 THR 106 3.794 20.879 -5.564 757 HG21 THR 106 HG21 THR 106 4.747 24.073 -5.148 758 HG22 THR 106 HG22 THR 106 6.039 23.655 -6.274 759 HG23 THR 106 HG23 THR 106 6.386 23.806 -4.552 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 -13.133 -19.311 4.699 2 H2 GLY 1 HT2 GLY 1 -14.208 -20.485 4.135 3 H3 GLY 1 HT3 GLY 1 -14.339 -18.890 3.595 4 HA2 GLY 1 HA1 GLY 1 -13.316 -20.333 1.925 5 HA3 GLY 1 HA2 GLY 1 -12.259 -19.026 2.442 6 H SER 2 H SER 2 -10.336 -20.027 2.013 7 HA SER 2 HA SER 2 -9.785 -22.675 3.019 8 HB2 SER 2 HB2 SER 2 -7.959 -20.659 1.688 9 HB3 SER 2 HB1 SER 2 -7.574 -22.352 1.996 10 HG SER 2 HG SER 2 -8.577 -21.508 -0.165 11 H HIS 3 H HIS 3 -8.956 -23.134 4.942 12 HA HIS 3 HA HIS 3 -7.706 -20.955 6.479 13 HB2 HIS 3 HB2 HIS 3 -9.830 -21.633 7.472 14 HB3 HIS 3 HB1 HIS 3 -9.312 -23.312 7.490 15 HD1 HIS 3 HD1 HIS 3 -8.398 -24.085 9.658 16 HD2 HIS 3 HD2 HIS 3 -8.048 -19.966 9.209 17 HE1 HIS 3 HE1 HIS 3 -7.456 -23.244 11.832 18 HE2 HIS 3 HE2 HIS 3 -7.087 -20.778 11.469 19 H MET 4 H MET 4 -7.763 -24.512 6.168 20 HA MET 4 HA MET 4 -4.906 -24.612 6.007 21 HB2 MET 4 HB2 MET 4 -5.254 -24.347 8.456 22 HB3 MET 4 HB1 MET 4 -6.223 -25.811 8.454 23 HG2 MET 4 HG2 MET 4 -4.289 -27.101 7.723 24 HG3 MET 4 HG1 MET 4 -3.313 -25.635 7.710 25 HE1 MET 4 HE1 MET 4 -4.466 -24.156 10.370 26 HE2 MET 4 HE2 MET 4 -2.773 -24.212 9.884 27 HE3 MET 4 HE3 MET 4 -3.237 -24.687 11.517 28 H GLY 5 H GLY 5 -4.406 -26.271 4.715 29 HA2 GLY 5 HA2 GLY 5 -5.234 -28.879 4.876 30 HA3 GLY 5 HA1 GLY 5 -6.443 -28.100 3.866 31 H THR 6 H THR 6 -6.069 -28.206 1.763 32 HA THR 6 HA THR 6 -3.508 -29.011 0.750 33 HB THR 6 HB THR 6 -4.705 -28.614 -1.502 34 HG1 THR 6 HG1 THR 6 -6.982 -28.484 -1.321 35 HG21 THR 6 HG21 THR 6 -5.994 -30.708 -1.263 36 HG22 THR 6 HG22 THR 6 -5.784 -30.618 0.485 37 HG23 THR 6 HG23 THR 6 -4.382 -30.833 -0.562 38 H THR 7 H THR 7 -5.078 -26.035 1.368 39 HA THR 7 HA THR 7 -3.258 -24.569 -0.390 40 HB THR 7 HB THR 7 -4.627 -22.572 0.313 41 HG1 THR 7 HG1 THR 7 -6.600 -24.370 1.201 42 HG21 THR 7 HG21 THR 7 -6.559 -23.154 -1.088 43 HG22 THR 7 HG22 THR 7 -6.103 -24.856 -1.000 44 HG23 THR 7 HG23 THR 7 -5.044 -23.700 -1.807 45 H THR 8 H THR 8 -1.386 -23.955 0.436 46 HA THR 8 HA THR 8 -0.875 -23.770 3.243 47 HB THR 8 HB THR 8 0.790 -22.698 0.948 48 HG1 THR 8 HG1 THR 8 1.527 -24.691 0.657 49 HG21 THR 8 HG21 THR 8 1.574 -23.532 3.745 50 HG22 THR 8 HG22 THR 8 1.457 -21.871 3.164 51 HG23 THR 8 HG23 THR 8 2.670 -22.958 2.489 52 H ALA 9 H ALA 9 -0.653 -21.892 4.488 53 HA ALA 9 HA ALA 9 -2.110 -19.594 3.494 54 HB1 ALA 9 HB1 ALA 9 -1.967 -18.757 5.775 55 HB2 ALA 9 HB2 ALA 9 -0.878 -20.074 6.205 56 HB3 ALA 9 HB3 ALA 9 -2.548 -20.419 5.758 57 HA PRO 10 HA PRO 10 1.810 -17.769 2.285 58 HB2 PRO 10 HB2 PRO 10 0.765 -15.700 0.908 59 HB3 PRO 10 HB1 PRO 10 0.748 -17.348 0.267 60 HG2 PRO 10 HG2 PRO 10 -1.440 -15.829 1.636 61 HG3 PRO 10 HG1 PRO 10 -1.523 -16.835 0.179 62 HD2 PRO 10 HD2 PRO 10 -2.266 -17.730 2.625 63 HD3 PRO 10 HD1 PRO 10 -1.623 -18.779 1.397 64 H ASP 11 H ASP 11 2.715 -15.484 2.460 65 HA ASP 11 HA ASP 11 1.605 -14.178 4.858 66 HB2 ASP 11 HB2 ASP 11 4.498 -14.581 4.080 67 HB3 ASP 11 HB1 ASP 11 3.979 -13.490 5.359 68 H ALA 12 H ALA 12 1.997 -11.911 5.028 69 HA ALA 12 HA ALA 12 2.081 -10.549 2.440 70 HB1 ALA 12 HB1 ALA 12 1.403 -9.528 5.203 71 HB2 ALA 12 HB2 ALA 12 0.242 -10.007 3.965 72 HB3 ALA 12 HB3 ALA 12 1.280 -8.605 3.706 73 HA PRO 13 HA PRO 13 6.180 -8.968 3.036 74 HB2 PRO 13 HB2 PRO 13 5.206 -6.230 2.484 75 HB3 PRO 13 HB1 PRO 13 6.409 -7.189 1.615 76 HG2 PRO 13 HG2 PRO 13 4.005 -6.748 0.561 77 HG3 PRO 13 HG1 PRO 13 4.799 -8.323 0.383 78 HD2 PRO 13 HD2 PRO 13 2.643 -7.493 2.284 79 HD3 PRO 13 HD1 PRO 13 2.768 -8.982 1.317 80 HA PRO 14 HA PRO 14 6.287 -7.483 7.322 81 HB2 PRO 14 HB2 PRO 14 9.032 -6.887 6.287 82 HB3 PRO 14 HB1 PRO 14 8.553 -7.620 7.822 83 HG2 PRO 14 HG2 PRO 14 9.493 -9.130 5.849 84 HG3 PRO 14 HG1 PRO 14 8.148 -9.690 6.860 85 HD2 PRO 14 HD2 PRO 14 8.123 -8.688 4.059 86 HD3 PRO 14 HD1 PRO 14 7.079 -9.892 4.840 87 H ASP 15 H ASP 15 6.466 -5.442 8.281 88 HA ASP 15 HA ASP 15 5.090 -3.495 7.042 89 HB2 ASP 15 HB2 ASP 15 5.845 -1.917 8.751 90 HB3 ASP 15 HB1 ASP 15 5.486 -3.492 9.443 91 HA PRO 16 HA PRO 16 7.977 -2.054 3.914 92 HB2 PRO 16 HB2 PRO 16 5.545 -0.510 3.192 93 HB3 PRO 16 HB1 PRO 16 6.549 -1.559 2.165 94 HG2 PRO 16 HG2 PRO 16 4.173 -2.397 2.951 95 HG3 PRO 16 HG1 PRO 16 5.551 -3.508 3.009 96 HD2 PRO 16 HD2 PRO 16 4.338 -1.914 5.255 97 HD3 PRO 16 HD1 PRO 16 4.722 -3.658 5.217 98 H THR 17 H THR 17 9.045 -0.178 3.585 99 HA THR 17 HA THR 17 8.496 1.957 5.545 100 HB THR 17 HB THR 17 11.107 1.354 4.142 101 HG1 THR 17 HG1 THR 17 10.038 0.479 6.625 102 HG21 THR 17 HG21 THR 17 10.474 3.062 6.552 103 HG22 THR 17 HG22 THR 17 10.865 3.662 4.941 104 HG23 THR 17 HG23 THR 17 12.077 2.782 5.872 105 H VAL 18 H VAL 18 8.030 3.840 4.936 106 HA VAL 18 HA VAL 18 7.758 4.512 2.143 107 HB VAL 18 HB VAL 18 7.241 6.119 4.648 108 HG11 VAL 18 HG11 VAL 18 7.837 7.632 2.838 109 HG12 VAL 18 HG12 VAL 18 6.115 7.746 3.196 110 HG13 VAL 18 HG13 VAL 18 6.663 6.855 1.769 111 HG21 VAL 18 HG21 VAL 18 5.334 4.877 2.672 112 HG22 VAL 18 HG22 VAL 18 4.906 5.762 4.135 113 HG23 VAL 18 HG23 VAL 18 5.729 4.207 4.254 114 H ASP 19 H ASP 19 9.196 5.454 0.924 115 HA ASP 19 HA ASP 19 11.749 6.254 2.062 116 HB2 ASP 19 HB2 ASP 19 11.828 4.768 0.158 117 HB3 ASP 19 HB1 ASP 19 10.824 5.857 -0.790 118 H GLN 20 H GLN 20 9.024 7.672 0.369 119 HA GLN 20 HA GLN 20 10.192 10.330 0.788 120 HB2 GLN 20 HB2 GLN 20 8.937 9.361 -1.785 121 HB3 GLN 20 HB1 GLN 20 9.373 11.030 -1.450 122 HG2 GLN 20 HG2 GLN 20 11.695 10.469 -1.354 123 HG3 GLN 20 HG1 GLN 20 11.328 8.749 -1.473 124 HE21 GLN 20 HE21 GLN 20 12.525 8.458 -3.307 125 HE22 GLN 20 HE22 GLN 20 12.065 9.073 -4.837 126 H VAL 21 H VAL 21 8.815 11.791 1.526 127 HA VAL 21 HA VAL 21 5.940 11.223 1.376 128 HB VAL 21 HB VAL 21 7.386 12.287 3.806 129 HG11 VAL 21 HG11 VAL 21 4.458 11.699 3.411 130 HG12 VAL 21 HG12 VAL 21 5.183 13.303 3.482 131 HG13 VAL 21 HG13 VAL 21 5.218 12.257 4.903 132 HG21 VAL 21 HG21 VAL 21 7.703 9.886 3.532 133 HG22 VAL 21 HG22 VAL 21 5.959 9.665 3.391 134 HG23 VAL 21 HG23 VAL 21 6.657 10.233 4.909 135 H ASP 22 H ASP 22 5.061 12.769 0.189 136 HA ASP 22 HA ASP 22 5.900 15.554 0.650 137 HB2 ASP 22 HB2 ASP 22 5.264 14.194 -1.975 138 HB3 ASP 22 HB1 ASP 22 5.299 15.943 -1.791 139 H ASP 23 H ASP 23 4.001 16.815 -0.885 140 HA ASP 23 HA ASP 23 1.701 16.722 0.738 141 HB2 ASP 23 HB2 ASP 23 0.735 18.192 -1.154 142 HB3 ASP 23 HB1 ASP 23 2.121 18.789 -0.261 143 H THR 24 H THR 24 1.861 16.077 -2.739 144 HA THR 24 HA THR 24 -0.550 14.400 -2.469 145 HB THR 24 HB THR 24 -0.915 14.949 -4.864 146 HG1 THR 24 HG1 THR 24 1.283 16.750 -4.498 147 HG21 THR 24 HG21 THR 24 -0.498 17.371 -3.102 148 HG22 THR 24 HG22 THR 24 -1.919 16.323 -3.084 149 HG23 THR 24 HG23 THR 24 -1.549 17.283 -4.519 150 H SER 25 H SER 25 1.989 13.288 -1.910 151 HA SER 25 HA SER 25 2.119 11.089 -3.635 152 HB2 SER 25 HB2 SER 25 4.366 11.456 -4.632 153 HB3 SER 25 HB1 SER 25 3.162 12.597 -5.226 154 HG SER 25 HG SER 25 4.032 14.184 -3.945 155 H ILE 26 H ILE 26 3.063 9.439 -2.644 156 HA ILE 26 HA ILE 26 5.161 9.834 -0.655 157 HB ILE 26 HB ILE 26 2.458 8.644 0.004 158 HG12 ILE 26 HG12 ILE 26 4.174 10.661 1.454 159 HG13 ILE 26 HG11 ILE 26 2.749 11.031 0.493 160 HG21 ILE 26 HG21 ILE 26 4.112 7.009 0.691 161 HG22 ILE 26 HG22 ILE 26 3.400 7.798 2.100 162 HG23 ILE 26 HG23 ILE 26 5.011 8.260 1.551 163 HD11 ILE 26 HD11 ILE 26 2.169 11.084 2.814 164 HD12 ILE 26 HD12 ILE 26 2.851 9.475 3.066 165 HD13 ILE 26 HD13 ILE 26 1.406 9.675 2.076 166 H VAL 27 H VAL 27 6.493 7.919 -0.513 167 HA VAL 27 HA VAL 27 5.684 5.864 -2.481 168 HB VAL 27 HB VAL 27 8.506 6.720 -1.845 169 HG11 VAL 27 HG11 VAL 27 7.771 4.300 -2.659 170 HG12 VAL 27 HG12 VAL 27 9.242 5.077 -3.259 171 HG13 VAL 27 HG13 VAL 27 7.772 5.105 -4.233 172 HG21 VAL 27 HG21 VAL 27 7.307 8.459 -3.076 173 HG22 VAL 27 HG22 VAL 27 6.847 7.279 -4.303 174 HG23 VAL 27 HG23 VAL 27 8.544 7.702 -4.079 175 H VAL 28 H VAL 28 5.734 3.760 -1.787 176 HA VAL 28 HA VAL 28 7.006 3.329 0.825 177 HB VAL 28 HB VAL 28 5.190 2.450 1.777 178 HG11 VAL 28 HG11 VAL 28 3.711 3.753 -0.460 179 HG12 VAL 28 HG12 VAL 28 4.398 4.580 0.936 180 HG13 VAL 28 HG13 VAL 28 3.114 3.400 1.160 181 HG21 VAL 28 HG21 VAL 28 5.216 0.470 0.404 182 HG22 VAL 28 HG22 VAL 28 4.299 1.323 -0.841 183 HG23 VAL 28 HG23 VAL 28 3.559 0.998 0.730 184 H ARG 29 H ARG 29 7.913 1.293 1.196 185 HA ARG 29 HA ARG 29 8.239 -0.409 -1.193 186 HB2 ARG 29 HB2 ARG 29 10.494 0.397 0.655 187 HB3 ARG 29 HB1 ARG 29 10.621 -0.568 -0.808 188 HG2 ARG 29 HG2 ARG 29 9.841 1.435 -2.090 189 HG3 ARG 29 HG1 ARG 29 9.974 2.361 -0.597 190 HD2 ARG 29 HD2 ARG 29 12.328 1.886 -0.457 191 HD3 ARG 29 HD1 ARG 29 12.230 0.811 -1.850 192 HE ARG 29 HE ARG 29 11.366 3.475 -2.439 193 HH11 ARG 29 HH11 ARG 29 14.154 1.394 -2.126 194 HH12 ARG 29 HH12 ARG 29 15.151 2.350 -3.175 195 HH21 ARG 29 HH21 ARG 29 12.664 4.742 -3.836 196 HH22 ARG 29 HH22 ARG 29 14.306 4.264 -4.140 197 H TRP 30 H TRP 30 7.881 -2.441 -0.808 198 HA TRP 30 HA TRP 30 7.722 -3.315 2.006 199 HB2 TRP 30 HB2 TRP 30 5.964 -4.939 1.177 200 HB3 TRP 30 HB1 TRP 30 5.513 -3.242 1.087 201 HD1 TRP 30 HD1 TRP 30 6.573 -6.125 -1.178 202 HE1 TRP 30 HE1 TRP 30 5.750 -5.644 -3.564 203 HE3 TRP 30 HE3 TRP 30 4.731 -1.457 -0.418 204 HZ2 TRP 30 HZ2 TRP 30 4.420 -3.560 -4.919 205 HZ3 TRP 30 HZ3 TRP 30 3.664 -0.297 -2.300 206 HH2 TRP 30 HH2 TRP 30 3.505 -1.314 -4.491 207 H SER 31 H SER 31 8.654 -5.188 2.649 208 HA SER 31 HA SER 31 10.405 -6.584 0.838 209 HB2 SER 31 HB2 SER 31 9.666 -7.163 3.720 210 HB3 SER 31 HB1 SER 31 10.933 -7.990 2.813 211 HG SER 31 HG SER 31 11.114 -5.243 2.765 212 H ARG 32 H ARG 32 9.005 -7.382 -0.686 213 HA ARG 32 HA ARG 32 6.629 -8.684 -0.460 214 HB2 ARG 32 HB2 ARG 32 7.441 -9.927 -2.601 215 HB3 ARG 32 HB1 ARG 32 7.256 -8.179 -2.631 216 HG2 ARG 32 HG2 ARG 32 9.898 -9.159 -1.828 217 HG3 ARG 32 HG1 ARG 32 9.444 -9.485 -3.500 218 HD2 ARG 32 HD2 ARG 32 9.064 -7.131 -3.888 219 HD3 ARG 32 HD1 ARG 32 9.350 -6.759 -2.189 220 HE ARG 32 HE ARG 32 11.419 -7.823 -4.010 221 HH11 ARG 32 HH11 ARG 32 10.452 -5.679 -1.393 222 HH12 ARG 32 HH12 ARG 32 12.048 -5.039 -1.176 223 HH21 ARG 32 HH21 ARG 32 13.500 -6.949 -3.723 224 HH22 ARG 32 HH22 ARG 32 13.772 -5.747 -2.502 225 HA PRO 33 HA PRO 33 7.269 -12.485 1.550 226 HB2 PRO 33 HB2 PRO 33 5.114 -13.803 0.174 227 HB3 PRO 33 HB1 PRO 33 5.076 -13.022 1.758 228 HG2 PRO 33 HG2 PRO 33 3.733 -12.121 -0.476 229 HG3 PRO 33 HG1 PRO 33 4.187 -11.104 0.911 230 HD2 PRO 33 HD2 PRO 33 5.512 -11.411 -1.740 231 HD3 PRO 33 HD1 PRO 33 5.275 -9.953 -0.765 232 H GLN 34 H GLN 34 7.762 -14.708 1.388 233 HA GLN 34 HA GLN 34 8.971 -15.560 -1.095 234 HB2 GLN 34 HB2 GLN 34 8.584 -17.105 1.471 235 HB3 GLN 34 HB1 GLN 34 9.654 -17.520 0.139 236 HG2 GLN 34 HG2 GLN 34 10.976 -15.517 0.567 237 HG3 GLN 34 HG1 GLN 34 9.907 -15.102 1.906 238 HE21 GLN 34 HE21 GLN 34 12.382 -17.258 0.776 239 HE22 GLN 34 HE22 GLN 34 12.775 -17.935 2.318 240 H ALA 35 H ALA 35 5.956 -15.672 0.387 241 HA ALA 35 HA ALA 35 4.791 -18.028 -0.525 242 HB1 ALA 35 HB1 ALA 35 2.722 -16.983 -0.132 243 HB2 ALA 35 HB2 ALA 35 3.374 -15.379 -0.480 244 HB3 ALA 35 HB3 ALA 35 3.831 -16.219 1.010 245 HA PRO 36 HA PRO 36 4.453 -17.275 -4.940 246 HB2 PRO 36 HB2 PRO 36 2.080 -18.990 -4.926 247 HB3 PRO 36 HB1 PRO 36 3.636 -19.257 -5.714 248 HG2 PRO 36 HG2 PRO 36 2.810 -20.703 -3.579 249 HG3 PRO 36 HG1 PRO 36 4.516 -20.348 -3.897 250 HD2 PRO 36 HD2 PRO 36 2.643 -19.066 -1.950 251 HD3 PRO 36 HD1 PRO 36 4.362 -19.472 -1.764 252 H ILE 37 H ILE 37 3.661 -15.346 -5.464 253 HA ILE 37 HA ILE 37 0.828 -14.761 -4.932 254 HB ILE 37 HB ILE 37 1.447 -12.399 -4.555 255 HG12 ILE 37 HG12 ILE 37 4.196 -13.463 -5.078 256 HG13 ILE 37 HG11 ILE 37 3.403 -12.057 -5.759 257 HG21 ILE 37 HG21 ILE 37 1.307 -14.010 -2.617 258 HG22 ILE 37 HG22 ILE 37 2.298 -12.572 -2.312 259 HG23 ILE 37 HG23 ILE 37 3.070 -14.131 -2.670 260 HD11 ILE 37 HD11 ILE 37 4.743 -12.376 -3.128 261 HD12 ILE 37 HD12 ILE 37 3.503 -11.148 -3.344 262 HD13 ILE 37 HD13 ILE 37 4.952 -11.120 -4.352 263 H THR 38 H THR 38 -0.233 -13.517 -6.556 264 HA THR 38 HA THR 38 1.060 -13.691 -9.171 265 HB THR 38 HB THR 38 -1.274 -13.165 -10.024 266 HG1 THR 38 HG1 THR 38 -2.838 -13.960 -8.277 267 HG21 THR 38 HG21 THR 38 -0.303 -15.367 -10.124 268 HG22 THR 38 HG22 THR 38 -2.020 -15.451 -9.752 269 HG23 THR 38 HG23 THR 38 -0.829 -15.695 -8.474 270 H GLY 39 H GLY 39 -0.174 -11.267 -6.953 271 HA2 GLY 39 HA2 GLY 39 1.061 -9.217 -8.509 272 HA3 GLY 39 HA1 GLY 39 -0.692 -9.153 -8.597 273 H TYR 40 H TYR 40 -0.103 -6.978 -7.632 274 HA TYR 40 HA TYR 40 -0.549 -7.253 -4.739 275 HB2 TYR 40 HB2 TYR 40 1.488 -5.553 -6.118 276 HB3 TYR 40 HB1 TYR 40 0.690 -4.929 -4.677 277 HD1 TYR 40 HD2 TYR 40 1.992 -8.313 -5.579 278 HD2 TYR 40 HD1 TYR 40 2.096 -5.036 -2.876 279 HE1 TYR 40 HE2 TYR 40 3.610 -9.510 -4.189 280 HE2 TYR 40 HE1 TYR 40 3.683 -6.249 -1.466 281 HH TYR 40 HH TYR 40 5.280 -9.064 -2.527 282 H ARG 41 H ARG 41 -2.291 -6.173 -4.063 283 HA ARG 41 HA ARG 41 -3.211 -3.877 -5.670 284 HB2 ARG 41 HB2 ARG 41 -4.661 -4.847 -3.253 285 HB3 ARG 41 HB1 ARG 41 -5.279 -4.082 -4.714 286 HG2 ARG 41 HG2 ARG 41 -4.112 -6.849 -4.641 287 HG3 ARG 41 HG1 ARG 41 -5.840 -6.523 -4.425 288 HD2 ARG 41 HD2 ARG 41 -4.169 -5.865 -6.851 289 HD3 ARG 41 HD1 ARG 41 -5.372 -7.150 -6.726 290 HE ARG 41 HE ARG 41 -6.360 -4.477 -6.202 291 HH11 ARG 41 HH11 ARG 41 -5.870 -6.976 -8.611 292 HH12 ARG 41 HH12 ARG 41 -7.072 -6.342 -9.689 293 HH21 ARG 41 HH21 ARG 41 -7.918 -3.631 -7.611 294 HH22 ARG 41 HH22 ARG 41 -8.244 -4.441 -9.121 295 H ILE 42 H ILE 42 -3.456 -1.840 -4.651 296 HA ILE 42 HA ILE 42 -2.281 -1.656 -1.953 297 HB ILE 42 HB ILE 42 -1.475 0.168 -4.193 298 HG12 ILE 42 HG12 ILE 42 0.163 -2.029 -2.971 299 HG13 ILE 42 HG11 ILE 42 -0.734 -2.215 -4.469 300 HG21 ILE 42 HG21 ILE 42 -0.194 -0.236 -1.496 301 HG22 ILE 42 HG22 ILE 42 -1.378 1.024 -1.833 302 HG23 ILE 42 HG23 ILE 42 0.166 1.021 -2.682 303 HD11 ILE 42 HD11 ILE 42 0.583 -0.423 -5.462 304 HD12 ILE 42 HD12 ILE 42 1.586 -1.761 -4.900 305 HD13 ILE 42 HD13 ILE 42 1.489 -0.277 -3.957 306 H VAL 43 H VAL 43 -3.848 -0.804 -0.727 307 HA VAL 43 HA VAL 43 -5.404 1.400 -1.926 308 HB VAL 43 HB VAL 43 -6.211 -0.438 0.330 309 HG11 VAL 43 HG11 VAL 43 -6.983 1.784 0.792 310 HG12 VAL 43 HG12 VAL 43 -8.334 0.766 0.303 311 HG13 VAL 43 HG13 VAL 43 -7.649 1.929 -0.835 312 HG21 VAL 43 HG21 VAL 43 -7.970 -1.165 -1.167 313 HG22 VAL 43 HG22 VAL 43 -6.397 -1.408 -1.929 314 HG23 VAL 43 HG23 VAL 43 -7.409 -0.042 -2.404 315 H TYR 44 H TYR 44 -4.607 3.258 -1.335 316 HA TYR 44 HA TYR 44 -3.886 3.640 1.470 317 HB2 TYR 44 HB2 TYR 44 -2.648 5.723 0.460 318 HB3 TYR 44 HB1 TYR 44 -1.893 4.136 0.425 319 HD1 TYR 44 HD2 TYR 44 -2.165 2.763 -1.720 320 HD2 TYR 44 HD1 TYR 44 -2.911 6.940 -1.528 321 HE1 TYR 44 HE2 TYR 44 -1.884 2.900 -4.145 322 HE2 TYR 44 HE1 TYR 44 -2.626 7.105 -3.960 323 HH TYR 44 HH TYR 44 -1.688 5.966 -5.780 324 H SER 45 H SER 45 -4.963 4.926 2.622 325 HA SER 45 HA SER 45 -6.845 6.792 1.335 326 HB2 SER 45 HB2 SER 45 -7.684 4.913 3.545 327 HB3 SER 45 HB1 SER 45 -8.709 5.956 2.557 328 HG SER 45 HG SER 45 -7.643 4.577 0.768 329 HA PRO 46 HA PRO 46 -5.666 9.476 4.722 330 HB2 PRO 46 HB2 PRO 46 -7.522 11.378 4.303 331 HB3 PRO 46 HB1 PRO 46 -6.148 11.158 3.216 332 HG2 PRO 46 HG2 PRO 46 -8.981 10.267 2.896 333 HG3 PRO 46 HG1 PRO 46 -7.886 10.973 1.694 334 HD2 PRO 46 HD2 PRO 46 -8.402 8.297 1.900 335 HD3 PRO 46 HD1 PRO 46 -6.896 8.964 1.242 336 H SER 47 H SER 47 -6.181 9.467 6.807 337 HA SER 47 HA SER 47 -8.359 7.981 7.797 338 HB2 SER 47 HB2 SER 47 -6.218 8.227 8.996 339 HB3 SER 47 HB1 SER 47 -6.567 9.933 9.264 340 HG SER 47 HG SER 47 -8.231 7.818 10.165 341 H VAL 48 H VAL 48 -7.999 11.373 7.098 342 HA VAL 48 HA VAL 48 -10.507 11.989 8.484 343 HB VAL 48 HB VAL 48 -9.962 14.349 7.966 344 HG11 VAL 48 HG11 VAL 48 -7.914 12.763 9.502 345 HG12 VAL 48 HG12 VAL 48 -9.397 13.476 10.131 346 HG13 VAL 48 HG13 VAL 48 -8.082 14.515 9.587 347 HG21 VAL 48 HG21 VAL 48 -7.375 13.182 6.960 348 HG22 VAL 48 HG22 VAL 48 -7.678 14.898 7.231 349 HG23 VAL 48 HG23 VAL 48 -8.589 14.024 5.999 350 H GLU 49 H GLU 49 -10.053 10.598 5.836 351 HA GLU 49 HA GLU 49 -11.246 10.297 3.934 352 HB2 GLU 49 HB2 GLU 49 -12.829 12.691 4.874 353 HB3 GLU 49 HB1 GLU 49 -13.224 11.737 3.450 354 HG2 GLU 49 HG2 GLU 49 -13.141 10.735 6.287 355 HG3 GLU 49 HG1 GLU 49 -14.591 11.096 5.353 356 H GLY 50 H GLY 50 -11.473 11.186 1.766 357 HA2 GLY 50 HA2 GLY 50 -10.873 13.441 0.587 358 HA3 GLY 50 HA1 GLY 50 -9.296 13.088 1.282 359 H SER 51 H SER 51 -8.070 12.569 -0.448 360 HA SER 51 HA SER 51 -9.138 10.953 -2.589 361 HB2 SER 51 HB2 SER 51 -6.280 11.905 -2.157 362 HB3 SER 51 HB1 SER 51 -6.992 11.314 -3.664 363 HG SER 51 HG SER 51 -8.532 13.280 -2.773 364 H SER 52 H SER 52 -9.236 8.809 -2.484 365 HA SER 52 HA SER 52 -7.043 7.340 -1.153 366 HB2 SER 52 HB2 SER 52 -9.905 6.422 -1.578 367 HB3 SER 52 HB1 SER 52 -8.620 5.474 -0.823 368 HG SER 52 HG SER 52 -10.020 7.707 0.156 369 H THR 53 H THR 53 -6.173 5.553 -2.301 370 HA THR 53 HA THR 53 -7.246 5.105 -4.982 371 HB THR 53 HB THR 53 -4.362 5.921 -4.589 372 HG1 THR 53 HG1 THR 53 -6.649 7.381 -4.963 373 HG21 THR 53 HG21 THR 53 -5.970 5.448 -7.101 374 HG22 THR 53 HG22 THR 53 -4.709 4.389 -6.465 375 HG23 THR 53 HG23 THR 53 -4.300 6.008 -7.032 376 H GLU 54 H GLU 54 -6.694 3.146 -5.896 377 HA GLU 54 HA GLU 54 -5.060 1.326 -4.294 378 HB2 GLU 54 HB2 GLU 54 -7.460 0.699 -4.295 379 HB3 GLU 54 HB1 GLU 54 -7.424 0.629 -6.052 380 HG2 GLU 54 HG2 GLU 54 -5.651 -1.132 -5.853 381 HG3 GLU 54 HG1 GLU 54 -5.960 -1.147 -4.118 382 H LEU 55 H LEU 55 -3.175 1.005 -5.309 383 HA LEU 55 HA LEU 55 -3.162 1.053 -8.240 384 HB2 LEU 55 HB2 LEU 55 -0.827 1.167 -6.289 385 HB3 LEU 55 HB1 LEU 55 -0.664 1.050 -8.039 386 HG LEU 55 HG LEU 55 -1.778 3.311 -6.431 387 HD11 LEU 55 HD11 LEU 55 0.522 2.997 -8.316 388 HD12 LEU 55 HD12 LEU 55 0.534 3.520 -6.629 389 HD13 LEU 55 HD13 LEU 55 -0.128 4.576 -7.876 390 HD21 LEU 55 HD21 LEU 55 -2.313 4.428 -8.573 391 HD22 LEU 55 HD22 LEU 55 -3.328 3.024 -8.249 392 HD23 LEU 55 HD23 LEU 55 -2.003 2.905 -9.407 393 H ASN 56 H ASN 56 -1.999 -0.579 -9.416 394 HA ASN 56 HA ASN 56 -2.022 -3.183 -8.036 395 HB2 ASN 56 HB2 ASN 56 -3.821 -2.966 -9.752 396 HB3 ASN 56 HB1 ASN 56 -2.584 -2.671 -10.968 397 HD21 ASN 56 HD21 ASN 56 -4.106 -5.019 -8.945 398 HD22 ASN 56 HD22 ASN 56 -3.391 -6.420 -9.663 399 H LEU 57 H LEU 57 -0.047 -3.989 -7.825 400 HA LEU 57 HA LEU 57 1.992 -3.130 -9.769 401 HB2 LEU 57 HB2 LEU 57 2.259 -3.692 -6.805 402 HB3 LEU 57 HB1 LEU 57 3.632 -3.637 -7.884 403 HG LEU 57 HG LEU 57 2.014 -1.447 -6.759 404 HD11 LEU 57 HD11 LEU 57 4.303 -1.957 -6.062 405 HD12 LEU 57 HD12 LEU 57 4.154 -0.338 -6.740 406 HD13 LEU 57 HD13 LEU 57 4.862 -1.637 -7.700 407 HD21 LEU 57 HD21 LEU 57 3.189 -1.251 -9.517 408 HD22 LEU 57 HD22 LEU 57 2.553 0.085 -8.556 409 HD23 LEU 57 HD23 LEU 57 1.475 -1.195 -9.111 410 HA PRO 58 HA PRO 58 2.643 -7.344 -10.770 411 HB2 PRO 58 HB2 PRO 58 5.420 -7.402 -10.831 412 HB3 PRO 58 HB1 PRO 58 4.375 -6.939 -12.174 413 HG2 PRO 58 HG2 PRO 58 5.926 -5.239 -10.310 414 HG3 PRO 58 HG1 PRO 58 5.477 -4.944 -11.996 415 HD2 PRO 58 HD2 PRO 58 4.267 -3.734 -9.864 416 HD3 PRO 58 HD1 PRO 58 3.464 -4.004 -11.419 417 H GLU 59 H GLU 59 3.066 -9.245 -9.840 418 HA GLU 59 HA GLU 59 3.104 -9.752 -7.178 419 HB2 GLU 59 HB2 GLU 59 4.072 -11.991 -7.802 420 HB3 GLU 59 HB1 GLU 59 2.675 -11.491 -8.749 421 HG2 GLU 59 HG2 GLU 59 4.194 -10.734 -10.537 422 HG3 GLU 59 HG1 GLU 59 5.560 -11.328 -9.597 423 H THR 60 H THR 60 5.828 -8.846 -9.073 424 HA THR 60 HA THR 60 7.674 -9.549 -6.899 425 HB THR 60 HB THR 60 8.182 -10.666 -9.009 426 HG1 THR 60 HG1 THR 60 10.279 -10.336 -8.784 427 HG21 THR 60 HG21 THR 60 7.202 -9.081 -10.561 428 HG22 THR 60 HG22 THR 60 8.890 -9.378 -10.980 429 HG23 THR 60 HG23 THR 60 8.435 -7.887 -10.153 430 H ALA 61 H ALA 61 5.929 -7.054 -7.490 431 HA ALA 61 HA ALA 61 7.844 -4.933 -7.810 432 HB1 ALA 61 HB1 ALA 61 5.515 -4.627 -8.482 433 HB2 ALA 61 HB2 ALA 61 5.987 -3.443 -7.265 434 HB3 ALA 61 HB3 ALA 61 5.003 -4.833 -6.809 435 H ASN 62 H ASN 62 8.115 -3.246 -6.099 436 HA ASN 62 HA ASN 62 8.009 -4.369 -3.401 437 HB2 ASN 62 HB2 ASN 62 10.330 -3.947 -2.960 438 HB3 ASN 62 HB1 ASN 62 10.203 -4.996 -4.367 439 HD21 ASN 62 HD21 ASN 62 12.375 -3.244 -3.521 440 HD22 ASN 62 HD22 ASN 62 12.654 -2.157 -4.836 441 H SER 63 H SER 63 7.203 -1.810 -5.225 442 HA SER 63 HA SER 63 7.112 -0.049 -2.984 443 HB2 SER 63 HB2 SER 63 8.608 1.711 -3.959 444 HB3 SER 63 HB1 SER 63 9.463 0.250 -3.469 445 HG SER 63 HG SER 63 8.998 -0.313 -5.857 446 H VAL 64 H VAL 64 5.512 1.400 -3.258 447 HA VAL 64 HA VAL 64 4.550 1.878 -6.006 448 HB VAL 64 HB VAL 64 2.778 0.729 -4.837 449 HG11 VAL 64 HG11 VAL 64 2.458 2.780 -2.764 450 HG12 VAL 64 HG12 VAL 64 3.790 1.644 -2.571 451 HG13 VAL 64 HG13 VAL 64 2.146 1.045 -2.725 452 HG21 VAL 64 HG21 VAL 64 2.109 2.502 -6.276 453 HG22 VAL 64 HG22 VAL 64 2.183 3.644 -4.933 454 HG23 VAL 64 HG23 VAL 64 1.011 2.324 -4.913 455 H THR 65 H THR 65 4.450 3.937 -6.716 456 HA THR 65 HA THR 65 4.918 6.124 -4.867 457 HB THR 65 HB THR 65 4.667 5.908 -7.853 458 HG1 THR 65 HG1 THR 65 6.697 5.680 -6.156 459 HG21 THR 65 HG21 THR 65 5.099 8.417 -6.205 460 HG22 THR 65 HG22 THR 65 3.674 8.052 -7.187 461 HG23 THR 65 HG23 THR 65 5.241 8.319 -7.959 462 H LEU 66 H LEU 66 3.082 6.411 -3.721 463 HA LEU 66 HA LEU 66 0.477 6.539 -4.936 464 HB2 LEU 66 HB2 LEU 66 0.825 7.914 -2.394 465 HB3 LEU 66 HB1 LEU 66 -0.313 6.662 -2.839 466 HG LEU 66 HG LEU 66 2.545 6.039 -2.184 467 HD11 LEU 66 HD11 LEU 66 1.233 7.271 -0.383 468 HD12 LEU 66 HD12 LEU 66 2.047 5.766 0.019 469 HD13 LEU 66 HD13 LEU 66 0.303 5.778 -0.255 470 HD21 LEU 66 HD21 LEU 66 -0.003 4.450 -2.288 471 HD22 LEU 66 HD22 LEU 66 1.543 3.824 -1.703 472 HD23 LEU 66 HD23 LEU 66 1.367 4.317 -3.391 473 H SER 67 H SER 67 -0.656 8.440 -5.387 474 HA SER 67 HA SER 67 0.655 10.972 -5.015 475 HB2 SER 67 HB2 SER 67 0.513 9.627 -7.688 476 HB3 SER 67 HB1 SER 67 0.382 11.390 -7.599 477 HG SER 67 HG SER 67 2.454 9.979 -6.293 478 H ASP 68 H ASP 68 -0.700 12.742 -6.045 479 HA ASP 68 HA ASP 68 -2.648 13.882 -6.057 480 HB2 ASP 68 HB2 ASP 68 -3.864 11.161 -6.579 481 HB3 ASP 68 HB1 ASP 68 -4.775 12.668 -6.600 482 H LEU 69 H LEU 69 -1.453 12.629 -3.658 483 HA LEU 69 HA LEU 69 -3.567 12.090 -1.810 484 HB2 LEU 69 HB2 LEU 69 -0.915 13.163 -0.905 485 HB3 LEU 69 HB1 LEU 69 -1.969 11.993 -0.137 486 HG LEU 69 HG LEU 69 -0.258 11.423 -2.548 487 HD11 LEU 69 HD11 LEU 69 0.051 10.660 0.348 488 HD12 LEU 69 HD12 LEU 69 1.040 11.830 -0.525 489 HD13 LEU 69 HD13 LEU 69 1.076 10.128 -0.985 490 HD21 LEU 69 HD21 LEU 69 -2.221 9.890 -0.891 491 HD22 LEU 69 HD22 LEU 69 -0.881 9.041 -1.670 492 HD23 LEU 69 HD23 LEU 69 -2.059 9.929 -2.649 493 H GLN 70 H GLN 70 -3.393 13.624 0.334 494 HA GLN 70 HA GLN 70 -3.512 16.409 -0.605 495 HB2 GLN 70 HB2 GLN 70 -5.755 15.419 -0.069 496 HB3 GLN 70 HB1 GLN 70 -5.212 15.217 1.592 497 HG2 GLN 70 HG2 GLN 70 -4.966 17.600 1.846 498 HG3 GLN 70 HG1 GLN 70 -5.364 17.854 0.147 499 HE21 GLN 70 HE21 GLN 70 -6.588 17.141 3.300 500 HE22 GLN 70 HE22 GLN 70 -8.265 17.297 2.910 501 HA PRO 71 HA PRO 71 -0.193 16.967 2.268 502 HB2 PRO 71 HB2 PRO 71 -0.386 19.689 2.497 503 HB3 PRO 71 HB1 PRO 71 0.412 18.837 1.172 504 HG2 PRO 71 HG2 PRO 71 -2.326 20.026 1.282 505 HG3 PRO 71 HG1 PRO 71 -1.144 20.056 -0.041 506 HD2 PRO 71 HD2 PRO 71 -3.241 18.374 -0.047 507 HD3 PRO 71 HD1 PRO 71 -1.667 17.909 -0.724 508 H GLY 72 H GLY 72 -0.061 16.818 4.412 509 HA2 GLY 72 HA2 GLY 72 -0.458 17.301 6.646 510 HA3 GLY 72 HA1 GLY 72 -1.726 18.417 6.157 511 H VAL 73 H VAL 73 -1.458 15.051 5.182 512 HA VAL 73 HA VAL 73 -3.811 14.414 6.826 513 HB VAL 73 HB VAL 73 -3.534 13.757 3.886 514 HG11 VAL 73 HG11 VAL 73 -4.729 11.974 4.720 515 HG12 VAL 73 HG12 VAL 73 -5.998 13.136 4.298 516 HG13 VAL 73 HG13 VAL 73 -5.493 12.949 5.978 517 HG21 VAL 73 HG21 VAL 73 -5.152 15.781 5.360 518 HG22 VAL 73 HG22 VAL 73 -5.758 15.046 3.877 519 HG23 VAL 73 HG23 VAL 73 -4.237 15.951 3.855 520 H GLN 74 H GLN 74 -3.853 12.410 7.668 521 HA GLN 74 HA GLN 74 -1.529 10.768 7.616 522 HB2 GLN 74 HB2 GLN 74 -3.197 11.209 9.500 523 HB3 GLN 74 HB1 GLN 74 -4.259 10.087 8.676 524 HG2 GLN 74 HG2 GLN 74 -3.196 8.829 10.342 525 HG3 GLN 74 HG1 GLN 74 -2.425 8.376 8.826 526 HE21 GLN 74 HE21 GLN 74 -0.282 8.970 8.461 527 HE22 GLN 74 HE22 GLN 74 0.743 9.538 9.732 528 H TYR 75 H TYR 75 -1.131 9.585 5.811 529 HA TYR 75 HA TYR 75 -3.416 8.344 4.476 530 HB2 TYR 75 HB2 TYR 75 -0.761 9.276 3.574 531 HB3 TYR 75 HB1 TYR 75 -1.370 7.804 2.812 532 HD1 TYR 75 HD1 TYR 75 -2.115 11.377 3.426 533 HD2 TYR 75 HD2 TYR 75 -3.161 7.857 1.281 534 HE1 TYR 75 HE1 TYR 75 -3.611 12.699 1.990 535 HE2 TYR 75 HE2 TYR 75 -4.651 9.169 -0.160 536 HH TYR 75 HH TYR 75 -5.817 11.197 -0.217 537 H ASN 76 H ASN 76 -3.901 6.417 5.113 538 HA ASN 76 HA ASN 76 -1.880 4.596 6.110 539 HB2 ASN 76 HB2 ASN 76 -4.877 4.358 5.793 540 HB3 ASN 76 HB1 ASN 76 -3.863 3.030 6.348 541 HD21 ASN 76 HD21 ASN 76 -4.784 2.903 8.351 542 HD22 ASN 76 HD22 ASN 76 -4.590 4.118 9.565 543 H ILE 77 H ILE 77 -0.654 3.647 4.642 544 HA ILE 77 HA ILE 77 -1.765 2.856 2.063 545 HB ILE 77 HB ILE 77 1.061 2.613 3.102 546 HG12 ILE 77 HG12 ILE 77 1.344 4.297 1.125 547 HG13 ILE 77 HG11 ILE 77 -0.315 4.703 1.477 548 HG21 ILE 77 HG21 ILE 77 -0.209 1.760 0.562 549 HG22 ILE 77 HG22 ILE 77 1.092 0.996 1.491 550 HG23 ILE 77 HG23 ILE 77 1.417 2.436 0.512 551 HD11 ILE 77 HD11 ILE 77 0.309 5.223 3.789 552 HD12 ILE 77 HD12 ILE 77 1.191 6.206 2.619 553 HD13 ILE 77 HD13 ILE 77 1.988 4.844 3.406 554 H THR 78 H THR 78 -2.651 0.984 1.851 555 HA THR 78 HA THR 78 -1.846 -1.187 3.631 556 HB THR 78 HB THR 78 -4.358 -0.852 2.006 557 HG1 THR 78 HG1 THR 78 -3.582 0.275 4.332 558 HG21 THR 78 HG21 THR 78 -3.837 -3.191 2.540 559 HG22 THR 78 HG22 THR 78 -5.236 -2.638 3.463 560 HG23 THR 78 HG23 THR 78 -3.659 -2.766 4.243 561 H ILE 79 H ILE 79 -0.524 -2.650 2.706 562 HA ILE 79 HA ILE 79 -0.535 -2.901 -0.241 563 HB ILE 79 HB ILE 79 1.431 -4.302 1.586 564 HG12 ILE 79 HG12 ILE 79 1.988 -2.038 2.006 565 HG13 ILE 79 HG11 ILE 79 3.096 -2.604 0.754 566 HG21 ILE 79 HG21 ILE 79 2.826 -4.196 -0.497 567 HG22 ILE 79 HG22 ILE 79 1.345 -3.727 -1.342 568 HG23 ILE 79 HG23 ILE 79 1.438 -5.292 -0.526 569 HD11 ILE 79 HD11 ILE 79 2.016 -0.278 0.589 570 HD12 ILE 79 HD12 ILE 79 0.618 -1.163 -0.026 571 HD13 ILE 79 HD13 ILE 79 2.179 -1.291 -0.852 572 H TYR 80 H TYR 80 -1.152 -4.732 -1.271 573 HA TYR 80 HA TYR 80 -2.016 -7.013 0.391 574 HB2 TYR 80 HB2 TYR 80 -3.301 -6.011 -2.162 575 HB3 TYR 80 HB1 TYR 80 -3.833 -7.385 -1.209 576 HD1 TYR 80 HD2 TYR 80 -3.728 -3.699 -1.410 577 HD2 TYR 80 HD1 TYR 80 -5.125 -7.077 0.793 578 HE1 TYR 80 HE2 TYR 80 -5.300 -2.261 -0.191 579 HE2 TYR 80 HE1 TYR 80 -6.702 -5.634 2.006 580 HH TYR 80 HH TYR 80 -7.029 -3.340 2.581 581 H ALA 81 H ALA 81 -0.502 -8.569 -0.018 582 HA ALA 81 HA ALA 81 0.487 -9.054 -2.697 583 HB1 ALA 81 HB1 ALA 81 1.959 -9.645 -0.862 584 HB2 ALA 81 HB2 ALA 81 1.475 -11.139 -1.687 585 HB3 ALA 81 HB3 ALA 81 0.725 -10.680 -0.146 586 H VAL 82 H VAL 82 -0.719 -10.035 -4.197 587 HA VAL 82 HA VAL 82 -2.994 -11.653 -3.191 588 HB VAL 82 HB VAL 82 -3.809 -9.730 -4.421 589 HG11 VAL 82 HG11 VAL 82 -1.896 -9.257 -5.807 590 HG12 VAL 82 HG12 VAL 82 -3.367 -9.384 -6.770 591 HG13 VAL 82 HG13 VAL 82 -2.209 -10.715 -6.749 592 HG21 VAL 82 HG21 VAL 82 -5.190 -10.821 -6.077 593 HG22 VAL 82 HG22 VAL 82 -5.035 -11.846 -4.647 594 HG23 VAL 82 HG23 VAL 82 -4.093 -12.206 -6.101 595 H GLU 83 H GLU 83 -3.203 -13.744 -3.792 596 HA GLU 83 HA GLU 83 -1.197 -14.739 -5.703 597 HB2 GLU 83 HB2 GLU 83 -2.473 -16.694 -3.886 598 HB3 GLU 83 HB1 GLU 83 -0.821 -16.576 -4.458 599 HG2 GLU 83 HG2 GLU 83 -0.581 -16.222 -2.233 600 HG3 GLU 83 HG1 GLU 83 -0.619 -14.600 -2.897 601 H GLU 84 H GLU 84 -1.950 -16.922 -6.681 602 HA GLU 84 HA GLU 84 -3.876 -16.422 -8.537 603 HB2 GLU 84 HB2 GLU 84 -3.219 -19.155 -7.440 604 HB3 GLU 84 HB1 GLU 84 -3.928 -18.810 -9.011 605 HG2 GLU 84 HG2 GLU 84 -1.868 -17.575 -9.609 606 HG3 GLU 84 HG1 GLU 84 -1.163 -18.084 -8.077 607 H ASN 85 H ASN 85 -4.417 -17.893 -5.362 608 HA ASN 85 HA ASN 85 -7.239 -18.231 -6.095 609 HB2 ASN 85 HB2 ASN 85 -7.338 -20.002 -4.389 610 HB3 ASN 85 HB1 ASN 85 -6.155 -20.344 -5.643 611 HD21 ASN 85 HD21 ASN 85 -6.369 -21.354 -2.911 612 HD22 ASN 85 HD22 ASN 85 -4.851 -20.993 -2.162 613 H GLN 86 H GLN 86 -5.196 -16.494 -3.913 614 HA GLN 86 HA GLN 86 -7.560 -15.696 -2.387 615 HB2 GLN 86 HB2 GLN 86 -5.056 -16.798 -1.104 616 HB3 GLN 86 HB1 GLN 86 -6.355 -15.995 -0.236 617 HG2 GLN 86 HG2 GLN 86 -7.900 -17.759 -0.924 618 HG3 GLN 86 HG1 GLN 86 -6.588 -18.566 -1.781 619 HE21 GLN 86 HE21 GLN 86 -4.931 -19.539 -0.587 620 HE22 GLN 86 HE22 GLN 86 -5.125 -19.933 1.077 621 H GLU 87 H GLU 87 -6.912 -13.977 -0.730 622 HA GLU 87 HA GLU 87 -4.798 -12.233 -1.798 623 HB2 GLU 87 HB2 GLU 87 -7.270 -11.391 -0.260 624 HB3 GLU 87 HB1 GLU 87 -6.068 -10.326 -0.970 625 HG2 GLU 87 HG2 GLU 87 -7.846 -10.209 -2.442 626 HG3 GLU 87 HG1 GLU 87 -6.759 -11.360 -3.212 627 H SER 88 H SER 88 -3.114 -12.042 -0.448 628 HA SER 88 HA SER 88 -3.122 -13.298 2.090 629 HB2 SER 88 HB2 SER 88 -1.074 -11.443 0.865 630 HB3 SER 88 HB1 SER 88 -0.812 -12.470 2.275 631 HG SER 88 HG SER 88 -1.607 -13.469 -0.272 632 H THR 89 H THR 89 -2.037 -12.068 3.990 633 HA THR 89 HA THR 89 -3.902 -10.276 5.037 634 HB THR 89 HB THR 89 -1.870 -9.826 6.676 635 HG1 THR 89 HG1 THR 89 -0.143 -10.921 6.147 636 HG21 THR 89 HG21 THR 89 -3.257 -12.496 6.437 637 HG22 THR 89 HG22 THR 89 -3.891 -11.067 7.253 638 HG23 THR 89 HG23 THR 89 -2.457 -11.878 7.883 639 HA PRO 90 HA PRO 90 -2.419 -6.466 3.443 640 HB2 PRO 90 HB2 PRO 90 -3.741 -4.745 5.024 641 HB3 PRO 90 HB1 PRO 90 -4.563 -5.781 3.854 642 HG2 PRO 90 HG2 PRO 90 -4.444 -5.986 6.796 643 HG3 PRO 90 HG1 PRO 90 -5.688 -6.556 5.677 644 HD2 PRO 90 HD2 PRO 90 -3.619 -8.071 6.899 645 HD3 PRO 90 HD1 PRO 90 -4.788 -8.620 5.687 646 H VAL 91 H VAL 91 -0.759 -5.174 3.604 647 HA VAL 91 HA VAL 91 0.728 -4.615 6.028 648 HB VAL 91 HB VAL 91 0.812 -3.604 3.196 649 HG11 VAL 91 HG11 VAL 91 2.652 -2.148 3.817 650 HG12 VAL 91 HG12 VAL 91 2.479 -2.623 5.501 651 HG13 VAL 91 HG13 VAL 91 1.195 -1.719 4.704 652 HG21 VAL 91 HG21 VAL 91 3.038 -4.547 3.173 653 HG22 VAL 91 HG22 VAL 91 1.857 -5.776 3.637 654 HG23 VAL 91 HG23 VAL 91 2.878 -5.023 4.864 655 H VAL 92 H VAL 92 0.101 -2.952 7.414 656 HA VAL 92 HA VAL 92 -1.305 -0.711 6.124 657 HB VAL 92 HB VAL 92 -1.690 -1.413 9.029 658 HG11 VAL 92 HG11 VAL 92 -2.171 0.876 8.444 659 HG12 VAL 92 HG12 VAL 92 -3.686 0.025 8.747 660 HG13 VAL 92 HG13 VAL 92 -3.173 0.352 7.089 661 HG21 VAL 92 HG21 VAL 92 -2.518 -3.294 7.701 662 HG22 VAL 92 HG22 VAL 92 -3.467 -2.184 6.712 663 HG23 VAL 92 HG23 VAL 92 -3.852 -2.391 8.420 664 H ILE 93 H ILE 93 0.226 0.754 5.865 665 HA ILE 93 HA ILE 93 1.811 1.521 8.227 666 HB ILE 93 HB ILE 93 3.497 2.433 6.497 667 HG12 ILE 93 HG12 ILE 93 2.348 0.307 4.720 668 HG13 ILE 93 HG11 ILE 93 1.836 1.969 4.590 669 HG21 ILE 93 HG21 ILE 93 3.962 0.552 7.971 670 HG22 ILE 93 HG22 ILE 93 4.655 0.284 6.372 671 HG23 ILE 93 HG23 ILE 93 3.170 -0.546 6.839 672 HD11 ILE 93 HD11 ILE 93 4.192 2.628 4.256 673 HD12 ILE 93 HD12 ILE 93 3.540 1.574 2.983 674 HD13 ILE 93 HD13 ILE 93 4.608 0.911 4.225 675 H GLN 94 H GLN 94 1.065 3.394 8.981 676 HA GLN 94 HA GLN 94 -0.263 5.193 7.105 677 HB2 GLN 94 HB2 GLN 94 -1.187 6.313 9.084 678 HB3 GLN 94 HB1 GLN 94 -1.561 4.598 9.064 679 HG2 GLN 94 HG2 GLN 94 0.243 4.205 10.680 680 HG3 GLN 94 HG1 GLN 94 0.565 5.936 10.720 681 HE21 GLN 94 HE21 GLN 94 -2.336 6.522 10.482 682 HE22 GLN 94 HE22 GLN 94 -2.984 6.234 12.059 683 H GLN 95 H GLN 95 0.817 6.761 6.261 684 HA GLN 95 HA GLN 95 2.831 8.159 7.887 685 HB2 GLN 95 HB2 GLN 95 3.205 6.786 5.423 686 HB3 GLN 95 HB1 GLN 95 3.344 8.503 5.088 687 HG2 GLN 95 HG2 GLN 95 4.925 6.938 7.114 688 HG3 GLN 95 HG1 GLN 95 5.510 7.548 5.570 689 HE21 GLN 95 HE21 GLN 95 4.021 10.092 5.916 690 HE22 GLN 95 HE22 GLN 95 4.940 10.999 7.065 691 H GLU 96 H GLU 96 2.425 10.266 8.125 692 HA GLU 96 HA GLU 96 0.168 11.406 6.707 693 HB2 GLU 96 HB2 GLU 96 0.233 11.800 9.065 694 HB3 GLU 96 HB1 GLU 96 1.873 12.428 8.977 695 HG2 GLU 96 HG2 GLU 96 1.039 14.331 7.662 696 HG3 GLU 96 HG1 GLU 96 -0.601 13.702 7.825 697 H THR 97 H THR 97 0.250 12.921 5.214 698 HA THR 97 HA THR 97 2.661 13.355 3.788 699 HB THR 97 HB THR 97 1.224 14.940 2.459 700 HG1 THR 97 HG1 THR 97 -1.153 14.351 3.271 701 HG21 THR 97 HG21 THR 97 -0.180 13.199 1.516 702 HG22 THR 97 HG22 THR 97 -0.010 12.232 2.982 703 HG23 THR 97 HG23 THR 97 1.389 12.513 1.945 704 H THR 98 H THR 98 4.198 14.765 4.278 705 HA THR 98 HA THR 98 3.949 16.701 6.328 706 HB THR 98 HB THR 98 6.095 16.606 4.206 707 HG1 THR 98 HG1 THR 98 7.096 15.030 5.425 708 HG21 THR 98 HG21 THR 98 6.136 17.485 7.096 709 HG22 THR 98 HG22 THR 98 6.158 18.549 5.690 710 HG23 THR 98 HG23 THR 98 7.521 17.476 6.005 711 H GLY 99 H GLY 99 3.730 16.774 2.844 712 HA2 GLY 99 HA2 GLY 99 2.214 18.377 1.859 713 HA3 GLY 99 HA1 GLY 99 2.754 19.537 3.048 714 H THR 100 H THR 100 3.015 20.855 1.086 715 HA THR 100 HA THR 100 5.236 20.238 -0.645 716 HB THR 100 HB THR 100 3.628 22.784 -0.387 717 HG1 THR 100 HG1 THR 100 3.291 20.424 -1.929 718 HG21 THR 100 HG21 THR 100 5.750 23.151 -1.481 719 HG22 THR 100 HG22 THR 100 4.422 23.276 -2.629 720 HG23 THR 100 HG23 THR 100 5.425 21.827 -2.598 721 HA PRO 101 HA PRO 101 8.269 22.083 2.127 722 HB2 PRO 101 HB2 PRO 101 9.897 22.100 -0.344 723 HB3 PRO 101 HB1 PRO 101 10.255 21.381 1.228 724 HG2 PRO 101 HG2 PRO 101 9.618 19.857 -0.871 725 HG3 PRO 101 HG1 PRO 101 9.063 19.450 0.764 726 HD2 PRO 101 HD2 PRO 101 7.557 20.722 -1.489 727 HD3 PRO 101 HD1 PRO 101 7.018 19.500 -0.317 728 H ARG 102 H ARG 102 7.108 24.050 2.273 729 HA ARG 102 HA ARG 102 8.045 26.141 0.422 730 HB2 ARG 102 HB2 ARG 102 5.803 27.176 0.548 731 HB3 ARG 102 HB1 ARG 102 5.756 25.579 -0.185 732 HG2 ARG 102 HG2 ARG 102 5.079 24.681 2.064 733 HG3 ARG 102 HG1 ARG 102 4.900 26.356 2.591 734 HD2 ARG 102 HD2 ARG 102 3.439 25.061 0.292 735 HD3 ARG 102 HD1 ARG 102 2.765 25.380 1.888 736 HE ARG 102 HE ARG 102 3.767 27.769 0.736 737 HH11 ARG 102 HH11 ARG 102 1.103 25.515 0.534 738 HH12 ARG 102 HH12 ARG 102 -0.010 26.685 -0.099 739 HH21 ARG 102 HH21 ARG 102 2.303 29.318 -0.104 740 HH22 ARG 102 HH22 ARG 102 0.668 28.850 -0.451 741 H SER 103 H SER 103 8.650 25.137 3.240 742 HA SER 103 HA SER 103 8.424 27.754 4.557 743 HB2 SER 103 HB2 SER 103 6.843 26.202 5.601 744 HB3 SER 103 HB1 SER 103 8.132 25.028 5.849 745 HG SER 103 HG SER 103 8.809 26.104 7.529 746 H ASP 104 H ASP 104 10.481 28.412 4.089 747 HA ASP 104 HA ASP 104 12.740 26.689 4.619 748 HB2 ASP 104 HB2 ASP 104 14.113 28.532 3.850 749 HB3 ASP 104 HB1 ASP 104 12.765 28.319 2.740 750 H GLY 105 H GLY 105 14.271 26.982 6.239 751 HA2 GLY 105 HA2 GLY 105 15.161 27.938 8.194 752 HA3 GLY 105 HA1 GLY 105 13.735 28.958 8.317 753 H THR 106 H THR 106 11.821 26.860 8.023 754 HA THR 106 HA THR 106 12.320 25.128 10.311 755 HB THR 106 HB THR 106 11.241 26.924 11.411 756 HG1 THR 106 HG1 THR 106 10.349 24.938 12.007 757 HG21 THR 106 HG21 THR 106 9.161 26.915 9.224 758 HG22 THR 106 HG22 THR 106 10.393 28.148 9.489 759 HG23 THR 106 HG23 THR 106 9.113 27.911 10.678 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 -16.819 -20.367 -1.786 2 H2 GLY 1 HT2 GLY 1 -17.405 -19.946 -0.259 3 H3 GLY 1 HT3 GLY 1 -17.938 -21.363 -1.003 4 HA2 GLY 1 HA1 GLY 1 -15.722 -22.301 -0.871 5 HA3 GLY 1 HA2 GLY 1 -15.170 -20.824 -0.099 6 H SER 2 H SER 2 -15.775 -23.867 0.603 7 HA SER 2 HA SER 2 -17.556 -23.759 2.790 8 HB2 SER 2 HB2 SER 2 -15.345 -25.757 2.276 9 HB3 SER 2 HB1 SER 2 -16.747 -25.991 3.319 10 HG SER 2 HG SER 2 -17.271 -26.932 1.408 11 H HIS 3 H HIS 3 -14.176 -23.049 2.448 12 HA HIS 3 HA HIS 3 -12.514 -22.489 3.885 13 HB2 HIS 3 HB2 HIS 3 -14.919 -21.395 5.330 14 HB3 HIS 3 HB1 HIS 3 -13.293 -21.204 5.973 15 HD1 HIS 3 HD1 HIS 3 -11.834 -19.408 4.951 16 HD2 HIS 3 HD2 HIS 3 -15.388 -19.993 2.874 17 HE1 HIS 3 HE1 HIS 3 -11.968 -17.522 3.299 18 HE2 HIS 3 HE2 HIS 3 -14.030 -18.002 1.936 19 H MET 4 H MET 4 -13.333 -25.116 3.991 20 HA MET 4 HA MET 4 -13.577 -25.926 6.758 21 HB2 MET 4 HB2 MET 4 -13.565 -28.223 5.835 22 HB3 MET 4 HB1 MET 4 -14.783 -27.204 5.086 23 HG2 MET 4 HG2 MET 4 -13.244 -26.850 3.180 24 HG3 MET 4 HG1 MET 4 -12.125 -27.992 3.920 25 HE1 MET 4 HE1 MET 4 -13.305 -28.229 0.935 26 HE2 MET 4 HE2 MET 4 -13.629 -29.961 0.857 27 HE3 MET 4 HE3 MET 4 -12.150 -29.374 1.618 28 H GLY 5 H GLY 5 -11.118 -25.138 4.621 29 HA2 GLY 5 HA2 GLY 5 -9.117 -25.798 6.571 30 HA3 GLY 5 HA1 GLY 5 -8.999 -26.762 5.105 31 H THR 6 H THR 6 -6.933 -25.117 5.814 32 HA THR 6 HA THR 6 -6.850 -23.421 3.469 33 HB THR 6 HB THR 6 -6.171 -22.212 6.161 34 HG1 THR 6 HG1 THR 6 -8.577 -22.456 4.871 35 HG21 THR 6 HG21 THR 6 -6.441 -21.001 3.404 36 HG22 THR 6 HG22 THR 6 -4.932 -21.279 4.271 37 HG23 THR 6 HG23 THR 6 -6.100 -20.110 4.886 38 H THR 7 H THR 7 -5.385 -25.123 2.900 39 HA THR 7 HA THR 7 -3.035 -25.661 4.433 40 HB THR 7 HB THR 7 -3.355 -26.232 1.492 41 HG1 THR 7 HG1 THR 7 -4.268 -27.989 3.524 42 HG21 THR 7 HG21 THR 7 -1.984 -27.721 3.736 43 HG22 THR 7 HG22 THR 7 -1.186 -26.748 2.501 44 HG23 THR 7 HG23 THR 7 -2.035 -28.225 2.046 45 H THR 8 H THR 8 -3.836 -23.631 1.675 46 HA THR 8 HA THR 8 -1.097 -22.602 1.611 47 HB THR 8 HB THR 8 -3.358 -22.103 -0.335 48 HG1 THR 8 HG1 THR 8 -1.128 -23.569 -1.107 49 HG21 THR 8 HG21 THR 8 -1.663 -20.314 -0.264 50 HG22 THR 8 HG22 THR 8 -1.617 -21.200 -1.787 51 HG23 THR 8 HG23 THR 8 -0.402 -21.512 -0.548 52 H ALA 9 H ALA 9 -0.658 -20.778 2.615 53 HA ALA 9 HA ALA 9 -2.699 -18.708 2.852 54 HB1 ALA 9 HB1 ALA 9 -2.927 -20.018 4.902 55 HB2 ALA 9 HB2 ALA 9 -2.282 -18.413 5.246 56 HB3 ALA 9 HB3 ALA 9 -1.208 -19.810 5.234 57 HA PRO 10 HA PRO 10 1.263 -16.811 1.747 58 HB2 PRO 10 HB2 PRO 10 0.202 -14.739 0.383 59 HB3 PRO 10 HB1 PRO 10 0.346 -16.353 -0.317 60 HG2 PRO 10 HG2 PRO 10 -2.048 -15.000 0.847 61 HG3 PRO 10 HG1 PRO 10 -1.930 -16.043 -0.582 62 HD2 PRO 10 HD2 PRO 10 -2.810 -16.895 1.866 63 HD3 PRO 10 HD1 PRO 10 -2.113 -17.942 0.668 64 H ASP 11 H ASP 11 2.381 -15.119 2.675 65 HA ASP 11 HA ASP 11 0.897 -13.611 4.723 66 HB2 ASP 11 HB2 ASP 11 3.800 -14.402 4.510 67 HB3 ASP 11 HB1 ASP 11 3.242 -13.182 5.649 68 H ALA 12 H ALA 12 1.207 -11.399 4.961 69 HA ALA 12 HA ALA 12 1.787 -9.910 2.596 70 HB1 ALA 12 HB1 ALA 12 0.168 -9.144 4.270 71 HB2 ALA 12 HB2 ALA 12 1.442 -7.950 4.023 72 HB3 ALA 12 HB3 ALA 12 1.464 -8.980 5.455 73 HA PRO 13 HA PRO 13 6.169 -9.111 3.066 74 HB2 PRO 13 HB2 PRO 13 5.438 -6.286 2.501 75 HB3 PRO 13 HB1 PRO 13 6.610 -7.325 1.683 76 HG2 PRO 13 HG2 PRO 13 4.291 -6.740 0.531 77 HG3 PRO 13 HG1 PRO 13 4.980 -8.370 0.400 78 HD2 PRO 13 HD2 PRO 13 2.765 -7.380 2.141 79 HD3 PRO 13 HD1 PRO 13 2.906 -8.917 1.263 80 HA PRO 14 HA PRO 14 6.360 -7.596 7.305 81 HB2 PRO 14 HB2 PRO 14 9.102 -7.004 7.132 82 HB3 PRO 14 HB1 PRO 14 8.394 -8.501 7.739 83 HG2 PRO 14 HG2 PRO 14 9.569 -7.905 5.086 84 HG3 PRO 14 HG1 PRO 14 9.523 -9.432 5.980 85 HD2 PRO 14 HD2 PRO 14 7.945 -8.957 3.841 86 HD3 PRO 14 HD1 PRO 14 7.420 -9.970 5.200 87 H ASP 15 H ASP 15 6.563 -5.615 8.296 88 HA ASP 15 HA ASP 15 5.323 -3.561 7.217 89 HB2 ASP 15 HB2 ASP 15 7.630 -3.303 9.144 90 HB3 ASP 15 HB1 ASP 15 6.455 -2.031 8.821 91 HA PRO 16 HA PRO 16 8.117 -2.084 3.974 92 HB2 PRO 16 HB2 PRO 16 5.647 -0.670 3.171 93 HB3 PRO 16 HB1 PRO 16 6.667 -1.768 2.210 94 HG2 PRO 16 HG2 PRO 16 4.279 -2.563 3.055 95 HG3 PRO 16 HG1 PRO 16 5.660 -3.671 3.129 96 HD2 PRO 16 HD2 PRO 16 4.494 -1.990 5.339 97 HD3 PRO 16 HD1 PRO 16 4.848 -3.738 5.352 98 H THR 17 H THR 17 9.071 -0.139 3.630 99 HA THR 17 HA THR 17 8.415 1.955 5.611 100 HB THR 17 HB THR 17 11.096 1.460 4.301 101 HG1 THR 17 HG1 THR 17 9.966 0.469 6.715 102 HG21 THR 17 HG21 THR 17 10.765 3.722 5.185 103 HG22 THR 17 HG22 THR 17 11.944 2.833 6.147 104 HG23 THR 17 HG23 THR 17 10.300 3.047 6.747 105 H VAL 18 H VAL 18 7.962 3.848 5.012 106 HA VAL 18 HA VAL 18 7.765 4.548 2.215 107 HB VAL 18 HB VAL 18 7.188 6.166 4.700 108 HG11 VAL 18 HG11 VAL 18 5.946 7.675 3.186 109 HG12 VAL 18 HG12 VAL 18 6.575 6.780 1.795 110 HG13 VAL 18 HG13 VAL 18 7.677 7.660 2.859 111 HG21 VAL 18 HG21 VAL 18 5.357 4.693 2.818 112 HG22 VAL 18 HG22 VAL 18 4.842 5.699 4.171 113 HG23 VAL 18 HG23 VAL 18 5.753 4.218 4.468 114 H ASP 19 H ASP 19 9.187 5.610 1.061 115 HA ASP 19 HA ASP 19 11.758 6.201 2.244 116 HB2 ASP 19 HB2 ASP 19 11.551 4.957 0.108 117 HB3 ASP 19 HB1 ASP 19 10.855 6.392 -0.638 118 H GLN 20 H GLN 20 9.378 7.980 0.280 119 HA GLN 20 HA GLN 20 10.311 10.466 1.524 120 HB2 GLN 20 HB2 GLN 20 9.982 9.975 -1.440 121 HB3 GLN 20 HB1 GLN 20 10.083 11.583 -0.734 122 HG2 GLN 20 HG2 GLN 20 12.305 11.215 0.002 123 HG3 GLN 20 HG1 GLN 20 12.212 9.494 -0.366 124 HE21 GLN 20 HE21 GLN 20 10.937 11.938 -2.498 125 HE22 GLN 20 HE22 GLN 20 12.098 11.743 -3.733 126 H VAL 21 H VAL 21 8.740 11.788 2.125 127 HA VAL 21 HA VAL 21 5.993 11.101 1.321 128 HB VAL 21 HB VAL 21 6.936 12.316 3.926 129 HG11 VAL 21 HG11 VAL 21 4.705 13.107 3.133 130 HG12 VAL 21 HG12 VAL 21 4.673 12.248 4.673 131 HG13 VAL 21 HG13 VAL 21 4.151 11.434 3.199 132 HG21 VAL 21 HG21 VAL 21 7.462 9.937 3.744 133 HG22 VAL 21 HG22 VAL 21 5.779 9.589 3.344 134 HG23 VAL 21 HG23 VAL 21 6.194 10.219 4.938 135 H ASP 22 H ASP 22 4.967 12.581 0.157 136 HA ASP 22 HA ASP 22 5.747 15.408 0.449 137 HB2 ASP 22 HB2 ASP 22 4.979 13.939 -2.084 138 HB3 ASP 22 HB1 ASP 22 5.168 15.684 -1.968 139 H ASP 23 H ASP 23 3.783 16.399 -1.293 140 HA ASP 23 HA ASP 23 1.509 16.489 0.413 141 HB2 ASP 23 HB2 ASP 23 0.579 17.862 -1.558 142 HB3 ASP 23 HB1 ASP 23 1.998 18.479 -0.728 143 H THR 24 H THR 24 1.460 15.860 -3.057 144 HA THR 24 HA THR 24 -0.843 14.070 -2.668 145 HB THR 24 HB THR 24 -1.329 14.614 -5.047 146 HG1 THR 24 HG1 THR 24 0.798 16.513 -4.771 147 HG21 THR 24 HG21 THR 24 -2.301 15.941 -3.212 148 HG22 THR 24 HG22 THR 24 -2.024 16.925 -4.653 149 HG23 THR 24 HG23 THR 24 -0.915 17.034 -3.279 150 H SER 25 H SER 25 1.755 13.103 -2.217 151 HA SER 25 HA SER 25 2.068 10.933 -3.994 152 HB2 SER 25 HB2 SER 25 4.089 13.178 -4.253 153 HB3 SER 25 HB1 SER 25 4.348 11.542 -4.854 154 HG SER 25 HG SER 25 1.973 12.649 -5.670 155 H ILE 26 H ILE 26 3.030 9.347 -2.905 156 HA ILE 26 HA ILE 26 5.125 9.911 -0.937 157 HB ILE 26 HB ILE 26 2.469 8.682 -0.198 158 HG12 ILE 26 HG12 ILE 26 4.195 10.760 1.152 159 HG13 ILE 26 HG11 ILE 26 2.733 11.077 0.231 160 HG21 ILE 26 HG21 ILE 26 5.073 8.328 1.264 161 HG22 ILE 26 HG22 ILE 26 4.100 7.066 0.504 162 HG23 ILE 26 HG23 ILE 26 3.484 7.927 1.916 163 HD11 ILE 26 HD11 ILE 26 2.959 9.626 2.861 164 HD12 ILE 26 HD12 ILE 26 1.482 9.711 1.895 165 HD13 ILE 26 HD13 ILE 26 2.192 11.188 2.543 166 H VAL 27 H VAL 27 6.447 7.943 -0.521 167 HA VAL 27 HA VAL 27 5.804 5.847 -2.500 168 HB VAL 27 HB VAL 27 8.569 6.765 -1.741 169 HG11 VAL 27 HG11 VAL 27 7.887 4.325 -2.547 170 HG12 VAL 27 HG12 VAL 27 9.387 5.100 -3.074 171 HG13 VAL 27 HG13 VAL 27 7.975 5.106 -4.130 172 HG21 VAL 27 HG21 VAL 27 8.704 7.695 -4.000 173 HG22 VAL 27 HG22 VAL 27 7.434 8.472 -3.057 174 HG23 VAL 27 HG23 VAL 27 7.016 7.270 -4.276 175 H VAL 28 H VAL 28 5.792 3.797 -1.739 176 HA VAL 28 HA VAL 28 7.027 3.386 0.893 177 HB VAL 28 HB VAL 28 5.209 2.471 1.803 178 HG11 VAL 28 HG11 VAL 28 3.791 3.811 -0.448 179 HG12 VAL 28 HG12 VAL 28 4.380 4.580 1.025 180 HG13 VAL 28 HG13 VAL 28 3.108 3.368 1.114 181 HG21 VAL 28 HG21 VAL 28 4.414 1.330 -0.839 182 HG22 VAL 28 HG22 VAL 28 3.589 1.025 0.691 183 HG23 VAL 28 HG23 VAL 28 5.263 0.490 0.460 184 H ARG 29 H ARG 29 7.948 1.352 1.269 185 HA ARG 29 HA ARG 29 8.404 -0.286 -1.150 186 HB2 ARG 29 HB2 ARG 29 10.531 0.473 0.866 187 HB3 ARG 29 HB1 ARG 29 10.764 -0.414 -0.634 188 HG2 ARG 29 HG2 ARG 29 10.305 1.534 -1.938 189 HG3 ARG 29 HG1 ARG 29 9.821 2.440 -0.505 190 HD2 ARG 29 HD2 ARG 29 12.060 3.068 -1.191 191 HD3 ARG 29 HD1 ARG 29 12.101 2.255 0.371 192 HE ARG 29 HE ARG 29 12.836 0.239 -0.863 193 HH11 ARG 29 HH11 ARG 29 13.239 3.384 -2.355 194 HH12 ARG 29 HH12 ARG 29 14.591 2.891 -3.320 195 HH21 ARG 29 HH21 ARG 29 14.632 -0.406 -2.134 196 HH22 ARG 29 HH22 ARG 29 15.384 0.745 -3.194 197 H TRP 30 H TRP 30 7.989 -2.326 -0.827 198 HA TRP 30 HA TRP 30 7.874 -3.317 1.953 199 HB2 TRP 30 HB2 TRP 30 6.070 -4.866 1.181 200 HB3 TRP 30 HB1 TRP 30 5.624 -3.171 1.078 201 HD1 TRP 30 HD1 TRP 30 6.514 -6.133 -1.128 202 HE1 TRP 30 HE1 TRP 30 5.662 -5.688 -3.507 203 HE3 TRP 30 HE3 TRP 30 4.905 -1.371 -0.475 204 HZ2 TRP 30 HZ2 TRP 30 4.393 -3.596 -4.897 205 HZ3 TRP 30 HZ3 TRP 30 3.847 -0.227 -2.368 206 HH2 TRP 30 HH2 TRP 30 3.591 -1.303 -4.518 207 H SER 31 H SER 31 8.590 -5.364 2.420 208 HA SER 31 HA SER 31 10.407 -6.534 0.464 209 HB2 SER 31 HB2 SER 31 11.192 -6.087 2.793 210 HB3 SER 31 HB1 SER 31 10.001 -7.243 3.380 211 HG SER 31 HG SER 31 11.151 -8.877 2.589 212 H ARG 32 H ARG 32 9.232 -7.693 -0.925 213 HA ARG 32 HA ARG 32 6.835 -8.917 -0.657 214 HB2 ARG 32 HB2 ARG 32 9.044 -10.071 -2.335 215 HB3 ARG 32 HB1 ARG 32 7.322 -10.132 -2.646 216 HG2 ARG 32 HG2 ARG 32 7.946 -8.485 -4.099 217 HG3 ARG 32 HG1 ARG 32 7.549 -7.530 -2.669 218 HD2 ARG 32 HD2 ARG 32 9.634 -6.800 -2.428 219 HD3 ARG 32 HD1 ARG 32 10.316 -8.414 -2.680 220 HE ARG 32 HE ARG 32 9.357 -7.132 -5.083 221 HH11 ARG 32 HH11 ARG 32 12.096 -7.555 -2.941 222 HH12 ARG 32 HH12 ARG 32 13.271 -7.190 -4.162 223 HH21 ARG 32 HH21 ARG 32 10.907 -6.667 -6.700 224 HH22 ARG 32 HH22 ARG 32 12.598 -6.683 -6.294 225 HA PRO 33 HA PRO 33 7.211 -12.555 1.759 226 HB2 PRO 33 HB2 PRO 33 5.042 -13.843 0.365 227 HB3 PRO 33 HB1 PRO 33 4.963 -12.913 1.868 228 HG2 PRO 33 HG2 PRO 33 3.815 -12.130 -0.501 229 HG3 PRO 33 HG1 PRO 33 4.319 -11.004 0.780 230 HD2 PRO 33 HD2 PRO 33 5.764 -11.795 -1.718 231 HD3 PRO 33 HD1 PRO 33 5.556 -10.184 -1.018 232 H GLN 34 H GLN 34 7.502 -14.841 1.785 233 HA GLN 34 HA GLN 34 8.839 -16.002 -0.466 234 HB2 GLN 34 HB2 GLN 34 9.478 -16.593 1.797 235 HB3 GLN 34 HB1 GLN 34 7.862 -17.193 2.132 236 HG2 GLN 34 HG2 GLN 34 8.223 -18.910 0.358 237 HG3 GLN 34 HG1 GLN 34 9.896 -18.364 0.255 238 HE21 GLN 34 HE21 GLN 34 10.733 -20.313 0.928 239 HE22 GLN 34 HE22 GLN 34 10.586 -20.881 2.558 240 H ALA 35 H ALA 35 5.645 -15.783 0.748 241 HA ALA 35 HA ALA 35 4.323 -17.947 -0.352 242 HB1 ALA 35 HB1 ALA 35 2.354 -16.696 -0.124 243 HB2 ALA 35 HB2 ALA 35 3.192 -15.168 -0.387 244 HB3 ALA 35 HB3 ALA 35 3.428 -16.058 1.123 245 HA PRO 36 HA PRO 36 4.550 -17.164 -4.797 246 HB2 PRO 36 HB2 PRO 36 2.207 -18.977 -4.790 247 HB3 PRO 36 HB1 PRO 36 3.715 -19.099 -5.701 248 HG2 PRO 36 HG2 PRO 36 3.210 -20.726 -3.639 249 HG3 PRO 36 HG1 PRO 36 4.844 -20.115 -3.954 250 HD2 PRO 36 HD2 PRO 36 2.846 -19.222 -1.914 251 HD3 PRO 36 HD1 PRO 36 4.605 -19.406 -1.763 252 H ILE 37 H ILE 37 3.751 -15.287 -5.389 253 HA ILE 37 HA ILE 37 0.906 -14.682 -4.925 254 HB ILE 37 HB ILE 37 1.541 -12.318 -4.596 255 HG12 ILE 37 HG12 ILE 37 4.234 -13.429 -5.204 256 HG13 ILE 37 HG11 ILE 37 3.504 -11.920 -5.719 257 HG21 ILE 37 HG21 ILE 37 2.403 -12.456 -2.345 258 HG22 ILE 37 HG22 ILE 37 3.108 -14.051 -2.663 259 HG23 ILE 37 HG23 ILE 37 1.354 -13.857 -2.622 260 HD11 ILE 37 HD11 ILE 37 5.230 -11.294 -4.294 261 HD12 ILE 37 HD12 ILE 37 4.840 -12.562 -3.134 262 HD13 ILE 37 HD13 ILE 37 3.773 -11.170 -3.300 263 H THR 38 H THR 38 -0.109 -13.466 -6.614 264 HA THR 38 HA THR 38 1.259 -13.710 -9.177 265 HB THR 38 HB THR 38 -1.049 -13.272 -10.124 266 HG1 THR 38 HG1 THR 38 -2.583 -12.854 -8.738 267 HG21 THR 38 HG21 THR 38 -0.081 -15.472 -10.097 268 HG22 THR 38 HG22 THR 38 -1.797 -15.562 -9.715 269 HG23 THR 38 HG23 THR 38 -0.599 -15.711 -8.430 270 H GLY 39 H GLY 39 -0.072 -11.266 -7.055 271 HA2 GLY 39 HA2 GLY 39 1.230 -9.233 -8.594 272 HA3 GLY 39 HA1 GLY 39 -0.524 -9.145 -8.676 273 H TYR 40 H TYR 40 0.081 -6.982 -7.682 274 HA TYR 40 HA TYR 40 -0.407 -7.297 -4.803 275 HB2 TYR 40 HB2 TYR 40 1.675 -5.570 -6.097 276 HB3 TYR 40 HB1 TYR 40 0.857 -5.003 -4.645 277 HD1 TYR 40 HD2 TYR 40 2.190 -8.331 -5.679 278 HD2 TYR 40 HD1 TYR 40 2.210 -5.207 -2.802 279 HE1 TYR 40 HE2 TYR 40 3.782 -9.598 -4.323 280 HE2 TYR 40 HE1 TYR 40 3.771 -6.490 -1.421 281 HH TYR 40 HH TYR 40 5.416 -9.227 -2.613 282 H ARG 41 H ARG 41 -2.166 -6.232 -4.174 283 HA ARG 41 HA ARG 41 -3.052 -3.921 -5.776 284 HB2 ARG 41 HB2 ARG 41 -4.528 -4.967 -3.398 285 HB3 ARG 41 HB1 ARG 41 -5.137 -4.133 -4.827 286 HG2 ARG 41 HG2 ARG 41 -3.958 -6.894 -4.892 287 HG3 ARG 41 HG1 ARG 41 -5.686 -6.594 -4.650 288 HD2 ARG 41 HD2 ARG 41 -4.040 -5.777 -7.045 289 HD3 ARG 41 HD1 ARG 41 -5.215 -7.090 -6.989 290 HE ARG 41 HE ARG 41 -6.326 -4.527 -6.279 291 HH11 ARG 41 HH11 ARG 41 -5.560 -6.698 -8.923 292 HH12 ARG 41 HH12 ARG 41 -6.692 -5.971 -10.018 293 HH21 ARG 41 HH21 ARG 41 -7.816 -3.558 -7.719 294 HH22 ARG 41 HH22 ARG 41 -7.979 -4.187 -9.333 295 H ILE 42 H ILE 42 -3.335 -1.899 -4.744 296 HA ILE 42 HA ILE 42 -2.200 -1.730 -2.025 297 HB ILE 42 HB ILE 42 -1.396 0.116 -4.257 298 HG12 ILE 42 HG12 ILE 42 0.281 -2.028 -2.993 299 HG13 ILE 42 HG11 ILE 42 -0.615 -2.269 -4.485 300 HG21 ILE 42 HG21 ILE 42 0.249 0.958 -2.710 301 HG22 ILE 42 HG22 ILE 42 -0.215 -0.245 -1.506 302 HG23 ILE 42 HG23 ILE 42 -1.340 1.040 -1.950 303 HD11 ILE 42 HD11 ILE 42 1.549 -0.252 -4.030 304 HD12 ILE 42 HD12 ILE 42 0.652 -0.479 -5.530 305 HD13 ILE 42 HD13 ILE 42 1.700 -1.761 -4.923 306 H VAL 43 H VAL 43 -3.824 -0.932 -0.827 307 HA VAL 43 HA VAL 43 -5.390 1.255 -2.043 308 HB VAL 43 HB VAL 43 -6.229 -0.622 0.171 309 HG11 VAL 43 HG11 VAL 43 -7.691 1.703 -1.044 310 HG12 VAL 43 HG12 VAL 43 -7.076 1.583 0.603 311 HG13 VAL 43 HG13 VAL 43 -8.379 0.525 0.072 312 HG21 VAL 43 HG21 VAL 43 -7.363 -0.236 -2.589 313 HG22 VAL 43 HG22 VAL 43 -7.877 -1.423 -1.390 314 HG23 VAL 43 HG23 VAL 43 -6.282 -1.553 -2.131 315 H TYR 44 H TYR 44 -4.663 3.113 -1.418 316 HA TYR 44 HA TYR 44 -3.969 3.473 1.392 317 HB2 TYR 44 HB2 TYR 44 -2.743 5.570 0.452 318 HB3 TYR 44 HB1 TYR 44 -1.990 3.988 0.324 319 HD1 TYR 44 HD2 TYR 44 -2.328 2.721 -1.894 320 HD2 TYR 44 HD1 TYR 44 -2.976 6.896 -1.454 321 HE1 TYR 44 HE2 TYR 44 -2.040 2.989 -4.303 322 HE2 TYR 44 HE1 TYR 44 -2.687 7.200 -3.872 323 HH TYR 44 HH TYR 44 -2.696 4.664 -6.070 324 H SER 45 H SER 45 -5.074 4.692 2.551 325 HA SER 45 HA SER 45 -6.917 6.640 1.366 326 HB2 SER 45 HB2 SER 45 -7.831 4.583 3.387 327 HB3 SER 45 HB1 SER 45 -8.824 5.734 2.491 328 HG SER 45 HG SER 45 -7.538 4.380 0.675 329 HA PRO 46 HA PRO 46 -5.661 8.995 4.982 330 HB2 PRO 46 HB2 PRO 46 -7.514 10.946 4.754 331 HB3 PRO 46 HB1 PRO 46 -6.115 10.841 3.677 332 HG2 PRO 46 HG2 PRO 46 -8.934 9.949 3.211 333 HG3 PRO 46 HG1 PRO 46 -7.849 10.834 2.126 334 HD2 PRO 46 HD2 PRO 46 -8.269 8.176 1.909 335 HD3 PRO 46 HD1 PRO 46 -6.717 8.934 1.501 336 H SER 47 H SER 47 -6.293 9.126 7.081 337 HA SER 47 HA SER 47 -8.395 7.412 7.929 338 HB2 SER 47 HB2 SER 47 -6.737 9.350 9.555 339 HB3 SER 47 HB1 SER 47 -7.702 8.020 10.195 340 HG SER 47 HG SER 47 -6.039 7.094 8.292 341 H VAL 48 H VAL 48 -8.162 10.898 7.539 342 HA VAL 48 HA VAL 48 -10.647 11.227 9.053 343 HB VAL 48 HB VAL 48 -10.167 13.652 8.998 344 HG11 VAL 48 HG11 VAL 48 -9.441 12.311 10.885 345 HG12 VAL 48 HG12 VAL 48 -8.264 13.579 10.547 346 HG13 VAL 48 HG13 VAL 48 -7.937 11.918 10.052 347 HG21 VAL 48 HG21 VAL 48 -8.884 13.752 6.929 348 HG22 VAL 48 HG22 VAL 48 -7.592 12.809 7.670 349 HG23 VAL 48 HG23 VAL 48 -7.958 14.427 8.270 350 H GLU 49 H GLU 49 -9.266 11.915 5.873 351 HA GLU 49 HA GLU 49 -11.506 11.576 4.341 352 HB2 GLU 49 HB2 GLU 49 -12.471 13.477 5.682 353 HB3 GLU 49 HB1 GLU 49 -11.211 14.514 5.029 354 HG2 GLU 49 HG2 GLU 49 -12.059 14.145 2.777 355 HG3 GLU 49 HG1 GLU 49 -13.306 13.076 3.416 356 H GLY 50 H GLY 50 -11.084 12.024 2.144 357 HA2 GLY 50 HA2 GLY 50 -9.584 13.667 0.785 358 HA3 GLY 50 HA1 GLY 50 -8.301 12.800 1.617 359 H SER 51 H SER 51 -7.819 12.504 -0.794 360 HA SER 51 HA SER 51 -9.442 10.703 -2.284 361 HB2 SER 51 HB2 SER 51 -6.581 11.605 -2.738 362 HB3 SER 51 HB1 SER 51 -7.600 10.768 -3.918 363 HG SER 51 HG SER 51 -8.153 12.725 -4.457 364 H SER 52 H SER 52 -9.389 8.550 -2.418 365 HA SER 52 HA SER 52 -7.130 7.102 -1.179 366 HB2 SER 52 HB2 SER 52 -9.974 6.110 -1.554 367 HB3 SER 52 HB1 SER 52 -8.665 5.256 -0.734 368 HG SER 52 HG SER 52 -9.801 7.738 0.076 369 H THR 53 H THR 53 -6.261 5.351 -2.359 370 HA THR 53 HA THR 53 -7.411 4.839 -4.995 371 HB THR 53 HB THR 53 -4.598 5.899 -4.673 372 HG1 THR 53 HG1 THR 53 -6.946 7.121 -5.035 373 HG21 THR 53 HG21 THR 53 -6.064 5.003 -7.158 374 HG22 THR 53 HG22 THR 53 -4.693 4.184 -6.406 375 HG23 THR 53 HG23 THR 53 -4.482 5.783 -7.121 376 H GLU 54 H GLU 54 -6.874 2.862 -5.875 377 HA GLU 54 HA GLU 54 -5.020 1.168 -4.378 378 HB2 GLU 54 HB2 GLU 54 -7.291 0.258 -4.458 379 HB3 GLU 54 HB1 GLU 54 -7.297 0.390 -6.210 380 HG2 GLU 54 HG2 GLU 54 -5.292 -1.167 -6.186 381 HG3 GLU 54 HG1 GLU 54 -5.682 -1.464 -4.493 382 H LEU 55 H LEU 55 -3.086 0.973 -5.347 383 HA LEU 55 HA LEU 55 -2.994 1.100 -8.273 384 HB2 LEU 55 HB2 LEU 55 -0.710 1.203 -6.260 385 HB3 LEU 55 HB1 LEU 55 -0.506 1.138 -8.010 386 HG LEU 55 HG LEU 55 -1.658 3.341 -6.355 387 HD11 LEU 55 HD11 LEU 55 0.588 3.145 -8.332 388 HD12 LEU 55 HD12 LEU 55 0.673 3.535 -6.612 389 HD13 LEU 55 HD13 LEU 55 -0.049 4.678 -7.741 390 HD21 LEU 55 HD21 LEU 55 -1.934 2.980 -9.331 391 HD22 LEU 55 HD22 LEU 55 -2.236 4.492 -8.478 392 HD23 LEU 55 HD23 LEU 55 -3.237 3.079 -8.147 393 H ASN 56 H ASN 56 -1.659 -0.495 -9.399 394 HA ASN 56 HA ASN 56 -1.805 -3.122 -8.082 395 HB2 ASN 56 HB2 ASN 56 -3.611 -2.858 -9.757 396 HB3 ASN 56 HB1 ASN 56 -2.398 -2.526 -10.990 397 HD21 ASN 56 HD21 ASN 56 -3.904 -4.928 -9.034 398 HD22 ASN 56 HD22 ASN 56 -3.196 -6.304 -9.803 399 H LEU 57 H LEU 57 0.161 -3.923 -7.852 400 HA LEU 57 HA LEU 57 2.210 -3.127 -9.809 401 HB2 LEU 57 HB2 LEU 57 2.479 -3.700 -6.844 402 HB3 LEU 57 HB1 LEU 57 3.846 -3.616 -7.932 403 HG LEU 57 HG LEU 57 2.190 -1.467 -6.784 404 HD11 LEU 57 HD11 LEU 57 5.053 -1.617 -7.678 405 HD12 LEU 57 HD12 LEU 57 4.467 -1.949 -6.051 406 HD13 LEU 57 HD13 LEU 57 4.317 -0.327 -6.728 407 HD21 LEU 57 HD21 LEU 57 3.401 -1.220 -9.523 408 HD22 LEU 57 HD22 LEU 57 2.731 0.095 -8.556 409 HD23 LEU 57 HD23 LEU 57 1.680 -1.197 -9.140 410 HA PRO 58 HA PRO 58 2.815 -7.399 -10.674 411 HB2 PRO 58 HB2 PRO 58 5.566 -7.488 -10.854 412 HB3 PRO 58 HB1 PRO 58 4.487 -6.983 -12.155 413 HG2 PRO 58 HG2 PRO 58 6.126 -5.339 -10.307 414 HG3 PRO 58 HG1 PRO 58 5.679 -5.034 -11.992 415 HD2 PRO 58 HD2 PRO 58 4.510 -3.790 -9.857 416 HD3 PRO 58 HD1 PRO 58 3.698 -4.039 -11.411 417 H GLU 59 H GLU 59 3.273 -9.259 -9.670 418 HA GLU 59 HA GLU 59 3.405 -9.639 -6.994 419 HB2 GLU 59 HB2 GLU 59 4.392 -11.891 -7.516 420 HB3 GLU 59 HB1 GLU 59 2.968 -11.471 -8.463 421 HG2 GLU 59 HG2 GLU 59 4.298 -10.961 -10.373 422 HG3 GLU 59 HG1 GLU 59 5.786 -11.100 -9.441 423 H THR 60 H THR 60 6.081 -8.831 -9.030 424 HA THR 60 HA THR 60 7.987 -9.442 -6.887 425 HB THR 60 HB THR 60 8.464 -10.579 -8.973 426 HG1 THR 60 HG1 THR 60 10.432 -8.594 -9.032 427 HG21 THR 60 HG21 THR 60 9.061 -9.319 -11.007 428 HG22 THR 60 HG22 THR 60 8.563 -7.828 -10.207 429 HG23 THR 60 HG23 THR 60 7.377 -9.092 -10.538 430 H ALA 61 H ALA 61 6.210 -6.935 -7.499 431 HA ALA 61 HA ALA 61 8.196 -4.840 -7.711 432 HB1 ALA 61 HB1 ALA 61 6.315 -3.318 -7.282 433 HB2 ALA 61 HB2 ALA 61 5.274 -4.708 -6.972 434 HB3 ALA 61 HB3 ALA 61 5.955 -4.456 -8.578 435 H ASN 62 H ASN 62 8.508 -3.236 -5.967 436 HA ASN 62 HA ASN 62 7.989 -4.305 -3.296 437 HB2 ASN 62 HB2 ASN 62 10.280 -4.097 -2.590 438 HB3 ASN 62 HB1 ASN 62 10.220 -5.140 -4.007 439 HD21 ASN 62 HD21 ASN 62 12.443 -3.619 -2.928 440 HD22 ASN 62 HD22 ASN 62 12.963 -2.555 -4.187 441 H SER 63 H SER 63 7.290 -1.835 -5.059 442 HA SER 63 HA SER 63 7.210 -0.020 -2.878 443 HB2 SER 63 HB2 SER 63 8.687 1.741 -3.982 444 HB3 SER 63 HB1 SER 63 9.532 0.362 -3.280 445 HG SER 63 HG SER 63 8.968 -0.291 -5.770 446 H VAL 64 H VAL 64 5.608 1.420 -3.197 447 HA VAL 64 HA VAL 64 4.688 1.871 -5.966 448 HB VAL 64 HB VAL 64 2.902 0.698 -4.845 449 HG11 VAL 64 HG11 VAL 64 3.850 1.693 -2.548 450 HG12 VAL 64 HG12 VAL 64 2.269 0.951 -2.743 451 HG13 VAL 64 HG13 VAL 64 2.425 2.706 -2.786 452 HG21 VAL 64 HG21 VAL 64 2.243 2.462 -6.298 453 HG22 VAL 64 HG22 VAL 64 2.279 3.607 -4.955 454 HG23 VAL 64 HG23 VAL 64 1.118 2.278 -4.957 455 H THR 65 H THR 65 4.639 3.925 -6.673 456 HA THR 65 HA THR 65 4.936 6.108 -4.784 457 HB THR 65 HB THR 65 4.972 5.888 -7.778 458 HG1 THR 65 HG1 THR 65 7.075 7.100 -6.464 459 HG21 THR 65 HG21 THR 65 3.867 8.003 -7.216 460 HG22 THR 65 HG22 THR 65 5.483 8.304 -7.856 461 HG23 THR 65 HG23 THR 65 5.188 8.416 -6.121 462 H LEU 66 H LEU 66 3.064 6.419 -3.801 463 HA LEU 66 HA LEU 66 0.486 6.270 -5.052 464 HB2 LEU 66 HB2 LEU 66 0.757 7.734 -2.534 465 HB3 LEU 66 HB1 LEU 66 -0.346 6.447 -2.967 466 HG LEU 66 HG LEU 66 2.523 5.839 -2.395 467 HD11 LEU 66 HD11 LEU 66 2.124 5.637 -0.141 468 HD12 LEU 66 HD12 LEU 66 0.379 5.798 -0.334 469 HD13 LEU 66 HD13 LEU 66 1.428 7.193 -0.570 470 HD21 LEU 66 HD21 LEU 66 1.448 3.695 -1.701 471 HD22 LEU 66 HD22 LEU 66 1.274 4.081 -3.415 472 HD23 LEU 66 HD23 LEU 66 -0.078 4.345 -2.311 473 H SER 67 H SER 67 -0.866 7.994 -5.517 474 HA SER 67 HA SER 67 0.288 10.672 -5.423 475 HB2 SER 67 HB2 SER 67 0.894 9.596 -7.627 476 HB3 SER 67 HB1 SER 67 -0.831 9.489 -7.978 477 HG SER 67 HG SER 67 0.859 11.647 -8.094 478 H ASP 68 H ASP 68 -1.426 12.279 -6.225 479 HA ASP 68 HA ASP 68 -3.486 13.224 -6.073 480 HB2 ASP 68 HB2 ASP 68 -4.332 10.347 -6.181 481 HB3 ASP 68 HB1 ASP 68 -5.507 11.608 -5.839 482 H LEU 69 H LEU 69 -1.841 12.294 -3.659 483 HA LEU 69 HA LEU 69 -3.762 11.803 -1.600 484 HB2 LEU 69 HB2 LEU 69 -1.112 13.030 -0.964 485 HB3 LEU 69 HB1 LEU 69 -2.041 11.838 -0.076 486 HG LEU 69 HG LEU 69 -0.495 11.261 -2.594 487 HD11 LEU 69 HD11 LEU 69 0.077 10.686 0.307 488 HD12 LEU 69 HD12 LEU 69 0.958 11.804 -0.734 489 HD13 LEU 69 HD13 LEU 69 1.003 10.070 -1.062 490 HD21 LEU 69 HD21 LEU 69 -2.265 9.712 -2.470 491 HD22 LEU 69 HD22 LEU 69 -2.196 9.669 -0.709 492 HD23 LEU 69 HD23 LEU 69 -0.926 8.886 -1.658 493 H GLN 70 H GLN 70 -3.507 13.413 0.419 494 HA GLN 70 HA GLN 70 -3.849 16.164 -0.564 495 HB2 GLN 70 HB2 GLN 70 -6.017 15.184 0.048 496 HB3 GLN 70 HB1 GLN 70 -5.396 14.776 1.640 497 HG2 GLN 70 HG2 GLN 70 -6.687 16.706 1.937 498 HG3 GLN 70 HG1 GLN 70 -5.011 17.248 1.980 499 HE21 GLN 70 HE21 GLN 70 -7.453 18.721 1.384 500 HE22 GLN 70 HE22 GLN 70 -7.224 19.407 -0.187 501 HA PRO 71 HA PRO 71 -0.410 16.745 2.227 502 HB2 PRO 71 HB2 PRO 71 -0.347 19.465 2.129 503 HB3 PRO 71 HB1 PRO 71 0.322 18.410 0.881 504 HG2 PRO 71 HG2 PRO 71 -2.303 19.845 0.940 505 HG3 PRO 71 HG1 PRO 71 -1.164 19.651 -0.404 506 HD2 PRO 71 HD2 PRO 71 -3.399 18.154 -0.180 507 HD3 PRO 71 HD1 PRO 71 -1.899 17.516 -0.885 508 H GLY 72 H GLY 72 -0.480 16.633 4.368 509 HA2 GLY 72 HA2 GLY 72 -0.822 17.560 6.521 510 HA3 GLY 72 HA1 GLY 72 -2.132 18.532 5.870 511 H VAL 73 H VAL 73 -1.825 15.112 5.203 512 HA VAL 73 HA VAL 73 -4.061 14.547 7.034 513 HB VAL 73 HB VAL 73 -3.944 13.617 4.163 514 HG11 VAL 73 HG11 VAL 73 -5.172 12.005 5.275 515 HG12 VAL 73 HG12 VAL 73 -6.404 13.154 4.723 516 HG13 VAL 73 HG13 VAL 73 -5.860 13.177 6.402 517 HG21 VAL 73 HG21 VAL 73 -4.545 15.825 3.901 518 HG22 VAL 73 HG22 VAL 73 -5.397 15.875 5.445 519 HG23 VAL 73 HG23 VAL 73 -6.105 15.007 4.080 520 H GLN 74 H GLN 74 -4.271 12.379 7.654 521 HA GLN 74 HA GLN 74 -1.770 10.917 7.737 522 HB2 GLN 74 HB2 GLN 74 -2.987 11.247 9.792 523 HB3 GLN 74 HB1 GLN 74 -4.450 10.601 9.063 524 HG2 GLN 74 HG2 GLN 74 -3.713 8.817 10.325 525 HG3 GLN 74 HG1 GLN 74 -3.010 8.459 8.748 526 HE21 GLN 74 HE21 GLN 74 -0.776 8.690 8.451 527 HE22 GLN 74 HE22 GLN 74 0.310 8.806 9.793 528 H TYR 75 H TYR 75 -1.398 9.679 6.005 529 HA TYR 75 HA TYR 75 -3.644 8.291 4.746 530 HB2 TYR 75 HB2 TYR 75 -1.028 9.283 3.789 531 HB3 TYR 75 HB1 TYR 75 -1.596 7.773 3.082 532 HD1 TYR 75 HD2 TYR 75 -2.602 11.300 3.707 533 HD2 TYR 75 HD1 TYR 75 -3.204 7.779 1.398 534 HE1 TYR 75 HE2 TYR 75 -4.092 12.546 2.199 535 HE2 TYR 75 HE1 TYR 75 -4.697 9.014 -0.109 536 HH TYR 75 HH TYR 75 -6.009 10.946 -0.210 537 H ASN 76 H ASN 76 -3.942 6.236 4.899 538 HA ASN 76 HA ASN 76 -1.879 4.513 6.079 539 HB2 ASN 76 HB2 ASN 76 -4.818 3.920 5.630 540 HB3 ASN 76 HB1 ASN 76 -3.680 2.948 6.553 541 HD21 ASN 76 HD21 ASN 76 -3.158 3.545 8.631 542 HD22 ASN 76 HD22 ASN 76 -3.997 4.792 9.483 543 H ILE 77 H ILE 77 -0.678 3.530 4.584 544 HA ILE 77 HA ILE 77 -1.859 2.790 2.017 545 HB ILE 77 HB ILE 77 1.006 2.644 2.958 546 HG12 ILE 77 HG12 ILE 77 1.267 4.301 1.055 547 HG13 ILE 77 HG11 ILE 77 -0.453 4.545 1.165 548 HG21 ILE 77 HG21 ILE 77 1.331 2.394 0.394 549 HG22 ILE 77 HG22 ILE 77 -0.286 1.685 0.467 550 HG23 ILE 77 HG23 ILE 77 1.036 0.970 1.402 551 HD11 ILE 77 HD11 ILE 77 -0.217 5.242 3.490 552 HD12 ILE 77 HD12 ILE 77 0.723 6.253 2.393 553 HD13 ILE 77 HD13 ILE 77 1.528 5.023 3.366 554 H THR 78 H THR 78 -2.660 0.897 1.747 555 HA THR 78 HA THR 78 -1.859 -1.249 3.551 556 HB THR 78 HB THR 78 -4.354 -0.977 1.893 557 HG1 THR 78 HG1 THR 78 -4.408 0.603 3.466 558 HG21 THR 78 HG21 THR 78 -5.220 -2.751 3.371 559 HG22 THR 78 HG22 THR 78 -3.653 -2.833 4.177 560 HG23 THR 78 HG23 THR 78 -3.796 -3.295 2.481 561 H ILE 79 H ILE 79 -0.458 -2.638 2.634 562 HA ILE 79 HA ILE 79 -0.480 -2.949 -0.302 563 HB ILE 79 HB ILE 79 1.512 -4.296 1.532 564 HG12 ILE 79 HG12 ILE 79 2.017 -2.020 1.955 565 HG13 ILE 79 HG11 ILE 79 3.147 -2.569 0.718 566 HG21 ILE 79 HG21 ILE 79 1.416 -3.725 -1.395 567 HG22 ILE 79 HG22 ILE 79 1.539 -5.289 -0.578 568 HG23 ILE 79 HG23 ILE 79 2.902 -4.158 -0.555 569 HD11 ILE 79 HD11 ILE 79 2.201 -1.289 -0.914 570 HD12 ILE 79 HD12 ILE 79 2.041 -0.262 0.527 571 HD13 ILE 79 HD13 ILE 79 0.651 -1.165 -0.072 572 H TYR 80 H TYR 80 -1.179 -4.728 -1.276 573 HA TYR 80 HA TYR 80 -1.981 -7.034 0.383 574 HB2 TYR 80 HB2 TYR 80 -3.237 -6.043 -2.192 575 HB3 TYR 80 HB1 TYR 80 -3.782 -7.410 -1.237 576 HD1 TYR 80 HD1 TYR 80 -4.963 -7.062 0.862 577 HD2 TYR 80 HD2 TYR 80 -3.805 -3.748 -1.576 578 HE1 TYR 80 HE1 TYR 80 -6.565 -5.631 2.049 579 HE2 TYR 80 HE2 TYR 80 -5.404 -2.325 -0.383 580 HH TYR 80 HH TYR 80 -7.431 -2.516 0.933 581 H ALA 81 H ALA 81 -0.458 -8.596 -0.039 582 HA ALA 81 HA ALA 81 0.622 -8.988 -2.701 583 HB1 ALA 81 HB1 ALA 81 1.677 -11.042 -1.673 584 HB2 ALA 81 HB2 ALA 81 0.905 -10.585 -0.139 585 HB3 ALA 81 HB3 ALA 81 2.098 -9.517 -0.877 586 H VAL 82 H VAL 82 -0.614 -9.885 -4.236 587 HA VAL 82 HA VAL 82 -2.873 -11.564 -3.290 588 HB VAL 82 HB VAL 82 -3.659 -9.590 -4.478 589 HG11 VAL 82 HG11 VAL 82 -1.751 -9.132 -5.879 590 HG12 VAL 82 HG12 VAL 82 -3.230 -9.233 -6.835 591 HG13 VAL 82 HG13 VAL 82 -2.090 -10.579 -6.826 592 HG21 VAL 82 HG21 VAL 82 -5.062 -10.645 -6.157 593 HG22 VAL 82 HG22 VAL 82 -4.936 -11.668 -4.724 594 HG23 VAL 82 HG23 VAL 82 -3.993 -12.052 -6.171 595 H GLU 83 H GLU 83 -3.268 -13.566 -4.120 596 HA GLU 83 HA GLU 83 -1.527 -14.481 -6.291 597 HB2 GLU 83 HB2 GLU 83 -0.958 -15.616 -4.220 598 HB3 GLU 83 HB1 GLU 83 -2.621 -16.154 -4.019 599 HG2 GLU 83 HG2 GLU 83 -2.386 -17.391 -6.161 600 HG3 GLU 83 HG1 GLU 83 -0.692 -16.909 -6.192 601 H GLU 84 H GLU 84 -2.633 -16.366 -7.465 602 HA GLU 84 HA GLU 84 -4.617 -15.651 -9.043 603 HB2 GLU 84 HB2 GLU 84 -4.527 -18.442 -7.918 604 HB3 GLU 84 HB1 GLU 84 -5.085 -17.952 -9.510 605 HG2 GLU 84 HG2 GLU 84 -2.825 -17.310 -10.126 606 HG3 GLU 84 HG1 GLU 84 -2.256 -17.741 -8.515 607 H ASN 85 H ASN 85 -5.305 -17.299 -5.935 608 HA ASN 85 HA ASN 85 -8.146 -16.774 -6.471 609 HB2 ASN 85 HB2 ASN 85 -8.688 -18.726 -5.138 610 HB3 ASN 85 HB1 ASN 85 -7.553 -19.159 -6.410 611 HD21 ASN 85 HD21 ASN 85 -8.174 -20.414 -3.823 612 HD22 ASN 85 HD22 ASN 85 -6.658 -20.547 -2.999 613 H GLN 86 H GLN 86 -5.618 -16.123 -4.177 614 HA GLN 86 HA GLN 86 -7.625 -15.071 -2.331 615 HB2 GLN 86 HB2 GLN 86 -6.526 -16.115 -0.438 616 HB3 GLN 86 HB1 GLN 86 -7.022 -17.328 -1.614 617 HG2 GLN 86 HG2 GLN 86 -4.730 -17.435 -2.466 618 HG3 GLN 86 HG1 GLN 86 -4.236 -16.266 -1.243 619 HE21 GLN 86 HE21 GLN 86 -5.980 -17.394 0.804 620 HE22 GLN 86 HE22 GLN 86 -5.235 -18.865 1.307 621 H GLU 87 H GLU 87 -6.481 -13.874 -0.495 622 HA GLU 87 HA GLU 87 -4.199 -12.371 -1.593 623 HB2 GLU 87 HB2 GLU 87 -6.496 -11.341 0.082 624 HB3 GLU 87 HB1 GLU 87 -5.076 -10.402 -0.355 625 HG2 GLU 87 HG2 GLU 87 -5.661 -10.529 -2.690 626 HG3 GLU 87 HG1 GLU 87 -7.030 -11.577 -2.317 627 H SER 88 H SER 88 -2.658 -11.654 -0.108 628 HA SER 88 HA SER 88 -2.368 -13.284 2.247 629 HB2 SER 88 HB2 SER 88 -0.661 -10.937 1.387 630 HB3 SER 88 HB1 SER 88 -0.198 -12.267 2.451 631 HG SER 88 HG SER 88 -0.722 -12.365 -0.335 632 H THR 89 H THR 89 -1.524 -11.949 4.276 633 HA THR 89 HA THR 89 -3.587 -10.367 5.297 634 HB THR 89 HB THR 89 -1.509 -9.581 6.816 635 HG1 THR 89 HG1 THR 89 -0.207 -11.707 6.812 636 HG21 THR 89 HG21 THR 89 -1.948 -11.543 8.232 637 HG22 THR 89 HG22 THR 89 -2.787 -12.317 6.890 638 HG23 THR 89 HG23 THR 89 -3.441 -10.845 7.607 639 HA PRO 90 HA PRO 90 -2.498 -6.423 3.602 640 HB2 PRO 90 HB2 PRO 90 -3.752 -4.754 5.289 641 HB3 PRO 90 HB1 PRO 90 -4.642 -5.865 4.244 642 HG2 PRO 90 HG2 PRO 90 -4.111 -6.029 7.163 643 HG3 PRO 90 HG1 PRO 90 -5.510 -6.599 6.239 644 HD2 PRO 90 HD2 PRO 90 -3.340 -8.141 7.147 645 HD3 PRO 90 HD1 PRO 90 -4.596 -8.649 6.005 646 H VAL 91 H VAL 91 -0.754 -5.154 3.625 647 HA VAL 91 HA VAL 91 0.784 -4.520 6.010 648 HB VAL 91 HB VAL 91 0.852 -3.580 3.151 649 HG11 VAL 91 HG11 VAL 91 2.696 -2.129 3.716 650 HG12 VAL 91 HG12 VAL 91 2.608 -2.621 5.403 651 HG13 VAL 91 HG13 VAL 91 1.292 -1.695 4.682 652 HG21 VAL 91 HG21 VAL 91 2.912 -5.013 4.821 653 HG22 VAL 91 HG22 VAL 91 3.059 -4.562 3.119 654 HG23 VAL 91 HG23 VAL 91 1.864 -5.765 3.614 655 H VAL 92 H VAL 92 0.048 -2.884 7.384 656 HA VAL 92 HA VAL 92 -1.293 -0.634 6.035 657 HB VAL 92 HB VAL 92 -1.705 -1.282 8.947 658 HG11 VAL 92 HG11 VAL 92 -3.198 0.414 6.951 659 HG12 VAL 92 HG12 VAL 92 -2.192 0.990 8.285 660 HG13 VAL 92 HG13 VAL 92 -3.699 0.137 8.621 661 HG21 VAL 92 HG21 VAL 92 -2.499 -3.205 7.664 662 HG22 VAL 92 HG22 VAL 92 -3.441 -2.133 6.628 663 HG23 VAL 92 HG23 VAL 92 -3.854 -2.295 8.333 664 H ILE 93 H ILE 93 0.223 0.853 5.791 665 HA ILE 93 HA ILE 93 1.852 1.570 8.143 666 HB ILE 93 HB ILE 93 3.576 2.411 6.506 667 HG12 ILE 93 HG12 ILE 93 2.020 0.793 4.498 668 HG13 ILE 93 HG11 ILE 93 2.022 2.537 4.590 669 HG21 ILE 93 HG21 ILE 93 2.946 -0.533 6.446 670 HG22 ILE 93 HG22 ILE 93 3.889 0.313 7.673 671 HG23 ILE 93 HG23 ILE 93 4.498 0.190 6.022 672 HD11 ILE 93 HD11 ILE 93 4.425 2.552 4.225 673 HD12 ILE 93 HD12 ILE 93 3.536 1.794 2.887 674 HD13 ILE 93 HD13 ILE 93 4.388 0.793 4.065 675 H GLN 94 H GLN 94 1.341 3.516 8.923 676 HA GLN 94 HA GLN 94 -0.071 5.350 7.112 677 HB2 GLN 94 HB2 GLN 94 -1.064 6.343 9.155 678 HB3 GLN 94 HB1 GLN 94 -1.480 4.652 8.931 679 HG2 GLN 94 HG2 GLN 94 0.162 4.006 10.591 680 HG3 GLN 94 HG1 GLN 94 0.649 5.687 10.787 681 HE21 GLN 94 HE21 GLN 94 0.142 5.675 12.964 682 HE22 GLN 94 HE22 GLN 94 -1.491 5.677 13.534 683 H GLN 95 H GLN 95 0.835 7.181 6.561 684 HA GLN 95 HA GLN 95 2.567 8.527 8.503 685 HB2 GLN 95 HB2 GLN 95 3.491 9.264 5.921 686 HB3 GLN 95 HB1 GLN 95 4.384 8.476 7.227 687 HG2 GLN 95 HG2 GLN 95 4.599 6.913 5.617 688 HG3 GLN 95 HG1 GLN 95 3.083 6.400 6.375 689 HE21 GLN 95 HE21 GLN 95 1.667 8.716 5.281 690 HE22 GLN 95 HE22 GLN 95 1.413 8.388 3.620 691 H GLU 96 H GLU 96 2.609 10.814 8.269 692 HA GLU 96 HA GLU 96 0.114 11.815 7.118 693 HB2 GLU 96 HB2 GLU 96 1.988 13.081 9.126 694 HB3 GLU 96 HB1 GLU 96 0.494 13.804 8.538 695 HG2 GLU 96 HG2 GLU 96 -0.805 12.038 9.518 696 HG3 GLU 96 HG1 GLU 96 0.659 11.183 10.001 697 H THR 97 H THR 97 0.112 13.043 5.377 698 HA THR 97 HA THR 97 2.418 13.337 3.811 699 HB THR 97 HB THR 97 0.953 14.893 2.441 700 HG1 THR 97 HG1 THR 97 -1.361 14.620 3.142 701 HG21 THR 97 HG21 THR 97 -0.121 12.153 3.139 702 HG22 THR 97 HG22 THR 97 1.120 12.506 1.937 703 HG23 THR 97 HG23 THR 97 -0.532 13.072 1.691 704 H THR 98 H THR 98 4.043 14.623 4.173 705 HA THR 98 HA THR 98 3.984 16.789 5.995 706 HB THR 98 HB THR 98 6.141 16.170 3.977 707 HG1 THR 98 HG1 THR 98 5.542 14.963 6.493 708 HG21 THR 98 HG21 THR 98 6.439 18.264 5.211 709 HG22 THR 98 HG22 THR 98 7.635 17.071 5.712 710 HG23 THR 98 HG23 THR 98 6.240 17.404 6.738 711 H GLY 99 H GLY 99 3.811 16.505 2.518 712 HA2 GLY 99 HA2 GLY 99 2.532 18.176 1.317 713 HA3 GLY 99 HA1 GLY 99 3.203 19.383 2.393 714 H THR 100 H THR 100 3.615 20.372 0.212 715 HA THR 100 HA THR 100 5.849 19.315 -1.278 716 HB THR 100 HB THR 100 4.648 22.082 -1.474 717 HG1 THR 100 HG1 THR 100 3.743 19.586 -2.407 718 HG21 THR 100 HG21 THR 100 6.774 21.800 -2.597 719 HG22 THR 100 HG22 THR 100 5.462 22.012 -3.750 720 HG23 THR 100 HG23 THR 100 6.139 20.408 -3.472 721 HA PRO 101 HA PRO 101 8.980 21.149 1.387 722 HB2 PRO 101 HB2 PRO 101 10.604 20.928 -1.089 723 HB3 PRO 101 HB1 PRO 101 10.943 20.321 0.535 724 HG2 PRO 101 HG2 PRO 101 10.218 18.659 -1.415 725 HG3 PRO 101 HG1 PRO 101 9.637 18.428 0.245 726 HD2 PRO 101 HD2 PRO 101 8.207 19.562 -2.125 727 HD3 PRO 101 HD1 PRO 101 7.598 18.497 -0.841 728 H ARG 102 H ARG 102 8.039 23.221 1.486 729 HA ARG 102 HA ARG 102 9.145 25.142 -0.454 730 HB2 ARG 102 HB2 ARG 102 7.091 26.431 -0.369 731 HB3 ARG 102 HB1 ARG 102 6.720 24.782 -0.854 732 HG2 ARG 102 HG2 ARG 102 5.981 24.275 1.418 733 HG3 ARG 102 HG1 ARG 102 6.359 25.926 1.909 734 HD2 ARG 102 HD2 ARG 102 4.022 25.844 1.510 735 HD3 ARG 102 HD1 ARG 102 4.743 26.708 0.156 736 HE ARG 102 HE ARG 102 4.195 23.844 -0.117 737 HH11 ARG 102 HH11 ARG 102 3.437 27.149 -0.978 738 HH12 ARG 102 HH12 ARG 102 2.471 26.705 -2.349 739 HH21 ARG 102 HH21 ARG 102 2.899 23.253 -1.902 740 HH22 ARG 102 HH22 ARG 102 2.165 24.488 -2.878 741 H SER 103 H SER 103 9.872 24.168 2.311 742 HA SER 103 HA SER 103 9.255 26.243 4.158 743 HB2 SER 103 HB2 SER 103 11.454 24.167 4.250 744 HB3 SER 103 HB1 SER 103 10.906 25.147 5.610 745 HG SER 103 HG SER 103 8.821 23.906 4.419 746 H ASP 104 H ASP 104 11.575 25.902 1.668 747 HA ASP 104 HA ASP 104 13.087 28.216 2.686 748 HB2 ASP 104 HB2 ASP 104 14.390 26.140 2.224 749 HB3 ASP 104 HB1 ASP 104 13.886 26.229 0.542 750 H GLY 105 H GLY 105 10.457 27.862 1.078 751 HA2 GLY 105 HA2 GLY 105 11.164 29.798 -1.040 752 HA3 GLY 105 HA1 GLY 105 9.998 28.508 -1.306 753 H THR 106 H THR 106 10.411 31.702 -0.376 754 HA THR 106 HA THR 106 7.892 31.795 1.109 755 HB THR 106 HB THR 106 9.850 34.054 0.646 756 HG1 THR 106 HG1 THR 106 9.806 31.936 2.481 757 HG21 THR 106 HG21 THR 106 7.589 34.750 1.304 758 HG22 THR 106 HG22 THR 106 8.754 35.053 2.592 759 HG23 THR 106 HG23 THR 106 7.663 33.671 2.696 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 -8.083 -30.943 4.965 2 H2 GLY 1 HT2 GLY 1 -7.963 -32.436 5.748 3 H3 GLY 1 HT3 GLY 1 -8.635 -31.113 6.551 4 HA2 GLY 1 HA1 GLY 1 -10.383 -32.576 5.860 5 HA3 GLY 1 HA2 GLY 1 -10.470 -31.062 4.975 6 H SER 2 H SER 2 -11.796 -32.681 3.628 7 HA SER 2 HA SER 2 -10.378 -34.574 2.050 8 HB2 SER 2 HB2 SER 2 -12.503 -34.531 0.668 9 HB3 SER 2 HB1 SER 2 -12.725 -34.909 2.377 10 HG SER 2 HG SER 2 -14.241 -33.371 1.673 11 H HIS 3 H HIS 3 -11.819 -31.416 1.238 12 HA HIS 3 HA HIS 3 -10.261 -31.361 -1.228 13 HB2 HIS 3 HB2 HIS 3 -12.470 -29.595 -0.175 14 HB3 HIS 3 HB1 HIS 3 -11.574 -29.228 -1.645 15 HD1 HIS 3 HD1 HIS 3 -12.538 -30.155 -3.726 16 HD2 HIS 3 HD2 HIS 3 -13.804 -32.253 -0.373 17 HE1 HIS 3 HE1 HIS 3 -14.196 -31.836 -4.572 18 HE2 HIS 3 HE2 HIS 3 -14.802 -33.214 -2.557 19 H MET 4 H MET 4 -8.439 -30.292 -1.437 20 HA MET 4 HA MET 4 -7.735 -28.323 0.626 21 HB2 MET 4 HB2 MET 4 -5.360 -29.144 0.357 22 HB3 MET 4 HB1 MET 4 -6.465 -30.254 1.152 23 HG2 MET 4 HG2 MET 4 -6.702 -31.512 -0.929 24 HG3 MET 4 HG1 MET 4 -5.601 -30.394 -1.729 25 HE1 MET 4 HE1 MET 4 -3.018 -30.242 -1.252 26 HE2 MET 4 HE2 MET 4 -2.209 -31.113 0.052 27 HE3 MET 4 HE3 MET 4 -3.379 -29.849 0.428 28 H GLY 5 H GLY 5 -8.736 -26.973 -1.165 29 HA2 GLY 5 HA2 GLY 5 -7.197 -26.528 -3.541 30 HA3 GLY 5 HA1 GLY 5 -8.503 -25.516 -2.940 31 H THR 6 H THR 6 -7.997 -24.033 -1.168 32 HA THR 6 HA THR 6 -5.436 -22.776 -1.553 33 HB THR 6 HB THR 6 -6.412 -21.302 0.402 34 HG1 THR 6 HG1 THR 6 -8.177 -22.508 0.986 35 HG21 THR 6 HG21 THR 6 -7.636 -21.311 -2.360 36 HG22 THR 6 HG22 THR 6 -6.099 -20.565 -1.920 37 HG23 THR 6 HG23 THR 6 -7.604 -19.947 -1.242 38 H THR 7 H THR 7 -4.595 -25.020 -0.756 39 HA THR 7 HA THR 7 -4.606 -25.497 2.056 40 HB THR 7 HB THR 7 -4.332 -27.365 0.547 41 HG1 THR 7 HG1 THR 7 -2.324 -26.722 2.376 42 HG21 THR 7 HG21 THR 7 -1.757 -26.048 -0.320 43 HG22 THR 7 HG22 THR 7 -3.208 -26.247 -1.302 44 HG23 THR 7 HG23 THR 7 -2.289 -27.663 -0.789 45 H THR 8 H THR 8 -2.747 -23.509 -0.027 46 HA THR 8 HA THR 8 -0.719 -23.143 2.072 47 HB THR 8 HB THR 8 -0.517 -22.326 -0.833 48 HG1 THR 8 HG1 THR 8 0.523 -24.629 0.506 49 HG21 THR 8 HG21 THR 8 0.929 -21.077 0.720 50 HG22 THR 8 HG22 THR 8 1.869 -22.117 -0.351 51 HG23 THR 8 HG23 THR 8 1.585 -22.598 1.322 52 H ALA 9 H ALA 9 -0.790 -21.295 3.184 53 HA ALA 9 HA ALA 9 -2.438 -19.103 2.132 54 HB1 ALA 9 HB1 ALA 9 -3.075 -20.000 4.339 55 HB2 ALA 9 HB2 ALA 9 -2.602 -18.303 4.412 56 HB3 ALA 9 HB3 ALA 9 -1.486 -19.553 4.958 57 HA PRO 10 HA PRO 10 1.478 -17.089 1.480 58 HB2 PRO 10 HB2 PRO 10 0.523 -14.942 0.158 59 HB3 PRO 10 HB1 PRO 10 0.655 -16.534 -0.597 60 HG2 PRO 10 HG2 PRO 10 -1.745 -15.138 0.492 61 HG3 PRO 10 HG1 PRO 10 -1.602 -16.190 -0.927 62 HD2 PRO 10 HD2 PRO 10 -2.579 -16.984 1.525 63 HD3 PRO 10 HD1 PRO 10 -1.955 -18.061 0.314 64 H ASP 11 H ASP 11 2.608 -15.495 2.496 65 HA ASP 11 HA ASP 11 1.189 -14.075 4.615 66 HB2 ASP 11 HB2 ASP 11 4.125 -14.547 4.091 67 HB3 ASP 11 HB1 ASP 11 3.539 -13.492 5.372 68 H ALA 12 H ALA 12 1.852 -11.820 5.046 69 HA ALA 12 HA ALA 12 1.949 -10.288 2.547 70 HB1 ALA 12 HB1 ALA 12 1.233 -8.407 3.920 71 HB2 ALA 12 HB2 ALA 12 1.378 -9.390 5.377 72 HB3 ALA 12 HB3 ALA 12 0.162 -9.788 4.163 73 HA PRO 13 HA PRO 13 6.113 -8.856 3.301 74 HB2 PRO 13 HB2 PRO 13 5.264 -6.116 2.643 75 HB3 PRO 13 HB1 PRO 13 6.411 -7.162 1.800 76 HG2 PRO 13 HG2 PRO 13 4.016 -6.585 0.752 77 HG3 PRO 13 HG1 PRO 13 4.757 -8.184 0.548 78 HD2 PRO 13 HD2 PRO 13 2.622 -7.314 2.452 79 HD3 PRO 13 HD1 PRO 13 2.715 -8.793 1.470 80 HA PRO 14 HA PRO 14 5.977 -7.227 7.538 81 HB2 PRO 14 HB2 PRO 14 8.803 -6.667 6.743 82 HB3 PRO 14 HB1 PRO 14 8.181 -7.410 8.220 83 HG2 PRO 14 HG2 PRO 14 9.298 -8.898 6.314 84 HG3 PRO 14 HG1 PRO 14 7.888 -9.476 7.219 85 HD2 PRO 14 HD2 PRO 14 8.061 -8.457 4.429 86 HD3 PRO 14 HD1 PRO 14 6.979 -9.682 5.123 87 H ASP 15 H ASP 15 6.158 -5.152 8.472 88 HA ASP 15 HA ASP 15 4.898 -3.169 7.191 89 HB2 ASP 15 HB2 ASP 15 7.005 -2.893 9.330 90 HB3 ASP 15 HB1 ASP 15 6.006 -1.549 8.793 91 HA PRO 16 HA PRO 16 7.916 -1.910 4.063 92 HB2 PRO 16 HB2 PRO 16 5.537 -0.377 3.177 93 HB3 PRO 16 HB1 PRO 16 6.569 -1.481 2.240 94 HG2 PRO 16 HG2 PRO 16 4.144 -2.245 2.959 95 HG3 PRO 16 HG1 PRO 16 5.498 -3.377 3.099 96 HD2 PRO 16 HD2 PRO 16 4.222 -1.711 5.253 97 HD3 PRO 16 HD1 PRO 16 4.596 -3.454 5.280 98 H THR 17 H THR 17 8.986 -0.030 3.675 99 HA THR 17 HA THR 17 8.413 2.143 5.586 100 HB THR 17 HB THR 17 11.032 1.523 4.200 101 HG1 THR 17 HG1 THR 17 9.903 0.643 6.630 102 HG21 THR 17 HG21 THR 17 10.801 3.857 4.917 103 HG22 THR 17 HG22 THR 17 11.995 3.009 5.899 104 HG23 THR 17 HG23 THR 17 10.383 3.320 6.544 105 H VAL 18 H VAL 18 7.861 3.978 4.931 106 HA VAL 18 HA VAL 18 7.554 4.638 2.171 107 HB VAL 18 HB VAL 18 7.254 6.294 4.674 108 HG11 VAL 18 HG11 VAL 18 6.688 7.082 1.806 109 HG12 VAL 18 HG12 VAL 18 7.878 7.805 2.895 110 HG13 VAL 18 HG13 VAL 18 6.158 7.981 3.232 111 HG21 VAL 18 HG21 VAL 18 5.616 4.437 4.223 112 HG22 VAL 18 HG22 VAL 18 5.151 5.309 2.760 113 HG23 VAL 18 HG23 VAL 18 4.914 6.053 4.338 114 H ASP 19 H ASP 19 8.963 5.465 0.842 115 HA ASP 19 HA ASP 19 11.669 5.939 1.754 116 HB2 ASP 19 HB2 ASP 19 11.174 4.550 -0.234 117 HB3 ASP 19 HB1 ASP 19 10.508 5.963 -1.040 118 H GLN 20 H GLN 20 9.157 7.720 0.021 119 HA GLN 20 HA GLN 20 10.470 10.237 0.760 120 HB2 GLN 20 HB2 GLN 20 9.518 9.442 -1.995 121 HB3 GLN 20 HB1 GLN 20 9.775 11.116 -1.526 122 HG2 GLN 20 HG2 GLN 20 12.117 10.656 -1.088 123 HG3 GLN 20 HG1 GLN 20 11.872 8.959 -1.499 124 HE21 GLN 20 HE21 GLN 20 13.384 9.059 -3.151 125 HE22 GLN 20 HE22 GLN 20 13.079 9.853 -4.632 126 H VAL 21 H VAL 21 9.118 11.824 1.336 127 HA VAL 21 HA VAL 21 6.239 11.231 1.188 128 HB VAL 21 HB VAL 21 7.592 12.664 3.469 129 HG11 VAL 21 HG11 VAL 21 5.215 13.203 2.983 130 HG12 VAL 21 HG12 VAL 21 5.490 12.517 4.583 131 HG13 VAL 21 HG13 VAL 21 4.819 11.514 3.297 132 HG21 VAL 21 HG21 VAL 21 8.314 10.343 3.463 133 HG22 VAL 21 HG22 VAL 21 6.637 9.807 3.346 134 HG23 VAL 21 HG23 VAL 21 7.199 10.639 4.797 135 H ASP 22 H ASP 22 5.160 12.710 0.054 136 HA ASP 22 HA ASP 22 5.988 15.517 0.283 137 HB2 ASP 22 HB2 ASP 22 5.337 14.003 -2.240 138 HB3 ASP 22 HB1 ASP 22 5.187 15.753 -2.155 139 H ASP 23 H ASP 23 3.950 16.558 -1.341 140 HA ASP 23 HA ASP 23 1.805 16.603 0.528 141 HB2 ASP 23 HB2 ASP 23 0.750 18.106 -1.234 142 HB3 ASP 23 HB1 ASP 23 2.296 18.633 -0.593 143 H THR 24 H THR 24 1.710 15.873 -2.947 144 HA THR 24 HA THR 24 -0.764 14.352 -2.462 145 HB THR 24 HB THR 24 -1.261 14.923 -4.861 146 HG1 THR 24 HG1 THR 24 0.792 16.879 -4.613 147 HG21 THR 24 HG21 THR 24 -0.753 17.264 -3.008 148 HG22 THR 24 HG22 THR 24 -2.182 16.224 -2.978 149 HG23 THR 24 HG23 THR 24 -1.866 17.250 -4.380 150 H SER 25 H SER 25 1.900 13.270 -2.236 151 HA SER 25 HA SER 25 1.768 10.949 -3.796 152 HB2 SER 25 HB2 SER 25 3.962 11.344 -5.050 153 HB3 SER 25 HB1 SER 25 2.540 12.184 -5.672 154 HG SER 25 HG SER 25 4.671 13.237 -4.130 155 H ILE 26 H ILE 26 2.924 9.374 -2.842 156 HA ILE 26 HA ILE 26 5.200 10.035 -1.102 157 HB ILE 26 HB ILE 26 2.620 8.820 -0.102 158 HG12 ILE 26 HG12 ILE 26 4.430 10.953 1.027 159 HG13 ILE 26 HG11 ILE 26 2.900 11.225 0.205 160 HG21 ILE 26 HG21 ILE 26 3.730 8.091 1.930 161 HG22 ILE 26 HG22 ILE 26 5.288 8.581 1.266 162 HG23 ILE 26 HG23 ILE 26 4.389 7.258 0.521 163 HD11 ILE 26 HD11 ILE 26 2.590 11.416 2.576 164 HD12 ILE 26 HD12 ILE 26 3.305 9.823 2.833 165 HD13 ILE 26 HD13 ILE 26 1.761 9.972 1.994 166 H VAL 27 H VAL 27 6.467 7.969 -0.583 167 HA VAL 27 HA VAL 27 5.746 5.888 -2.564 168 HB VAL 27 HB VAL 27 8.536 6.719 -1.769 169 HG11 VAL 27 HG11 VAL 27 8.005 4.284 -2.420 170 HG12 VAL 27 HG12 VAL 27 9.344 5.093 -3.244 171 HG13 VAL 27 HG13 VAL 27 7.784 4.919 -4.051 172 HG21 VAL 27 HG21 VAL 27 7.038 7.208 -4.344 173 HG22 VAL 27 HG22 VAL 27 8.738 7.580 -4.058 174 HG23 VAL 27 HG23 VAL 27 7.486 8.426 -3.149 175 H VAL 28 H VAL 28 5.863 3.742 -1.843 176 HA VAL 28 HA VAL 28 7.068 3.388 0.806 177 HB VAL 28 HB VAL 28 5.312 2.371 1.753 178 HG11 VAL 28 HG11 VAL 28 4.530 4.567 1.074 179 HG12 VAL 28 HG12 VAL 28 3.246 3.389 1.313 180 HG13 VAL 28 HG13 VAL 28 3.751 3.819 -0.322 181 HG21 VAL 28 HG21 VAL 28 4.266 1.451 -0.880 182 HG22 VAL 28 HG22 VAL 28 3.657 0.988 0.710 183 HG23 VAL 28 HG23 VAL 28 5.286 0.507 0.207 184 H ARG 29 H ARG 29 7.928 1.337 1.248 185 HA ARG 29 HA ARG 29 8.371 -0.391 -1.106 186 HB2 ARG 29 HB2 ARG 29 10.527 0.474 0.838 187 HB3 ARG 29 HB1 ARG 29 10.742 -0.511 -0.601 188 HG2 ARG 29 HG2 ARG 29 10.309 1.337 -2.029 189 HG3 ARG 29 HG1 ARG 29 9.763 2.329 -0.682 190 HD2 ARG 29 HD2 ARG 29 11.979 3.005 -1.322 191 HD3 ARG 29 HD1 ARG 29 12.041 2.237 0.262 192 HE ARG 29 HE ARG 29 12.582 0.259 -1.595 193 HH11 ARG 29 HH11 ARG 29 13.984 3.318 -0.613 194 HH12 ARG 29 HH12 ARG 29 15.609 2.836 -0.990 195 HH21 ARG 29 HH21 ARG 29 14.721 -0.367 -2.111 196 HH22 ARG 29 HH22 ARG 29 16.025 0.744 -1.841 197 H TRP 30 H TRP 30 7.934 -2.403 -0.685 198 HA TRP 30 HA TRP 30 7.715 -3.243 2.133 199 HB2 TRP 30 HB2 TRP 30 5.960 -4.854 1.318 200 HB3 TRP 30 HB1 TRP 30 5.522 -3.160 1.143 201 HD1 TRP 30 HD1 TRP 30 6.616 -6.144 -0.976 202 HE1 TRP 30 HE1 TRP 30 5.845 -5.761 -3.397 203 HE3 TRP 30 HE3 TRP 30 4.771 -1.457 -0.434 204 HZ2 TRP 30 HZ2 TRP 30 4.541 -3.728 -4.857 205 HZ3 TRP 30 HZ3 TRP 30 3.741 -0.372 -2.375 206 HH2 TRP 30 HH2 TRP 30 3.620 -1.468 -4.528 207 H SER 31 H SER 31 8.499 -5.186 2.794 208 HA SER 31 HA SER 31 10.358 -6.557 1.047 209 HB2 SER 31 HB2 SER 31 9.575 -7.182 3.909 210 HB3 SER 31 HB1 SER 31 10.961 -7.840 3.038 211 HG SER 31 HG SER 31 10.749 -5.066 3.154 212 H ARG 32 H ARG 32 9.047 -7.454 -0.475 213 HA ARG 32 HA ARG 32 6.594 -8.666 -0.200 214 HB2 ARG 32 HB2 ARG 32 7.281 -9.865 -2.380 215 HB3 ARG 32 HB1 ARG 32 7.219 -8.108 -2.376 216 HG2 ARG 32 HG2 ARG 32 9.803 -9.283 -1.655 217 HG3 ARG 32 HG1 ARG 32 9.288 -9.548 -3.321 218 HD2 ARG 32 HD2 ARG 32 9.109 -7.194 -3.700 219 HD3 ARG 32 HD1 ARG 32 9.353 -6.835 -1.990 220 HE ARG 32 HE ARG 32 11.420 -7.976 -3.767 221 HH11 ARG 32 HH11 ARG 32 10.492 -5.885 -1.099 222 HH12 ARG 32 HH12 ARG 32 12.123 -5.422 -0.745 223 HH21 ARG 32 HH21 ARG 32 13.549 -7.342 -3.302 224 HH22 ARG 32 HH22 ARG 32 13.859 -6.240 -1.998 225 HA PRO 33 HA PRO 33 7.197 -12.504 1.725 226 HB2 PRO 33 HB2 PRO 33 5.076 -13.808 0.283 227 HB3 PRO 33 HB1 PRO 33 5.014 -13.076 1.888 228 HG2 PRO 33 HG2 PRO 33 3.690 -12.116 -0.330 229 HG3 PRO 33 HG1 PRO 33 4.118 -11.143 1.093 230 HD2 PRO 33 HD2 PRO 33 5.462 -11.330 -1.555 231 HD3 PRO 33 HD1 PRO 33 5.221 -9.923 -0.512 232 H GLN 34 H GLN 34 7.788 -14.672 1.562 233 HA GLN 34 HA GLN 34 8.993 -15.560 -0.895 234 HB2 GLN 34 HB2 GLN 34 10.006 -16.096 1.251 235 HB3 GLN 34 HB1 GLN 34 8.556 -16.948 1.757 236 HG2 GLN 34 HG2 GLN 34 8.931 -18.546 -0.113 237 HG3 GLN 34 HG1 GLN 34 10.463 -17.736 -0.430 238 HE21 GLN 34 HE21 GLN 34 11.004 -17.256 2.396 239 HE22 GLN 34 HE22 GLN 34 11.454 -18.787 3.064 240 H ALA 35 H ALA 35 5.959 -15.649 0.590 241 HA ALA 35 HA ALA 35 4.733 -17.952 -0.341 242 HB1 ALA 35 HB1 ALA 35 3.457 -15.224 -0.296 243 HB2 ALA 35 HB2 ALA 35 3.768 -16.176 1.164 244 HB3 ALA 35 HB3 ALA 35 2.674 -16.792 -0.078 245 HA PRO 36 HA PRO 36 4.418 -17.248 -4.776 246 HB2 PRO 36 HB2 PRO 36 1.990 -18.895 -4.660 247 HB3 PRO 36 HB1 PRO 36 3.497 -19.195 -5.527 248 HG2 PRO 36 HG2 PRO 36 2.764 -20.636 -3.365 249 HG3 PRO 36 HG1 PRO 36 4.459 -20.287 -3.746 250 HD2 PRO 36 HD2 PRO 36 2.668 -19.005 -1.724 251 HD3 PRO 36 HD1 PRO 36 4.392 -19.417 -1.607 252 H ILE 37 H ILE 37 3.676 -15.298 -5.295 253 HA ILE 37 HA ILE 37 0.847 -14.671 -4.786 254 HB ILE 37 HB ILE 37 1.506 -12.299 -4.482 255 HG12 ILE 37 HG12 ILE 37 4.205 -13.455 -4.979 256 HG13 ILE 37 HG11 ILE 37 3.484 -11.982 -5.599 257 HG21 ILE 37 HG21 ILE 37 1.253 -13.812 -2.508 258 HG22 ILE 37 HG22 ILE 37 2.341 -12.447 -2.218 259 HG23 ILE 37 HG23 ILE 37 3.002 -14.066 -2.525 260 HD11 ILE 37 HD11 ILE 37 5.099 -11.191 -4.172 261 HD12 ILE 37 HD12 ILE 37 4.821 -12.471 -2.992 262 HD13 ILE 37 HD13 ILE 37 3.652 -11.161 -3.157 263 H THR 38 H THR 38 -0.199 -13.523 -6.459 264 HA THR 38 HA THR 38 1.087 -13.784 -9.062 265 HB THR 38 HB THR 38 -1.204 -13.259 -9.953 266 HG1 THR 38 HG1 THR 38 -1.636 -12.801 -7.309 267 HG21 THR 38 HG21 THR 38 -0.362 -15.515 -9.796 268 HG22 THR 38 HG22 THR 38 -2.085 -15.460 -9.444 269 HG23 THR 38 HG23 THR 38 -0.921 -15.627 -8.128 270 H GLY 39 H GLY 39 -0.028 -11.232 -6.933 271 HA2 GLY 39 HA2 GLY 39 1.316 -9.275 -8.494 272 HA3 GLY 39 HA1 GLY 39 -0.429 -9.152 -8.675 273 H TYR 40 H TYR 40 0.038 -6.990 -7.710 274 HA TYR 40 HA TYR 40 -0.439 -7.214 -4.823 275 HB2 TYR 40 HB2 TYR 40 1.676 -5.583 -6.161 276 HB3 TYR 40 HB1 TYR 40 0.829 -4.891 -4.781 277 HD1 TYR 40 HD2 TYR 40 2.134 -8.311 -5.525 278 HD2 TYR 40 HD1 TYR 40 2.114 -4.984 -2.879 279 HE1 TYR 40 HE2 TYR 40 3.642 -9.504 -4.013 280 HE2 TYR 40 HE1 TYR 40 3.591 -6.194 -1.351 281 HH TYR 40 HH TYR 40 5.210 -9.040 -2.259 282 H ARG 41 H ARG 41 -2.184 -6.108 -4.207 283 HA ARG 41 HA ARG 41 -3.021 -3.810 -5.861 284 HB2 ARG 41 HB2 ARG 41 -4.610 -4.804 -3.542 285 HB3 ARG 41 HB1 ARG 41 -5.140 -4.016 -5.029 286 HG2 ARG 41 HG2 ARG 41 -3.990 -6.790 -4.909 287 HG3 ARG 41 HG1 ARG 41 -5.729 -6.456 -4.827 288 HD2 ARG 41 HD2 ARG 41 -3.868 -5.771 -7.105 289 HD3 ARG 41 HD1 ARG 41 -5.071 -7.058 -7.094 290 HE ARG 41 HE ARG 41 -6.057 -4.349 -6.649 291 HH11 ARG 41 HH11 ARG 41 -5.578 -6.998 -8.906 292 HH12 ARG 41 HH12 ARG 41 -6.733 -6.388 -10.050 293 HH21 ARG 41 HH21 ARG 41 -7.562 -3.563 -8.130 294 HH22 ARG 41 HH22 ARG 41 -7.869 -4.430 -9.603 295 H ILE 42 H ILE 42 -3.306 -1.783 -4.863 296 HA ILE 42 HA ILE 42 -2.228 -1.597 -2.124 297 HB ILE 42 HB ILE 42 -1.327 0.198 -4.350 298 HG12 ILE 42 HG12 ILE 42 0.239 -2.018 -3.064 299 HG13 ILE 42 HG11 ILE 42 -0.627 -2.207 -4.579 300 HG21 ILE 42 HG21 ILE 42 -0.165 -0.207 -1.599 301 HG22 ILE 42 HG22 ILE 42 -1.275 1.095 -2.018 302 HG23 ILE 42 HG23 ILE 42 0.307 1.008 -2.789 303 HD11 ILE 42 HD11 ILE 42 0.744 -0.442 -5.559 304 HD12 ILE 42 HD12 ILE 42 1.703 -1.805 -4.981 305 HD13 ILE 42 HD13 ILE 42 1.630 -0.317 -4.043 306 H VAL 43 H VAL 43 -3.795 -0.725 -0.940 307 HA VAL 43 HA VAL 43 -5.323 1.481 -2.179 308 HB VAL 43 HB VAL 43 -6.209 -0.405 0.010 309 HG11 VAL 43 HG11 VAL 43 -7.024 1.802 0.484 310 HG12 VAL 43 HG12 VAL 43 -8.341 0.774 -0.069 311 HG13 VAL 43 HG13 VAL 43 -7.633 1.965 -1.161 312 HG21 VAL 43 HG21 VAL 43 -6.293 -1.338 -2.263 313 HG22 VAL 43 HG22 VAL 43 -7.281 0.033 -2.771 314 HG23 VAL 43 HG23 VAL 43 -7.902 -1.108 -1.579 315 H TYR 44 H TYR 44 -4.601 3.354 -1.516 316 HA TYR 44 HA TYR 44 -3.935 3.666 1.309 317 HB2 TYR 44 HB2 TYR 44 -2.570 5.703 0.405 318 HB3 TYR 44 HB1 TYR 44 -1.889 4.086 0.340 319 HD1 TYR 44 HD2 TYR 44 -2.130 2.802 -1.862 320 HD2 TYR 44 HD1 TYR 44 -2.708 6.997 -1.538 321 HE1 TYR 44 HE2 TYR 44 -1.729 3.015 -4.265 322 HE2 TYR 44 HE1 TYR 44 -2.302 7.243 -3.945 323 HH TYR 44 HH TYR 44 -2.290 4.678 -6.091 324 H SER 45 H SER 45 -4.987 4.963 2.435 325 HA SER 45 HA SER 45 -6.574 7.117 1.271 326 HB2 SER 45 HB2 SER 45 -8.629 6.230 2.445 327 HB3 SER 45 HB1 SER 45 -8.107 5.295 1.047 328 HG SER 45 HG SER 45 -8.566 4.368 3.408 329 HA PRO 46 HA PRO 46 -5.562 9.175 5.112 330 HB2 PRO 46 HB2 PRO 46 -8.189 10.428 4.836 331 HB3 PRO 46 HB1 PRO 46 -6.605 11.179 4.963 332 HG2 PRO 46 HG2 PRO 46 -7.924 11.146 2.646 333 HG3 PRO 46 HG1 PRO 46 -6.166 10.941 2.704 334 HD2 PRO 46 HD2 PRO 46 -8.305 8.894 2.311 335 HD3 PRO 46 HD1 PRO 46 -6.708 9.023 1.544 336 H SER 47 H SER 47 -6.118 9.130 7.266 337 HA SER 47 HA SER 47 -7.379 6.772 8.099 338 HB2 SER 47 HB2 SER 47 -6.668 9.190 9.766 339 HB3 SER 47 HB1 SER 47 -6.923 7.548 10.358 340 HG SER 47 HG SER 47 -5.147 7.182 8.575 341 H VAL 48 H VAL 48 -8.700 9.944 7.595 342 HA VAL 48 HA VAL 48 -11.137 9.072 8.986 343 HB VAL 48 HB VAL 48 -10.229 10.988 10.097 344 HG11 VAL 48 HG11 VAL 48 -10.267 12.349 7.412 345 HG12 VAL 48 HG12 VAL 48 -8.837 11.862 8.318 346 HG13 VAL 48 HG13 VAL 48 -9.889 13.129 8.948 347 HG21 VAL 48 HG21 VAL 48 -12.572 11.766 8.379 348 HG22 VAL 48 HG22 VAL 48 -12.074 12.590 9.858 349 HG23 VAL 48 HG23 VAL 48 -12.642 10.921 9.925 350 H GLU 49 H GLU 49 -9.952 10.777 6.114 351 HA GLU 49 HA GLU 49 -11.814 9.788 4.312 352 HB2 GLU 49 HB2 GLU 49 -13.487 10.991 5.681 353 HB3 GLU 49 HB1 GLU 49 -12.604 12.490 5.434 354 HG2 GLU 49 HG2 GLU 49 -13.043 12.317 3.019 355 HG3 GLU 49 HG1 GLU 49 -13.987 10.859 3.319 356 H GLY 50 H GLY 50 -11.394 10.545 2.220 357 HA2 GLY 50 HA2 GLY 50 -10.649 12.890 1.242 358 HA3 GLY 50 HA1 GLY 50 -9.137 12.380 1.974 359 H SER 51 H SER 51 -8.300 12.505 -0.218 360 HA SER 51 HA SER 51 -9.281 10.952 -2.342 361 HB2 SER 51 HB2 SER 51 -6.432 11.902 -1.899 362 HB3 SER 51 HB1 SER 51 -7.184 11.483 -3.441 363 HG SER 51 HG SER 51 -7.242 13.699 -3.216 364 H SER 52 H SER 52 -9.286 8.807 -2.570 365 HA SER 52 HA SER 52 -7.134 7.258 -1.272 366 HB2 SER 52 HB2 SER 52 -9.900 6.222 -1.929 367 HB3 SER 52 HB1 SER 52 -8.681 5.469 -0.899 368 HG SER 52 HG SER 52 -9.701 8.031 -0.288 369 H THR 53 H THR 53 -6.077 5.731 -2.477 370 HA THR 53 HA THR 53 -6.980 5.361 -5.246 371 HB THR 53 HB THR 53 -4.122 6.078 -4.588 372 HG1 THR 53 HG1 THR 53 -4.579 8.144 -5.172 373 HG21 THR 53 HG21 THR 53 -3.947 6.423 -7.016 374 HG22 THR 53 HG22 THR 53 -5.618 5.885 -7.202 375 HG23 THR 53 HG23 THR 53 -4.391 4.763 -6.613 376 H GLU 54 H GLU 54 -6.435 3.404 -6.150 377 HA GLU 54 HA GLU 54 -4.849 1.544 -4.549 378 HB2 GLU 54 HB2 GLU 54 -7.210 0.864 -4.708 379 HB3 GLU 54 HB1 GLU 54 -7.117 0.949 -6.462 380 HG2 GLU 54 HG2 GLU 54 -5.325 -0.812 -6.347 381 HG3 GLU 54 HG1 GLU 54 -5.725 -0.994 -4.642 382 H LEU 55 H LEU 55 -2.965 0.985 -5.488 383 HA LEU 55 HA LEU 55 -2.829 1.180 -8.415 384 HB2 LEU 55 HB2 LEU 55 -0.532 1.213 -6.419 385 HB3 LEU 55 HB1 LEU 55 -0.348 1.133 -8.169 386 HG LEU 55 HG LEU 55 -1.346 3.391 -6.498 387 HD11 LEU 55 HD11 LEU 55 0.249 4.624 -8.028 388 HD12 LEU 55 HD12 LEU 55 0.813 3.032 -8.538 389 HD13 LEU 55 HD13 LEU 55 0.950 3.522 -6.851 390 HD21 LEU 55 HD21 LEU 55 -1.993 4.569 -8.567 391 HD22 LEU 55 HD22 LEU 55 -3.017 3.174 -8.229 392 HD23 LEU 55 HD23 LEU 55 -1.763 3.070 -9.464 393 H ASN 56 H ASN 56 -1.704 -0.462 -9.570 394 HA ASN 56 HA ASN 56 -1.833 -3.080 -8.228 395 HB2 ASN 56 HB2 ASN 56 -3.620 -2.890 -9.881 396 HB3 ASN 56 HB1 ASN 56 -2.462 -2.394 -11.112 397 HD21 ASN 56 HD21 ASN 56 -3.638 -5.044 -9.190 398 HD22 ASN 56 HD22 ASN 56 -2.925 -6.305 -10.135 399 H LEU 57 H LEU 57 0.103 -3.947 -7.989 400 HA LEU 57 HA LEU 57 2.219 -3.197 -9.895 401 HB2 LEU 57 HB2 LEU 57 2.409 -3.799 -6.928 402 HB3 LEU 57 HB1 LEU 57 3.798 -3.752 -7.987 403 HG LEU 57 HG LEU 57 2.186 -1.548 -6.863 404 HD11 LEU 57 HD11 LEU 57 4.345 -0.508 -6.688 405 HD12 LEU 57 HD12 LEU 57 5.071 -1.781 -7.671 406 HD13 LEU 57 HD13 LEU 57 4.432 -2.158 -6.073 407 HD21 LEU 57 HD21 LEU 57 2.869 0.002 -8.597 408 HD22 LEU 57 HD22 LEU 57 1.778 -1.230 -9.231 409 HD23 LEU 57 HD23 LEU 57 3.510 -1.335 -9.551 410 HA PRO 58 HA PRO 58 2.687 -7.521 -10.670 411 HB2 PRO 58 HB2 PRO 58 5.405 -7.713 -10.955 412 HB3 PRO 58 HB1 PRO 58 4.323 -7.115 -12.214 413 HG2 PRO 58 HG2 PRO 58 6.075 -5.605 -10.343 414 HG3 PRO 58 HG1 PRO 58 5.656 -5.252 -12.027 415 HD2 PRO 58 HD2 PRO 58 4.540 -3.976 -9.879 416 HD3 PRO 58 HD1 PRO 58 3.728 -4.156 -11.442 417 H GLU 59 H GLU 59 3.144 -9.373 -9.630 418 HA GLU 59 HA GLU 59 3.296 -9.638 -6.929 419 HB2 GLU 59 HB2 GLU 59 4.121 -11.955 -7.360 420 HB3 GLU 59 HB1 GLU 59 2.727 -11.494 -8.328 421 HG2 GLU 59 HG2 GLU 59 4.190 -11.064 -10.232 422 HG3 GLU 59 HG1 GLU 59 5.590 -11.510 -9.260 423 H THR 60 H THR 60 5.924 -8.944 -9.013 424 HA THR 60 HA THR 60 7.890 -9.672 -6.964 425 HB THR 60 HB THR 60 8.247 -10.749 -9.117 426 HG1 THR 60 HG1 THR 60 10.089 -8.844 -8.191 427 HG21 THR 60 HG21 THR 60 8.810 -9.435 -11.119 428 HG22 THR 60 HG22 THR 60 8.422 -7.956 -10.241 429 HG23 THR 60 HG23 THR 60 7.160 -9.142 -10.570 430 H ALA 61 H ALA 61 6.162 -7.114 -7.392 431 HA ALA 61 HA ALA 61 8.217 -5.077 -7.674 432 HB1 ALA 61 HB1 ALA 61 5.289 -4.836 -6.988 433 HB2 ALA 61 HB2 ALA 61 6.009 -4.625 -8.584 434 HB3 ALA 61 HB3 ALA 61 6.380 -3.484 -7.291 435 H ASN 62 H ASN 62 8.441 -3.387 -5.953 436 HA ASN 62 HA ASN 62 7.999 -4.457 -3.268 437 HB2 ASN 62 HB2 ASN 62 10.267 -4.220 -2.594 438 HB3 ASN 62 HB1 ASN 62 10.261 -5.184 -4.066 439 HD21 ASN 62 HD21 ASN 62 12.404 -3.606 -2.891 440 HD22 ASN 62 HD22 ASN 62 12.875 -2.456 -4.092 441 H SER 63 H SER 63 7.353 -1.944 -5.119 442 HA SER 63 HA SER 63 7.228 -0.124 -2.929 443 HB2 SER 63 HB2 SER 63 8.742 1.611 -4.001 444 HB3 SER 63 HB1 SER 63 9.560 0.215 -3.303 445 HG SER 63 HG SER 63 9.399 -0.650 -5.565 446 H VAL 64 H VAL 64 5.727 1.420 -3.285 447 HA VAL 64 HA VAL 64 4.773 1.787 -6.051 448 HB VAL 64 HB VAL 64 2.996 0.628 -4.917 449 HG11 VAL 64 HG11 VAL 64 2.699 2.668 -2.816 450 HG12 VAL 64 HG12 VAL 64 3.980 1.471 -2.643 451 HG13 VAL 64 HG13 VAL 64 2.310 0.948 -2.810 452 HG21 VAL 64 HG21 VAL 64 2.399 2.530 -6.325 453 HG22 VAL 64 HG22 VAL 64 2.260 3.511 -4.861 454 HG23 VAL 64 HG23 VAL 64 1.212 2.110 -5.098 455 H THR 65 H THR 65 4.685 3.826 -6.792 456 HA THR 65 HA THR 65 5.032 6.074 -5.008 457 HB THR 65 HB THR 65 4.725 5.771 -7.986 458 HG1 THR 65 HG1 THR 65 6.939 6.495 -7.929 459 HG21 THR 65 HG21 THR 65 5.224 8.316 -6.420 460 HG22 THR 65 HG22 THR 65 3.739 7.917 -7.285 461 HG23 THR 65 HG23 THR 65 5.238 8.168 -8.178 462 H LEU 66 H LEU 66 3.237 6.359 -3.862 463 HA LEU 66 HA LEU 66 0.564 6.050 -4.836 464 HB2 LEU 66 HB2 LEU 66 1.099 7.652 -2.431 465 HB3 LEU 66 HB1 LEU 66 -0.075 6.381 -2.686 466 HG LEU 66 HG LEU 66 2.826 5.724 -2.412 467 HD11 LEU 66 HD11 LEU 66 2.151 7.126 -0.530 468 HD12 LEU 66 HD12 LEU 66 2.563 5.482 -0.081 469 HD13 LEU 66 HD13 LEU 66 0.871 5.975 -0.167 470 HD21 LEU 66 HD21 LEU 66 1.811 3.622 -1.529 471 HD22 LEU 66 HD22 LEU 66 1.446 3.955 -3.223 472 HD23 LEU 66 HD23 LEU 66 0.232 4.277 -1.982 473 H SER 67 H SER 67 -0.784 7.608 -5.579 474 HA SER 67 HA SER 67 0.299 10.331 -5.745 475 HB2 SER 67 HB2 SER 67 -0.720 10.371 -8.098 476 HB3 SER 67 HB1 SER 67 0.769 9.448 -7.890 477 HG SER 67 HG SER 67 -1.855 8.551 -8.320 478 H ASP 68 H ASP 68 -1.326 11.954 -6.229 479 HA ASP 68 HA ASP 68 -3.237 13.060 -5.783 480 HB2 ASP 68 HB2 ASP 68 -4.247 10.393 -6.560 481 HB3 ASP 68 HB1 ASP 68 -5.363 11.398 -5.643 482 H LEU 69 H LEU 69 -1.722 12.613 -3.644 483 HA LEU 69 HA LEU 69 -3.553 11.838 -1.501 484 HB2 LEU 69 HB2 LEU 69 -0.877 13.048 -0.944 485 HB3 LEU 69 HB1 LEU 69 -1.796 11.876 -0.021 486 HG LEU 69 HG LEU 69 -0.275 11.277 -2.542 487 HD11 LEU 69 HD11 LEU 69 1.117 11.778 -0.586 488 HD12 LEU 69 HD12 LEU 69 1.207 10.078 -1.050 489 HD13 LEU 69 HD13 LEU 69 0.235 10.565 0.341 490 HD21 LEU 69 HD21 LEU 69 -0.781 8.904 -1.647 491 HD22 LEU 69 HD22 LEU 69 -2.089 9.773 -2.458 492 HD23 LEU 69 HD23 LEU 69 -2.036 9.705 -0.693 493 H GLN 70 H GLN 70 -3.134 13.526 0.479 494 HA GLN 70 HA GLN 70 -3.503 16.240 -0.587 495 HB2 GLN 70 HB2 GLN 70 -4.988 15.011 1.745 496 HB3 GLN 70 HB1 GLN 70 -5.121 16.676 1.201 497 HG2 GLN 70 HG2 GLN 70 -5.827 14.328 -0.527 498 HG3 GLN 70 HG1 GLN 70 -6.978 15.137 0.533 499 HE21 GLN 70 HE21 GLN 70 -8.262 15.792 -1.175 500 HE22 GLN 70 HE22 GLN 70 -7.786 17.047 -2.268 501 HA PRO 71 HA PRO 71 -0.082 17.061 2.119 502 HB2 PRO 71 HB2 PRO 71 -0.338 19.771 2.223 503 HB3 PRO 71 HB1 PRO 71 0.389 18.886 0.880 504 HG2 PRO 71 HG2 PRO 71 -2.367 20.017 1.134 505 HG3 PRO 71 HG1 PRO 71 -1.279 20.020 -0.267 506 HD2 PRO 71 HD2 PRO 71 -3.337 18.284 -0.031 507 HD3 PRO 71 HD1 PRO 71 -1.822 17.858 -0.853 508 H GLY 72 H GLY 72 0.109 17.004 4.271 509 HA2 GLY 72 HA2 GLY 72 -0.263 17.514 6.497 510 HA3 GLY 72 HA1 GLY 72 -1.502 18.657 5.996 511 H VAL 73 H VAL 73 -1.485 15.330 4.959 512 HA VAL 73 HA VAL 73 -3.715 14.727 6.777 513 HB VAL 73 HB VAL 73 -3.711 14.209 3.782 514 HG11 VAL 73 HG11 VAL 73 -5.998 13.687 5.608 515 HG12 VAL 73 HG12 VAL 73 -4.738 12.457 5.438 516 HG13 VAL 73 HG13 VAL 73 -5.658 12.985 4.025 517 HG21 VAL 73 HG21 VAL 73 -5.786 15.668 5.331 518 HG22 VAL 73 HG22 VAL 73 -5.400 15.780 3.611 519 HG23 VAL 73 HG23 VAL 73 -4.330 16.518 4.808 520 H GLN 74 H GLN 74 -3.872 12.617 7.443 521 HA GLN 74 HA GLN 74 -1.406 11.126 7.338 522 HB2 GLN 74 HB2 GLN 74 -2.515 11.529 9.448 523 HB3 GLN 74 HB1 GLN 74 -3.997 10.821 8.830 524 HG2 GLN 74 HG2 GLN 74 -3.210 9.064 10.044 525 HG3 GLN 74 HG1 GLN 74 -2.418 8.722 8.507 526 HE21 GLN 74 HE21 GLN 74 -0.186 9.081 8.311 527 HE22 GLN 74 HE22 GLN 74 0.823 9.303 9.698 528 H TYR 75 H TYR 75 -1.115 9.706 5.700 529 HA TYR 75 HA TYR 75 -3.508 8.469 4.546 530 HB2 TYR 75 HB2 TYR 75 -0.882 9.272 3.427 531 HB3 TYR 75 HB1 TYR 75 -1.642 7.835 2.744 532 HD1 TYR 75 HD1 TYR 75 -2.234 11.431 3.475 533 HD2 TYR 75 HD2 TYR 75 -3.397 8.018 1.219 534 HE1 TYR 75 HE1 TYR 75 -3.734 12.835 2.126 535 HE2 TYR 75 HE2 TYR 75 -4.891 9.415 -0.136 536 HH TYR 75 HH TYR 75 -4.805 12.786 -0.115 537 H ASN 76 H ASN 76 -3.934 6.447 4.794 538 HA ASN 76 HA ASN 76 -1.944 4.659 5.974 539 HB2 ASN 76 HB2 ASN 76 -4.919 4.354 5.508 540 HB3 ASN 76 HB1 ASN 76 -3.897 3.102 6.200 541 HD21 ASN 76 HD21 ASN 76 -3.301 3.231 8.308 542 HD22 ASN 76 HD22 ASN 76 -3.879 4.444 9.396 543 H ILE 77 H ILE 77 -0.688 3.705 4.522 544 HA ILE 77 HA ILE 77 -1.749 2.933 1.920 545 HB ILE 77 HB ILE 77 1.049 2.685 3.022 546 HG12 ILE 77 HG12 ILE 77 1.405 4.353 1.075 547 HG13 ILE 77 HG11 ILE 77 -0.278 4.736 1.314 548 HG21 ILE 77 HG21 ILE 77 1.487 2.477 0.458 549 HG22 ILE 77 HG22 ILE 77 -0.152 1.817 0.456 550 HG23 ILE 77 HG23 ILE 77 1.109 1.050 1.433 551 HD11 ILE 77 HD11 ILE 77 0.190 5.306 3.652 552 HD12 ILE 77 HD12 ILE 77 1.127 6.287 2.523 553 HD13 ILE 77 HD13 ILE 77 1.895 4.951 3.381 554 H THR 78 H THR 78 -2.648 1.071 1.679 555 HA THR 78 HA THR 78 -1.936 -1.094 3.502 556 HB THR 78 HB THR 78 -4.391 -0.751 1.794 557 HG1 THR 78 HG1 THR 78 -4.513 0.799 3.366 558 HG21 THR 78 HG21 THR 78 -5.325 -2.519 3.242 559 HG22 THR 78 HG22 THR 78 -3.772 -2.648 4.068 560 HG23 THR 78 HG23 THR 78 -3.903 -3.085 2.364 561 H ILE 79 H ILE 79 -0.566 -2.538 2.620 562 HA ILE 79 HA ILE 79 -0.523 -2.843 -0.322 563 HB ILE 79 HB ILE 79 1.405 -4.219 1.562 564 HG12 ILE 79 HG12 ILE 79 1.961 -1.949 1.962 565 HG13 ILE 79 HG11 ILE 79 3.096 -2.545 0.748 566 HG21 ILE 79 HG21 ILE 79 1.442 -5.234 -0.538 567 HG22 ILE 79 HG22 ILE 79 2.836 -4.142 -0.496 568 HG23 ILE 79 HG23 ILE 79 1.376 -3.677 -1.371 569 HD11 ILE 79 HD11 ILE 79 0.645 -1.094 -0.106 570 HD12 ILE 79 HD12 ILE 79 2.218 -1.253 -0.907 571 HD13 ILE 79 HD13 ILE 79 2.038 -0.213 0.519 572 H TYR 80 H TYR 80 -1.222 -4.628 -1.326 573 HA TYR 80 HA TYR 80 -2.080 -6.919 0.329 574 HB2 TYR 80 HB2 TYR 80 -3.301 -5.939 -2.266 575 HB3 TYR 80 HB1 TYR 80 -3.869 -7.289 -1.300 576 HD1 TYR 80 HD1 TYR 80 -3.748 -3.612 -1.589 577 HD2 TYR 80 HD2 TYR 80 -5.162 -6.927 0.698 578 HE1 TYR 80 HE1 TYR 80 -5.335 -2.146 -0.429 579 HE2 TYR 80 HE2 TYR 80 -6.745 -5.452 1.864 580 HH TYR 80 HH TYR 80 -7.012 -3.058 2.379 581 H ALA 81 H ALA 81 -0.591 -8.513 -0.056 582 HA ALA 81 HA ALA 81 0.529 -8.957 -2.694 583 HB1 ALA 81 HB1 ALA 81 1.936 -9.520 -0.807 584 HB2 ALA 81 HB2 ALA 81 1.512 -11.026 -1.640 585 HB3 ALA 81 HB3 ALA 81 0.695 -10.577 -0.132 586 H VAL 82 H VAL 82 -0.730 -9.804 -4.249 587 HA VAL 82 HA VAL 82 -3.046 -11.408 -3.332 588 HB VAL 82 HB VAL 82 -3.725 -9.465 -4.630 589 HG11 VAL 82 HG11 VAL 82 -2.158 -10.625 -6.903 590 HG12 VAL 82 HG12 VAL 82 -1.741 -9.172 -5.996 591 HG13 VAL 82 HG13 VAL 82 -3.208 -9.211 -6.972 592 HG21 VAL 82 HG21 VAL 82 -4.100 -11.989 -6.223 593 HG22 VAL 82 HG22 VAL 82 -5.137 -10.558 -6.264 594 HG23 VAL 82 HG23 VAL 82 -5.043 -11.538 -4.800 595 H GLU 83 H GLU 83 -3.444 -13.412 -4.032 596 HA GLU 83 HA GLU 83 -1.462 -14.676 -5.789 597 HB2 GLU 83 HB2 GLU 83 -1.355 -15.291 -3.414 598 HB3 GLU 83 HB1 GLU 83 -3.008 -15.865 -3.464 599 HG2 GLU 83 HG2 GLU 83 -0.800 -16.992 -5.129 600 HG3 GLU 83 HG1 GLU 83 -1.129 -17.555 -3.501 601 H GLU 84 H GLU 84 -2.576 -16.736 -6.863 602 HA GLU 84 HA GLU 84 -4.449 -15.867 -8.653 603 HB2 GLU 84 HB2 GLU 84 -4.019 -18.688 -7.677 604 HB3 GLU 84 HB1 GLU 84 -4.960 -18.269 -9.099 605 HG2 GLU 84 HG2 GLU 84 -2.934 -17.234 -10.073 606 HG3 GLU 84 HG1 GLU 84 -2.020 -17.807 -8.680 607 H ASN 85 H ASN 85 -5.131 -17.418 -5.532 608 HA ASN 85 HA ASN 85 -8.009 -17.273 -6.169 609 HB2 ASN 85 HB2 ASN 85 -6.948 -19.511 -5.677 610 HB3 ASN 85 HB1 ASN 85 -6.677 -18.948 -4.037 611 HD21 ASN 85 HD21 ASN 85 -8.221 -21.193 -4.983 612 HD22 ASN 85 HD22 ASN 85 -9.834 -20.963 -4.401 613 H GLN 86 H GLN 86 -5.586 -16.184 -3.901 614 HA GLN 86 HA GLN 86 -7.689 -15.103 -2.167 615 HB2 GLN 86 HB2 GLN 86 -6.441 -15.936 -0.218 616 HB3 GLN 86 HB1 GLN 86 -6.966 -17.239 -1.280 617 HG2 GLN 86 HG2 GLN 86 -4.668 -17.134 -2.325 618 HG3 GLN 86 HG1 GLN 86 -4.208 -16.126 -0.955 619 HE21 GLN 86 HE21 GLN 86 -3.304 -18.775 -1.797 620 HE22 GLN 86 HE22 GLN 86 -3.532 -19.804 -0.432 621 H GLU 87 H GLU 87 -6.549 -13.717 -0.393 622 HA GLU 87 HA GLU 87 -4.242 -12.297 -1.533 623 HB2 GLU 87 HB2 GLU 87 -6.684 -11.031 -0.266 624 HB3 GLU 87 HB1 GLU 87 -5.212 -10.167 -0.686 625 HG2 GLU 87 HG2 GLU 87 -5.557 -10.690 -3.035 626 HG3 GLU 87 HG1 GLU 87 -7.015 -11.594 -2.627 627 H SER 88 H SER 88 -2.662 -11.861 -0.100 628 HA SER 88 HA SER 88 -2.657 -13.147 2.411 629 HB2 SER 88 HB2 SER 88 -0.808 -10.949 1.459 630 HB3 SER 88 HB1 SER 88 -0.474 -12.139 2.715 631 HG SER 88 HG SER 88 0.492 -12.826 0.834 632 H THR 89 H THR 89 -2.086 -11.961 4.474 633 HA THR 89 HA THR 89 -4.013 -10.148 5.293 634 HB THR 89 HB THR 89 -2.146 -9.537 7.055 635 HG1 THR 89 HG1 THR 89 -1.126 -12.049 6.287 636 HG21 THR 89 HG21 THR 89 -4.123 -10.885 7.534 637 HG22 THR 89 HG22 THR 89 -2.697 -11.579 8.303 638 HG23 THR 89 HG23 THR 89 -3.343 -12.300 6.829 639 HA PRO 90 HA PRO 90 -2.612 -6.395 3.534 640 HB2 PRO 90 HB2 PRO 90 -3.922 -4.587 5.019 641 HB3 PRO 90 HB1 PRO 90 -4.774 -5.731 3.978 642 HG2 PRO 90 HG2 PRO 90 -4.431 -5.752 6.934 643 HG3 PRO 90 HG1 PRO 90 -5.810 -6.282 5.959 644 HD2 PRO 90 HD2 PRO 90 -3.839 -7.921 7.073 645 HD3 PRO 90 HD1 PRO 90 -5.001 -8.387 5.817 646 H VAL 91 H VAL 91 -0.927 -5.073 3.599 647 HA VAL 91 HA VAL 91 0.586 -4.461 6.002 648 HB VAL 91 HB VAL 91 0.704 -3.553 3.139 649 HG11 VAL 91 HG11 VAL 91 2.298 -2.462 5.451 650 HG12 VAL 91 HG12 VAL 91 1.079 -1.592 4.521 651 HG13 VAL 91 HG13 VAL 91 2.576 -2.099 3.754 652 HG21 VAL 91 HG21 VAL 91 2.758 -4.883 4.892 653 HG22 VAL 91 HG22 VAL 91 2.932 -4.481 3.182 654 HG23 VAL 91 HG23 VAL 91 1.758 -5.700 3.689 655 H VAL 92 H VAL 92 -0.124 -2.835 7.371 656 HA VAL 92 HA VAL 92 -1.435 -0.558 6.039 657 HB VAL 92 HB VAL 92 -1.827 -1.179 8.958 658 HG11 VAL 92 HG11 VAL 92 -3.862 0.194 8.591 659 HG12 VAL 92 HG12 VAL 92 -3.329 0.466 6.929 660 HG13 VAL 92 HG13 VAL 92 -2.362 1.065 8.277 661 HG21 VAL 92 HG21 VAL 92 -3.974 -2.225 8.378 662 HG22 VAL 92 HG22 VAL 92 -2.607 -3.141 7.742 663 HG23 VAL 92 HG23 VAL 92 -3.557 -2.115 6.668 664 H ILE 93 H ILE 93 0.134 0.883 5.772 665 HA ILE 93 HA ILE 93 1.702 1.626 8.154 666 HB ILE 93 HB ILE 93 3.402 2.562 6.458 667 HG12 ILE 93 HG12 ILE 93 2.233 0.484 4.636 668 HG13 ILE 93 HG11 ILE 93 1.784 2.168 4.523 669 HG21 ILE 93 HG21 ILE 93 3.887 0.677 7.885 670 HG22 ILE 93 HG22 ILE 93 4.527 0.379 6.270 671 HG23 ILE 93 HG23 ILE 93 3.038 -0.411 6.789 672 HD11 ILE 93 HD11 ILE 93 4.535 1.036 4.211 673 HD12 ILE 93 HD12 ILE 93 4.146 2.759 4.203 674 HD13 ILE 93 HD13 ILE 93 3.508 1.691 2.930 675 H GLN 94 H GLN 94 1.033 3.494 8.939 676 HA GLN 94 HA GLN 94 -0.317 5.349 7.122 677 HB2 GLN 94 HB2 GLN 94 -1.181 6.407 9.222 678 HB3 GLN 94 HB1 GLN 94 -1.713 4.756 8.947 679 HG2 GLN 94 HG2 GLN 94 -0.020 3.963 10.540 680 HG3 GLN 94 HG1 GLN 94 0.460 5.635 10.836 681 HE21 GLN 94 HE21 GLN 94 -0.080 5.522 13.009 682 HE22 GLN 94 HE22 GLN 94 -1.721 5.485 13.551 683 H GLN 95 H GLN 95 0.750 6.992 6.398 684 HA GLN 95 HA GLN 95 2.759 8.278 8.112 685 HB2 GLN 95 HB2 GLN 95 3.451 6.720 6.003 686 HB3 GLN 95 HB1 GLN 95 3.262 8.261 5.192 687 HG2 GLN 95 HG2 GLN 95 5.056 7.733 7.554 688 HG3 GLN 95 HG1 GLN 95 5.576 7.818 5.876 689 HE21 GLN 95 HE21 GLN 95 3.842 10.047 5.219 690 HE22 GLN 95 HE22 GLN 95 4.522 11.440 5.979 691 H GLU 96 H GLU 96 2.516 10.450 8.225 692 HA GLU 96 HA GLU 96 0.296 11.594 6.741 693 HB2 GLU 96 HB2 GLU 96 0.349 11.999 9.125 694 HB3 GLU 96 HB1 GLU 96 1.949 12.715 9.006 695 HG2 GLU 96 HG2 GLU 96 0.989 14.506 7.599 696 HG3 GLU 96 HG1 GLU 96 -0.607 13.802 7.847 697 H THR 97 H THR 97 0.441 12.930 5.140 698 HA THR 97 HA THR 97 2.801 13.284 3.697 699 HB THR 97 HB THR 97 1.436 14.974 2.413 700 HG1 THR 97 HG1 THR 97 -0.945 14.541 3.319 701 HG21 THR 97 HG21 THR 97 0.083 12.331 2.992 702 HG22 THR 97 HG22 THR 97 1.400 12.574 1.844 703 HG23 THR 97 HG23 THR 97 -0.168 13.332 1.561 704 H THR 98 H THR 98 4.420 14.665 3.914 705 HA THR 98 HA THR 98 4.528 16.611 5.971 706 HB THR 98 HB THR 98 6.370 16.412 3.584 707 HG1 THR 98 HG1 THR 98 6.259 14.842 5.961 708 HG21 THR 98 HG21 THR 98 6.820 17.333 6.428 709 HG22 THR 98 HG22 THR 98 6.726 18.364 5.000 710 HG23 THR 98 HG23 THR 98 8.061 17.226 5.180 711 H GLY 99 H GLY 99 3.818 16.645 2.564 712 HA2 GLY 99 HA2 GLY 99 2.500 18.249 1.478 713 HA3 GLY 99 HA1 GLY 99 2.773 19.346 2.813 714 H THR 100 H THR 100 3.538 21.102 1.812 715 HA THR 100 HA THR 100 6.086 20.781 0.381 716 HB THR 100 HB THR 100 3.981 22.825 -0.336 717 HG1 THR 100 HG1 THR 100 3.208 20.796 -0.940 718 HG21 THR 100 HG21 THR 100 5.324 23.155 -2.318 719 HG22 THR 100 HG22 THR 100 6.489 21.963 -1.743 720 HG23 THR 100 HG23 THR 100 6.253 23.471 -0.859 721 HA PRO 101 HA PRO 101 7.629 23.192 3.782 722 HB2 PRO 101 HB2 PRO 101 9.400 24.220 1.597 723 HB3 PRO 101 HB1 PRO 101 9.825 23.681 3.225 724 HG2 PRO 101 HG2 PRO 101 10.216 22.096 1.118 725 HG3 PRO 101 HG1 PRO 101 9.668 21.439 2.671 726 HD2 PRO 101 HD2 PRO 101 8.163 21.821 0.144 727 HD3 PRO 101 HD1 PRO 101 7.909 20.642 1.444 728 H ARG 102 H ARG 102 7.924 25.067 0.770 729 HA ARG 102 HA ARG 102 5.979 26.990 1.737 730 HB2 ARG 102 HB2 ARG 102 8.156 27.731 2.668 731 HB3 ARG 102 HB1 ARG 102 8.801 27.813 1.035 732 HG2 ARG 102 HG2 ARG 102 7.575 29.684 0.500 733 HG3 ARG 102 HG1 ARG 102 6.355 29.363 1.733 734 HD2 ARG 102 HD2 ARG 102 9.196 30.232 2.246 735 HD3 ARG 102 HD1 ARG 102 7.768 31.262 2.352 736 HE ARG 102 HE ARG 102 7.122 29.324 4.056 737 HH11 ARG 102 HH11 ARG 102 10.092 31.141 3.713 738 HH12 ARG 102 HH12 ARG 102 10.531 30.968 5.382 739 HH21 ARG 102 HH21 ARG 102 7.700 29.087 6.242 740 HH22 ARG 102 HH22 ARG 102 9.169 29.807 6.822 741 H SER 103 H SER 103 4.659 27.322 0.120 742 HA SER 103 HA SER 103 3.788 27.686 -1.925 743 HB2 SER 103 HB2 SER 103 6.613 28.433 -2.707 744 HB3 SER 103 HB1 SER 103 5.156 28.793 -3.636 745 HG SER 103 HG SER 103 6.110 30.434 -2.057 746 H ASP 104 H ASP 104 6.841 26.714 -3.396 747 HA ASP 104 HA ASP 104 5.584 24.153 -4.130 748 HB2 ASP 104 HB2 ASP 104 7.023 26.126 -5.874 749 HB3 ASP 104 HB1 ASP 104 7.015 24.417 -6.286 750 H GLY 105 H GLY 105 7.754 25.342 -2.228 751 HA2 GLY 105 HA2 GLY 105 9.145 23.302 -1.400 752 HA3 GLY 105 HA1 GLY 105 9.964 23.554 -2.938 753 H THR 106 H THR 106 11.065 25.530 -3.293 754 HA THR 106 HA THR 106 11.390 27.326 -1.056 755 HB THR 106 HB THR 106 13.081 25.731 -0.472 756 HG1 THR 106 HG1 THR 106 15.046 27.111 -1.036 757 HG21 THR 106 HG21 THR 106 14.143 26.001 -3.282 758 HG22 THR 106 HG22 THR 106 13.317 24.592 -2.615 759 HG23 THR 106 HG23 THR 106 14.890 25.077 -1.979 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 -3.214 -32.391 13.496 2 H2 GLY 1 HT2 GLY 1 -2.250 -33.773 13.611 3 H3 GLY 1 HT3 GLY 1 -2.934 -33.337 12.127 4 HA2 GLY 1 HA1 GLY 1 -0.912 -31.752 13.598 5 HA3 GLY 1 HA2 GLY 1 -0.572 -32.791 12.221 6 H SER 2 H SER 2 0.241 -30.378 11.802 7 HA SER 2 HA SER 2 -1.827 -28.668 10.734 8 HB2 SER 2 HB2 SER 2 1.188 -28.385 10.648 9 HB3 SER 2 HB1 SER 2 0.015 -27.125 10.258 10 HG SER 2 HG SER 2 -0.782 -27.497 12.485 11 H HIS 3 H HIS 3 -2.715 -29.220 8.860 12 HA HIS 3 HA HIS 3 -1.284 -30.745 6.874 13 HB2 HIS 3 HB2 HIS 3 -4.073 -29.589 6.945 14 HB3 HIS 3 HB1 HIS 3 -3.435 -30.462 5.560 15 HD1 HIS 3 HD1 HIS 3 -3.938 -32.881 5.548 16 HD2 HIS 3 HD2 HIS 3 -3.985 -31.309 9.396 17 HE1 HIS 3 HE1 HIS 3 -4.677 -34.763 7.039 18 HE2 HIS 3 HE2 HIS 3 -4.819 -33.755 9.343 19 H MET 4 H MET 4 0.401 -29.251 6.416 20 HA MET 4 HA MET 4 -0.335 -26.725 5.146 21 HB2 MET 4 HB2 MET 4 2.350 -27.884 5.901 22 HB3 MET 4 HB1 MET 4 2.126 -26.317 5.140 23 HG2 MET 4 HG2 MET 4 0.881 -25.533 7.065 24 HG3 MET 4 HG1 MET 4 1.023 -27.120 7.822 25 HE1 MET 4 HE1 MET 4 2.995 -23.983 6.515 26 HE2 MET 4 HE2 MET 4 3.830 -25.319 5.721 27 HE3 MET 4 HE3 MET 4 4.649 -24.387 6.972 28 H GLY 5 H GLY 5 -0.027 -29.830 4.151 29 HA2 GLY 5 HA2 GLY 5 1.455 -29.289 1.708 30 HA3 GLY 5 HA1 GLY 5 0.777 -30.834 2.195 31 H THR 6 H THR 6 -1.865 -29.716 2.726 32 HA THR 6 HA THR 6 -2.802 -29.892 -0.013 33 HB THR 6 HB THR 6 -3.845 -31.293 1.738 34 HG1 THR 6 HG1 THR 6 -5.289 -29.469 0.179 35 HG21 THR 6 HG21 THR 6 -5.351 -30.287 3.375 36 HG22 THR 6 HG22 THR 6 -4.897 -28.677 2.817 37 HG23 THR 6 HG23 THR 6 -3.701 -29.707 3.603 38 H THR 7 H THR 7 -1.996 -27.390 2.041 39 HA THR 7 HA THR 7 -3.345 -25.479 0.379 40 HB THR 7 HB THR 7 -5.138 -26.013 1.975 41 HG1 THR 7 HG1 THR 7 -4.223 -23.454 2.739 42 HG21 THR 7 HG21 THR 7 -3.187 -25.072 4.076 43 HG22 THR 7 HG22 THR 7 -3.827 -26.705 3.893 44 HG23 THR 7 HG23 THR 7 -4.901 -25.382 4.348 45 H THR 8 H THR 8 -2.447 -23.447 0.489 46 HA THR 8 HA THR 8 -0.091 -23.180 2.239 47 HB THR 8 HB THR 8 -0.445 -21.962 -0.509 48 HG1 THR 8 HG1 THR 8 1.254 -24.146 0.171 49 HG21 THR 8 HG21 THR 8 1.988 -22.226 1.265 50 HG22 THR 8 HG22 THR 8 1.083 -20.741 0.972 51 HG23 THR 8 HG23 THR 8 1.956 -21.516 -0.351 52 H ALA 9 H ALA 9 -0.144 -21.484 3.598 53 HA ALA 9 HA ALA 9 -2.148 -19.388 3.148 54 HB1 ALA 9 HB1 ALA 9 -1.807 -18.798 5.495 55 HB2 ALA 9 HB2 ALA 9 -0.543 -20.021 5.626 56 HB3 ALA 9 HB3 ALA 9 -2.211 -20.507 5.327 57 HA PRO 10 HA PRO 10 1.447 -17.093 1.779 58 HB2 PRO 10 HB2 PRO 10 0.093 -15.031 0.650 59 HB3 PRO 10 HB1 PRO 10 0.317 -16.592 -0.142 60 HG2 PRO 10 HG2 PRO 10 -2.080 -15.469 1.210 61 HG3 PRO 10 HG1 PRO 10 -1.979 -16.575 -0.170 62 HD2 PRO 10 HD2 PRO 10 -2.549 -17.323 2.438 63 HD3 PRO 10 HD1 PRO 10 -2.013 -18.396 1.184 64 H ASP 11 H ASP 11 2.653 -15.636 2.788 65 HA ASP 11 HA ASP 11 1.519 -14.105 4.986 66 HB2 ASP 11 HB2 ASP 11 4.331 -14.647 4.035 67 HB3 ASP 11 HB1 ASP 11 3.998 -13.421 5.251 68 H ALA 12 H ALA 12 2.051 -11.812 5.216 69 HA ALA 12 HA ALA 12 1.996 -10.381 2.653 70 HB1 ALA 12 HB1 ALA 12 1.380 -8.440 4.012 71 HB2 ALA 12 HB2 ALA 12 1.593 -9.389 5.482 72 HB3 ALA 12 HB3 ALA 12 0.311 -9.804 4.343 73 HA PRO 13 HA PRO 13 6.192 -8.865 3.171 74 HB2 PRO 13 HB2 PRO 13 5.288 -6.148 2.494 75 HB3 PRO 13 HB1 PRO 13 6.401 -7.205 1.619 76 HG2 PRO 13 HG2 PRO 13 3.962 -6.672 0.668 77 HG3 PRO 13 HG1 PRO 13 4.692 -8.278 0.485 78 HD2 PRO 13 HD2 PRO 13 2.674 -7.334 2.482 79 HD3 PRO 13 HD1 PRO 13 2.677 -8.834 1.522 80 HA PRO 14 HA PRO 14 6.139 -7.153 7.353 81 HB2 PRO 14 HB2 PRO 14 8.994 -6.739 6.621 82 HB3 PRO 14 HB1 PRO 14 8.310 -7.494 8.063 83 HG2 PRO 14 HG2 PRO 14 9.426 -8.956 6.115 84 HG3 PRO 14 HG1 PRO 14 8.018 -9.533 7.023 85 HD2 PRO 14 HD2 PRO 14 8.179 -8.481 4.246 86 HD3 PRO 14 HD1 PRO 14 7.081 -9.691 4.938 87 H ASP 15 H ASP 15 6.215 -5.118 8.178 88 HA ASP 15 HA ASP 15 4.948 -3.295 6.719 89 HB2 ASP 15 HB2 ASP 15 6.883 -2.718 8.956 90 HB3 ASP 15 HB1 ASP 15 5.728 -1.550 8.328 91 HA PRO 16 HA PRO 16 7.979 -1.867 3.606 92 HB2 PRO 16 HB2 PRO 16 5.873 -0.235 2.678 93 HB3 PRO 16 HB1 PRO 16 6.426 -1.746 1.954 94 HG2 PRO 16 HG2 PRO 16 4.192 -1.223 3.861 95 HG3 PRO 16 HG1 PRO 16 4.283 -2.386 2.522 96 HD2 PRO 16 HD2 PRO 16 4.503 -3.289 5.008 97 HD3 PRO 16 HD1 PRO 16 5.628 -3.848 3.740 98 H THR 17 H THR 17 9.049 0.001 3.478 99 HA THR 17 HA THR 17 8.429 2.044 5.507 100 HB THR 17 HB THR 17 10.990 1.679 3.937 101 HG1 THR 17 HG1 THR 17 11.745 0.700 5.928 102 HG21 THR 17 HG21 THR 17 11.964 3.030 5.757 103 HG22 THR 17 HG22 THR 17 10.360 3.211 6.463 104 HG23 THR 17 HG23 THR 17 10.709 3.906 4.881 105 H VAL 18 H VAL 18 7.769 3.920 4.979 106 HA VAL 18 HA VAL 18 7.449 4.740 2.243 107 HB VAL 18 HB VAL 18 7.104 6.308 4.804 108 HG11 VAL 18 HG11 VAL 18 5.904 7.953 3.371 109 HG12 VAL 18 HG12 VAL 18 6.484 7.082 1.940 110 HG13 VAL 18 HG13 VAL 18 7.632 7.856 3.040 111 HG21 VAL 18 HG21 VAL 18 4.764 5.983 4.514 112 HG22 VAL 18 HG22 VAL 18 5.525 4.395 4.373 113 HG23 VAL 18 HG23 VAL 18 4.999 5.258 2.928 114 H ASP 19 H ASP 19 9.025 5.405 1.033 115 HA ASP 19 HA ASP 19 11.592 6.095 2.207 116 HB2 ASP 19 HB2 ASP 19 11.209 4.469 0.263 117 HB3 ASP 19 HB1 ASP 19 10.925 5.894 -0.729 118 H GLN 20 H GLN 20 9.045 7.555 0.302 119 HA GLN 20 HA GLN 20 10.340 10.176 0.572 120 HB2 GLN 20 HB2 GLN 20 9.029 9.151 -1.952 121 HB3 GLN 20 HB1 GLN 20 9.678 10.764 -1.714 122 HG2 GLN 20 HG2 GLN 20 11.922 9.841 -1.500 123 HG3 GLN 20 HG1 GLN 20 11.276 8.213 -1.714 124 HE21 GLN 20 HE21 GLN 20 12.465 7.840 -3.571 125 HE22 GLN 20 HE22 GLN 20 12.119 8.601 -5.059 126 H VAL 21 H VAL 21 8.981 11.843 0.923 127 HA VAL 21 HA VAL 21 6.098 11.275 0.919 128 HB VAL 21 HB VAL 21 7.545 12.650 3.188 129 HG11 VAL 21 HG11 VAL 21 5.275 13.480 2.756 130 HG12 VAL 21 HG12 VAL 21 5.417 12.664 4.315 131 HG13 VAL 21 HG13 VAL 21 4.657 11.840 2.953 132 HG21 VAL 21 HG21 VAL 21 8.003 10.261 3.215 133 HG22 VAL 21 HG22 VAL 21 6.276 9.913 3.110 134 HG23 VAL 21 HG23 VAL 21 6.932 10.704 4.543 135 H ASP 22 H ASP 22 4.810 12.980 0.325 136 HA ASP 22 HA ASP 22 5.946 15.657 0.077 137 HB2 ASP 22 HB2 ASP 22 6.356 14.304 -2.070 138 HB3 ASP 22 HB1 ASP 22 4.615 14.318 -2.294 139 H ASP 23 H ASP 23 3.729 16.618 -1.537 140 HA ASP 23 HA ASP 23 1.698 16.763 0.517 141 HB2 ASP 23 HB2 ASP 23 1.633 17.881 -2.291 142 HB3 ASP 23 HB1 ASP 23 0.514 18.277 -1.016 143 H THR 24 H THR 24 1.441 16.082 -2.945 144 HA THR 24 HA THR 24 -0.893 14.369 -2.406 145 HB THR 24 HB THR 24 -1.448 14.798 -4.786 146 HG1 THR 24 HG1 THR 24 -0.094 15.875 -6.054 147 HG21 THR 24 HG21 THR 24 -0.919 17.309 -3.189 148 HG22 THR 24 HG22 THR 24 -2.319 16.253 -2.993 149 HG23 THR 24 HG23 THR 24 -2.082 17.137 -4.503 150 H SER 25 H SER 25 1.697 13.289 -2.013 151 HA SER 25 HA SER 25 1.853 11.073 -3.760 152 HB2 SER 25 HB2 SER 25 4.076 13.115 -4.081 153 HB3 SER 25 HB1 SER 25 4.005 11.525 -4.839 154 HG SER 25 HG SER 25 1.757 12.907 -5.382 155 H ILE 26 H ILE 26 2.985 9.462 -2.801 156 HA ILE 26 HA ILE 26 5.103 9.997 -0.866 157 HB ILE 26 HB ILE 26 2.465 8.768 -0.045 158 HG12 ILE 26 HG12 ILE 26 4.240 10.826 1.267 159 HG13 ILE 26 HG11 ILE 26 2.749 11.156 0.397 160 HG21 ILE 26 HG21 ILE 26 4.216 7.173 0.566 161 HG22 ILE 26 HG22 ILE 26 3.481 7.921 1.984 162 HG23 ILE 26 HG23 ILE 26 5.068 8.456 1.430 163 HD11 ILE 26 HD11 ILE 26 2.368 11.230 2.775 164 HD12 ILE 26 HD12 ILE 26 3.015 9.598 2.955 165 HD13 ILE 26 HD13 ILE 26 1.512 9.859 2.071 166 H VAL 27 H VAL 27 6.394 7.982 -0.490 167 HA VAL 27 HA VAL 27 5.674 5.930 -2.501 168 HB VAL 27 HB VAL 27 8.467 6.831 -1.807 169 HG11 VAL 27 HG11 VAL 27 7.905 4.398 -2.556 170 HG12 VAL 27 HG12 VAL 27 9.261 5.248 -3.307 171 HG13 VAL 27 HG13 VAL 27 7.717 5.129 -4.153 172 HG21 VAL 27 HG21 VAL 27 8.545 7.789 -4.055 173 HG22 VAL 27 HG22 VAL 27 7.282 8.542 -3.081 174 HG23 VAL 27 HG23 VAL 27 6.856 7.346 -4.304 175 H VAL 28 H VAL 28 5.836 3.806 -1.822 176 HA VAL 28 HA VAL 28 7.107 3.401 0.788 177 HB VAL 28 HB VAL 28 5.359 2.369 1.748 178 HG11 VAL 28 HG11 VAL 28 3.298 3.439 1.380 179 HG12 VAL 28 HG12 VAL 28 3.780 3.904 -0.251 180 HG13 VAL 28 HG13 VAL 28 4.599 4.599 1.145 181 HG21 VAL 28 HG21 VAL 28 4.218 1.557 -0.884 182 HG22 VAL 28 HG22 VAL 28 3.683 1.025 0.710 183 HG23 VAL 28 HG23 VAL 28 5.284 0.565 0.113 184 H ARG 29 H ARG 29 7.938 1.316 1.167 185 HA ARG 29 HA ARG 29 8.322 -0.354 -1.240 186 HB2 ARG 29 HB2 ARG 29 10.573 0.389 0.634 187 HB3 ARG 29 HB1 ARG 29 10.691 -0.412 -0.927 188 HG2 ARG 29 HG2 ARG 29 10.130 1.610 -2.079 189 HG3 ARG 29 HG1 ARG 29 9.751 2.427 -0.564 190 HD2 ARG 29 HD2 ARG 29 11.916 3.140 -1.335 191 HD3 ARG 29 HD1 ARG 29 12.107 2.169 0.122 192 HE ARG 29 HE ARG 29 12.371 0.460 -2.056 193 HH11 ARG 29 HH11 ARG 29 14.039 3.226 -0.678 194 HH12 ARG 29 HH12 ARG 29 15.590 2.738 -1.285 195 HH21 ARG 29 HH21 ARG 29 14.413 -0.169 -2.855 196 HH22 ARG 29 HH22 ARG 29 15.803 0.816 -2.525 197 H TRP 30 H TRP 30 7.935 -2.390 -0.832 198 HA TRP 30 HA TRP 30 7.828 -3.271 1.991 199 HB2 TRP 30 HB2 TRP 30 6.046 -4.884 1.236 200 HB3 TRP 30 HB1 TRP 30 5.584 -3.195 1.087 201 HD1 TRP 30 HD1 TRP 30 6.573 -6.181 -1.077 202 HE1 TRP 30 HE1 TRP 30 5.740 -5.768 -3.472 203 HE3 TRP 30 HE3 TRP 30 4.855 -1.446 -0.472 204 HZ2 TRP 30 HZ2 TRP 30 4.450 -3.701 -4.891 205 HZ3 TRP 30 HZ3 TRP 30 3.803 -0.329 -2.385 206 HH2 TRP 30 HH2 TRP 30 3.600 -1.419 -4.534 207 H SER 31 H SER 31 8.607 -5.268 2.565 208 HA SER 31 HA SER 31 10.318 -6.612 0.645 209 HB2 SER 31 HB2 SER 31 11.147 -6.242 2.949 210 HB3 SER 31 HB1 SER 31 9.823 -7.225 3.575 211 HG SER 31 HG SER 31 10.916 -8.952 3.104 212 H ARG 32 H ARG 32 8.973 -7.575 -0.763 213 HA ARG 32 HA ARG 32 6.523 -8.743 -0.358 214 HB2 ARG 32 HB2 ARG 32 7.156 -10.102 -2.469 215 HB3 ARG 32 HB1 ARG 32 7.095 -8.347 -2.576 216 HG2 ARG 32 HG2 ARG 32 9.691 -9.434 -1.819 217 HG3 ARG 32 HG1 ARG 32 9.153 -9.881 -3.437 218 HD2 ARG 32 HD2 ARG 32 8.900 -7.572 -4.039 219 HD3 ARG 32 HD1 ARG 32 9.223 -7.050 -2.381 220 HE ARG 32 HE ARG 32 11.501 -8.045 -2.731 221 HH11 ARG 32 HH11 ARG 32 9.606 -6.882 -5.435 222 HH12 ARG 32 HH12 ARG 32 10.988 -6.554 -6.428 223 HH21 ARG 32 HH21 ARG 32 13.323 -7.612 -4.039 224 HH22 ARG 32 HH22 ARG 32 13.097 -6.974 -5.637 225 HA PRO 33 HA PRO 33 7.075 -12.549 1.724 226 HB2 PRO 33 HB2 PRO 33 4.887 -13.821 0.347 227 HB3 PRO 33 HB1 PRO 33 4.876 -13.071 1.946 228 HG2 PRO 33 HG2 PRO 33 3.528 -12.110 -0.259 229 HG3 PRO 33 HG1 PRO 33 4.010 -11.126 1.142 230 HD2 PRO 33 HD2 PRO 33 5.285 -11.383 -1.534 231 HD3 PRO 33 HD1 PRO 33 5.108 -9.955 -0.506 232 H GLN 34 H GLN 34 7.535 -14.786 1.563 233 HA GLN 34 HA GLN 34 8.696 -15.650 -0.942 234 HB2 GLN 34 HB2 GLN 34 8.355 -17.168 1.646 235 HB3 GLN 34 HB1 GLN 34 9.366 -17.627 0.285 236 HG2 GLN 34 HG2 GLN 34 10.770 -15.678 0.641 237 HG3 GLN 34 HG1 GLN 34 9.745 -15.175 1.984 238 HE21 GLN 34 HE21 GLN 34 11.428 -15.263 3.456 239 HE22 GLN 34 HE22 GLN 34 12.091 -16.761 4.013 240 H ALA 35 H ALA 35 5.686 -15.628 0.456 241 HA ALA 35 HA ALA 35 4.473 -18.011 -0.350 242 HB1 ALA 35 HB1 ALA 35 2.408 -16.853 -0.122 243 HB2 ALA 35 HB2 ALA 35 3.178 -15.292 -0.415 244 HB3 ALA 35 HB3 ALA 35 3.499 -16.166 1.086 245 HA PRO 36 HA PRO 36 4.113 -17.380 -4.798 246 HB2 PRO 36 HB2 PRO 36 1.604 -18.885 -4.701 247 HB3 PRO 36 HB1 PRO 36 3.118 -19.306 -5.503 248 HG2 PRO 36 HG2 PRO 36 2.203 -20.619 -3.315 249 HG3 PRO 36 HG1 PRO 36 3.929 -20.430 -3.674 250 HD2 PRO 36 HD2 PRO 36 2.220 -18.936 -1.725 251 HD3 PRO 36 HD1 PRO 36 3.903 -19.486 -1.565 252 H ILE 37 H ILE 37 3.489 -15.382 -5.293 253 HA ILE 37 HA ILE 37 0.689 -14.620 -4.823 254 HB ILE 37 HB ILE 37 1.463 -12.285 -4.478 255 HG12 ILE 37 HG12 ILE 37 4.118 -13.583 -4.891 256 HG13 ILE 37 HG11 ILE 37 3.481 -12.098 -5.571 257 HG21 ILE 37 HG21 ILE 37 2.239 -12.505 -2.195 258 HG22 ILE 37 HG22 ILE 37 2.817 -14.153 -2.515 259 HG23 ILE 37 HG23 ILE 37 1.085 -13.811 -2.527 260 HD11 ILE 37 HD11 ILE 37 4.661 -12.569 -2.879 261 HD12 ILE 37 HD12 ILE 37 3.614 -11.186 -3.183 262 HD13 ILE 37 HD13 ILE 37 5.112 -11.377 -4.100 263 H THR 38 H THR 38 -0.303 -13.526 -6.529 264 HA THR 38 HA THR 38 1.077 -13.755 -9.079 265 HB THR 38 HB THR 38 -1.216 -13.136 -10.000 266 HG1 THR 38 HG1 THR 38 -2.775 -12.812 -8.611 267 HG21 THR 38 HG21 THR 38 -0.877 -15.659 -8.410 268 HG22 THR 38 HG22 THR 38 -0.333 -15.373 -10.062 269 HG23 THR 38 HG23 THR 38 -2.054 -15.397 -9.696 270 H GLY 39 H GLY 39 -0.162 -11.238 -6.972 271 HA2 GLY 39 HA2 GLY 39 1.219 -9.261 -8.506 272 HA3 GLY 39 HA1 GLY 39 -0.526 -9.134 -8.655 273 H TYR 40 H TYR 40 -0.042 -6.987 -7.693 274 HA TYR 40 HA TYR 40 -0.471 -7.211 -4.802 275 HB2 TYR 40 HB2 TYR 40 1.648 -5.605 -6.166 276 HB3 TYR 40 HB1 TYR 40 0.824 -4.903 -4.777 277 HD1 TYR 40 HD1 TYR 40 2.104 -8.321 -5.557 278 HD2 TYR 40 HD2 TYR 40 2.098 -5.025 -2.877 279 HE1 TYR 40 HE1 TYR 40 3.615 -9.535 -4.065 280 HE2 TYR 40 HE2 TYR 40 3.576 -6.253 -1.367 281 HH TYR 40 HH TYR 40 5.145 -9.142 -2.309 282 H ARG 41 H ARG 41 -2.197 -6.100 -4.160 283 HA ARG 41 HA ARG 41 -3.074 -3.804 -5.798 284 HB2 ARG 41 HB2 ARG 41 -4.554 -4.751 -3.390 285 HB3 ARG 41 HB1 ARG 41 -5.151 -3.966 -4.849 286 HG2 ARG 41 HG2 ARG 41 -4.033 -6.752 -4.792 287 HG3 ARG 41 HG1 ARG 41 -5.755 -6.400 -4.574 288 HD2 ARG 41 HD2 ARG 41 -4.057 -5.805 -6.994 289 HD3 ARG 41 HD1 ARG 41 -5.352 -6.996 -6.876 290 HE ARG 41 HE ARG 41 -6.240 -4.321 -6.307 291 HH11 ARG 41 HH11 ARG 41 -5.610 -6.652 -8.849 292 HH12 ARG 41 HH12 ARG 41 -6.607 -5.841 -10.014 293 HH21 ARG 41 HH21 ARG 41 -7.536 -3.233 -7.849 294 HH22 ARG 41 HH22 ARG 41 -7.709 -3.910 -9.444 295 H ILE 42 H ILE 42 -3.301 -1.752 -4.796 296 HA ILE 42 HA ILE 42 -2.180 -1.589 -2.074 297 HB ILE 42 HB ILE 42 -1.292 0.210 -4.309 298 HG12 ILE 42 HG12 ILE 42 0.298 -1.974 -3.002 299 HG13 ILE 42 HG11 ILE 42 -0.594 -2.209 -4.495 300 HG21 ILE 42 HG21 ILE 42 -0.097 -0.174 -1.569 301 HG22 ILE 42 HG22 ILE 42 -1.251 1.100 -1.959 302 HG23 ILE 42 HG23 ILE 42 0.317 1.061 -2.761 303 HD11 ILE 42 HD11 ILE 42 1.677 -0.319 -4.036 304 HD12 ILE 42 HD12 ILE 42 0.739 -0.421 -5.524 305 HD13 ILE 42 HD13 ILE 42 1.700 -1.800 -4.985 306 H VAL 43 H VAL 43 -3.781 -0.756 -0.898 307 HA VAL 43 HA VAL 43 -5.296 1.474 -2.094 308 HB VAL 43 HB VAL 43 -6.148 -0.411 0.109 309 HG11 VAL 43 HG11 VAL 43 -6.934 1.808 0.595 310 HG12 VAL 43 HG12 VAL 43 -8.271 0.784 0.080 311 HG13 VAL 43 HG13 VAL 43 -7.583 1.964 -1.036 312 HG21 VAL 43 HG21 VAL 43 -7.850 -1.140 -1.430 313 HG22 VAL 43 HG22 VAL 43 -6.271 -1.306 -2.199 314 HG23 VAL 43 HG23 VAL 43 -7.322 0.046 -2.622 315 H TYR 44 H TYR 44 -4.499 3.314 -1.457 316 HA TYR 44 HA TYR 44 -3.815 3.652 1.359 317 HB2 TYR 44 HB2 TYR 44 -2.684 5.822 0.354 318 HB3 TYR 44 HB1 TYR 44 -1.849 4.276 0.350 319 HD1 TYR 44 HD2 TYR 44 -2.045 2.859 -1.788 320 HD2 TYR 44 HD1 TYR 44 -2.961 7.004 -1.646 321 HE1 TYR 44 HE2 TYR 44 -1.747 2.980 -4.211 322 HE2 TYR 44 HE1 TYR 44 -2.656 7.156 -4.077 323 HH TYR 44 HH TYR 44 -1.481 5.937 -5.865 324 H SER 45 H SER 45 -4.964 4.823 2.541 325 HA SER 45 HA SER 45 -6.905 6.676 1.345 326 HB2 SER 45 HB2 SER 45 -8.026 4.501 1.636 327 HB3 SER 45 HB1 SER 45 -7.589 4.506 3.341 328 HG SER 45 HG SER 45 -9.672 5.260 3.163 329 HA PRO 46 HA PRO 46 -5.671 9.256 4.788 330 HB2 PRO 46 HB2 PRO 46 -7.622 11.112 4.466 331 HB3 PRO 46 HB1 PRO 46 -6.198 11.024 3.424 332 HG2 PRO 46 HG2 PRO 46 -8.968 10.020 2.932 333 HG3 PRO 46 HG1 PRO 46 -7.869 10.865 1.826 334 HD2 PRO 46 HD2 PRO 46 -8.236 8.186 1.765 335 HD3 PRO 46 HD1 PRO 46 -6.697 8.955 1.332 336 H SER 47 H SER 47 -6.143 9.045 6.876 337 HA SER 47 HA SER 47 -8.419 7.590 7.759 338 HB2 SER 47 HB2 SER 47 -6.486 9.211 9.429 339 HB3 SER 47 HB1 SER 47 -7.493 7.867 9.973 340 HG SER 47 HG SER 47 -6.289 6.659 8.237 341 H VAL 48 H VAL 48 -7.882 10.898 7.153 342 HA VAL 48 HA VAL 48 -10.240 11.670 8.729 343 HB VAL 48 HB VAL 48 -9.531 14.010 8.215 344 HG11 VAL 48 HG11 VAL 48 -9.012 13.012 10.361 345 HG12 VAL 48 HG12 VAL 48 -7.674 14.033 9.837 346 HG13 VAL 48 HG13 VAL 48 -7.555 12.279 9.693 347 HG21 VAL 48 HG21 VAL 48 -7.032 12.663 7.213 348 HG22 VAL 48 HG22 VAL 48 -7.242 14.397 7.453 349 HG23 VAL 48 HG23 VAL 48 -8.196 13.553 6.232 350 H GLU 49 H GLU 49 -9.930 10.317 6.039 351 HA GLU 49 HA GLU 49 -11.098 10.147 4.122 352 HB2 GLU 49 HB2 GLU 49 -12.677 12.316 5.445 353 HB3 GLU 49 HB1 GLU 49 -12.992 11.904 3.764 354 HG2 GLU 49 HG2 GLU 49 -13.112 10.010 6.100 355 HG3 GLU 49 HG1 GLU 49 -14.492 10.712 5.251 356 H GLY 50 H GLY 50 -11.468 11.210 2.025 357 HA2 GLY 50 HA2 GLY 50 -10.754 13.491 0.950 358 HA3 GLY 50 HA1 GLY 50 -9.176 12.955 1.516 359 H SER 51 H SER 51 -8.115 12.423 -0.317 360 HA SER 51 HA SER 51 -9.498 10.862 -2.351 361 HB2 SER 51 HB2 SER 51 -8.126 12.813 -3.029 362 HB3 SER 51 HB1 SER 51 -6.687 12.018 -2.381 363 HG SER 51 HG SER 51 -6.559 11.218 -4.314 364 H SER 52 H SER 52 -9.413 8.716 -2.329 365 HA SER 52 HA SER 52 -7.027 7.399 -1.201 366 HB2 SER 52 HB2 SER 52 -8.687 5.411 -0.938 367 HB3 SER 52 HB1 SER 52 -8.794 6.744 0.215 368 HG SER 52 HG SER 52 -10.681 5.822 -1.415 369 H THR 53 H THR 53 -6.126 5.674 -2.359 370 HA THR 53 HA THR 53 -7.241 5.190 -5.033 371 HB THR 53 HB THR 53 -4.382 6.094 -4.641 372 HG1 THR 53 HG1 THR 53 -5.016 8.081 -5.183 373 HG21 THR 53 HG21 THR 53 -4.372 6.281 -7.093 374 HG22 THR 53 HG22 THR 53 -6.005 5.616 -7.141 375 HG23 THR 53 HG23 THR 53 -4.667 4.626 -6.556 376 H GLU 54 H GLU 54 -6.638 3.235 -5.951 377 HA GLU 54 HA GLU 54 -4.840 1.516 -4.416 378 HB2 GLU 54 HB2 GLU 54 -7.135 0.634 -4.477 379 HB3 GLU 54 HB1 GLU 54 -7.122 0.712 -6.234 380 HG2 GLU 54 HG2 GLU 54 -5.056 -0.824 -6.061 381 HG3 GLU 54 HG1 GLU 54 -5.620 -1.133 -4.422 382 H LEU 55 H LEU 55 -2.942 1.163 -5.406 383 HA LEU 55 HA LEU 55 -2.901 1.276 -8.338 384 HB2 LEU 55 HB2 LEU 55 -0.583 1.339 -6.371 385 HB3 LEU 55 HB1 LEU 55 -0.398 1.188 -8.117 386 HG LEU 55 HG LEU 55 -1.388 3.519 -6.536 387 HD11 LEU 55 HD11 LEU 55 0.753 3.091 -8.592 388 HD12 LEU 55 HD12 LEU 55 0.920 3.616 -6.914 389 HD13 LEU 55 HD13 LEU 55 0.202 4.694 -8.107 390 HD21 LEU 55 HD21 LEU 55 -3.070 3.252 -8.235 391 HD22 LEU 55 HD22 LEU 55 -1.835 3.049 -9.479 392 HD23 LEU 55 HD23 LEU 55 -2.025 4.605 -8.669 393 H ASN 56 H ASN 56 -1.667 -0.375 -9.485 394 HA ASN 56 HA ASN 56 -1.847 -2.983 -8.129 395 HB2 ASN 56 HB2 ASN 56 -3.644 -2.742 -9.802 396 HB3 ASN 56 HB1 ASN 56 -2.444 -2.376 -11.037 397 HD21 ASN 56 HD21 ASN 56 -3.845 -4.836 -9.049 398 HD22 ASN 56 HD22 ASN 56 -3.160 -6.190 -9.874 399 H LEU 57 H LEU 57 0.069 -3.913 -7.939 400 HA LEU 57 HA LEU 57 2.163 -3.167 -9.873 401 HB2 LEU 57 HB2 LEU 57 2.413 -3.761 -6.907 402 HB3 LEU 57 HB1 LEU 57 3.779 -3.703 -7.996 403 HG LEU 57 HG LEU 57 2.170 -1.522 -6.832 404 HD11 LEU 57 HD11 LEU 57 5.045 -1.718 -7.680 405 HD12 LEU 57 HD12 LEU 57 4.432 -2.114 -6.078 406 HD13 LEU 57 HD13 LEU 57 4.320 -0.461 -6.679 407 HD21 LEU 57 HD21 LEU 57 2.808 0.045 -8.570 408 HD22 LEU 57 HD22 LEU 57 1.721 -1.198 -9.192 409 HD23 LEU 57 HD23 LEU 57 3.448 -1.282 -9.539 410 HA PRO 58 HA PRO 58 2.548 -7.518 -10.565 411 HB2 PRO 58 HB2 PRO 58 5.235 -7.745 -11.017 412 HB3 PRO 58 HB1 PRO 58 4.087 -7.151 -12.217 413 HG2 PRO 58 HG2 PRO 58 5.966 -5.634 -10.476 414 HG3 PRO 58 HG1 PRO 58 5.458 -5.304 -12.141 415 HD2 PRO 58 HD2 PRO 58 4.481 -3.982 -9.947 416 HD3 PRO 58 HD1 PRO 58 3.588 -4.161 -11.466 417 H GLU 59 H GLU 59 3.113 -9.382 -9.464 418 HA GLU 59 HA GLU 59 3.484 -9.513 -6.781 419 HB2 GLU 59 HB2 GLU 59 4.480 -11.776 -7.137 420 HB3 GLU 59 HB1 GLU 59 3.002 -11.498 -8.051 421 HG2 GLU 59 HG2 GLU 59 4.209 -11.214 -10.072 422 HG3 GLU 59 HG1 GLU 59 5.750 -11.152 -9.218 423 H THR 60 H THR 60 5.980 -9.176 -9.178 424 HA THR 60 HA THR 60 8.129 -9.503 -7.263 425 HB THR 60 HB THR 60 8.352 -10.598 -9.415 426 HG1 THR 60 HG1 THR 60 10.255 -9.593 -8.359 427 HG21 THR 60 HG21 THR 60 8.191 -7.834 -10.608 428 HG22 THR 60 HG22 THR 60 7.013 -9.135 -10.791 429 HG23 THR 60 HG23 THR 60 8.623 -9.298 -11.490 430 H ALA 61 H ALA 61 6.230 -7.078 -7.445 431 HA ALA 61 HA ALA 61 8.197 -4.941 -7.797 432 HB1 ALA 61 HB1 ALA 61 5.271 -4.816 -7.070 433 HB2 ALA 61 HB2 ALA 61 5.963 -4.534 -8.667 434 HB3 ALA 61 HB3 ALA 61 6.314 -3.421 -7.344 435 H ASN 62 H ASN 62 8.340 -3.288 -6.008 436 HA ASN 62 HA ASN 62 7.851 -4.371 -3.354 437 HB2 ASN 62 HB2 ASN 62 10.158 -4.173 -2.624 438 HB3 ASN 62 HB1 ASN 62 10.048 -5.294 -3.976 439 HD21 ASN 62 HD21 ASN 62 12.339 -3.814 -3.000 440 HD22 ASN 62 HD22 ASN 62 12.894 -2.850 -4.323 441 H SER 63 H SER 63 7.272 -1.892 -5.154 442 HA SER 63 HA SER 63 7.187 -0.062 -2.996 443 HB2 SER 63 HB2 SER 63 8.726 1.664 -4.063 444 HB3 SER 63 HB1 SER 63 9.515 0.279 -3.314 445 HG SER 63 HG SER 63 9.003 -0.325 -5.857 446 H VAL 64 H VAL 64 5.671 1.431 -3.329 447 HA VAL 64 HA VAL 64 4.739 1.887 -6.090 448 HB VAL 64 HB VAL 64 2.965 0.691 -4.972 449 HG11 VAL 64 HG11 VAL 64 2.263 0.990 -2.869 450 HG12 VAL 64 HG12 VAL 64 2.625 2.713 -2.864 451 HG13 VAL 64 HG13 VAL 64 3.924 1.533 -2.677 452 HG21 VAL 64 HG21 VAL 64 1.168 2.214 -5.094 453 HG22 VAL 64 HG22 VAL 64 2.323 2.535 -6.383 454 HG23 VAL 64 HG23 VAL 64 2.270 3.586 -4.967 455 H THR 65 H THR 65 4.648 3.972 -6.760 456 HA THR 65 HA THR 65 4.987 6.109 -4.828 457 HB THR 65 HB THR 65 4.893 5.992 -7.829 458 HG1 THR 65 HG1 THR 65 7.144 7.019 -7.087 459 HG21 THR 65 HG21 THR 65 3.912 8.122 -7.115 460 HG22 THR 65 HG22 THR 65 5.508 8.393 -7.814 461 HG23 THR 65 HG23 THR 65 5.296 8.425 -6.064 462 H LEU 66 H LEU 66 3.138 6.405 -3.783 463 HA LEU 66 HA LEU 66 0.536 6.252 -4.978 464 HB2 LEU 66 HB2 LEU 66 0.772 7.738 -2.486 465 HB3 LEU 66 HB1 LEU 66 -0.249 6.374 -2.882 466 HG LEU 66 HG LEU 66 2.657 5.993 -2.278 467 HD11 LEU 66 HD11 LEU 66 2.219 5.751 -0.028 468 HD12 LEU 66 HD12 LEU 66 0.474 5.795 -0.266 469 HD13 LEU 66 HD13 LEU 66 1.433 7.255 -0.485 470 HD21 LEU 66 HD21 LEU 66 1.814 3.755 -1.642 471 HD22 LEU 66 HD22 LEU 66 1.523 4.147 -3.338 472 HD23 LEU 66 HD23 LEU 66 0.205 4.259 -2.172 473 H SER 67 H SER 67 -0.766 7.934 -5.571 474 HA SER 67 HA SER 67 0.364 10.626 -5.463 475 HB2 SER 67 HB2 SER 67 0.901 9.539 -7.681 476 HB3 SER 67 HB1 SER 67 -0.834 9.430 -7.978 477 HG SER 67 HG SER 67 -0.639 11.374 -8.736 478 H ASP 68 H ASP 68 -1.381 12.208 -6.254 479 HA ASP 68 HA ASP 68 -3.405 13.176 -5.939 480 HB2 ASP 68 HB2 ASP 68 -4.401 10.324 -6.116 481 HB3 ASP 68 HB1 ASP 68 -5.449 11.735 -6.062 482 H LEU 69 H LEU 69 -1.771 12.454 -3.665 483 HA LEU 69 HA LEU 69 -3.684 11.800 -1.579 484 HB2 LEU 69 HB2 LEU 69 -1.010 12.995 -0.958 485 HB3 LEU 69 HB1 LEU 69 -1.959 11.835 -0.052 486 HG LEU 69 HG LEU 69 -0.366 11.217 -2.525 487 HD11 LEU 69 HD11 LEU 69 1.045 9.995 -0.984 488 HD12 LEU 69 HD12 LEU 69 0.033 10.497 0.372 489 HD13 LEU 69 HD13 LEU 69 0.964 11.696 -0.525 490 HD21 LEU 69 HD21 LEU 69 -2.232 9.679 -0.760 491 HD22 LEU 69 HD22 LEU 69 -0.928 8.849 -1.617 492 HD23 LEU 69 HD23 LEU 69 -2.175 9.715 -2.526 493 H GLN 70 H GLN 70 -3.395 13.440 0.418 494 HA GLN 70 HA GLN 70 -3.629 16.177 -0.631 495 HB2 GLN 70 HB2 GLN 70 -5.128 14.959 1.693 496 HB3 GLN 70 HB1 GLN 70 -5.209 16.642 1.191 497 HG2 GLN 70 HG2 GLN 70 -5.973 14.363 -0.599 498 HG3 GLN 70 HG1 GLN 70 -7.105 15.181 0.474 499 HE21 GLN 70 HE21 GLN 70 -8.348 15.895 -1.281 500 HE22 GLN 70 HE22 GLN 70 -7.814 17.171 -2.319 501 HA PRO 71 HA PRO 71 -0.192 16.943 2.079 502 HB2 PRO 71 HB2 PRO 71 -0.345 19.656 2.099 503 HB3 PRO 71 HB1 PRO 71 0.349 18.713 0.771 504 HG2 PRO 71 HG2 PRO 71 -2.373 19.941 1.013 505 HG3 PRO 71 HG1 PRO 71 -1.289 19.887 -0.390 506 HD2 PRO 71 HD2 PRO 71 -3.395 18.216 -0.120 507 HD3 PRO 71 HD1 PRO 71 -1.894 17.731 -0.933 508 H GLY 72 H GLY 72 -0.136 16.801 4.233 509 HA2 GLY 72 HA2 GLY 72 -0.536 17.400 6.446 510 HA3 GLY 72 HA1 GLY 72 -1.751 18.544 5.893 511 H VAL 73 H VAL 73 -1.608 15.149 5.027 512 HA VAL 73 HA VAL 73 -3.990 14.641 6.664 513 HB VAL 73 HB VAL 73 -3.763 14.089 3.691 514 HG11 VAL 73 HG11 VAL 73 -6.156 13.284 4.076 515 HG12 VAL 73 HG12 VAL 73 -5.646 13.034 5.750 516 HG13 VAL 73 HG13 VAL 73 -4.828 12.177 4.442 517 HG21 VAL 73 HG21 VAL 73 -4.568 16.241 3.882 518 HG22 VAL 73 HG22 VAL 73 -5.446 15.881 5.370 519 HG23 VAL 73 HG23 VAL 73 -6.039 15.257 3.828 520 H GLN 74 H GLN 74 -4.190 12.606 7.452 521 HA GLN 74 HA GLN 74 -1.820 10.996 7.543 522 HB2 GLN 74 HB2 GLN 74 -3.772 11.563 9.298 523 HB3 GLN 74 HB1 GLN 74 -4.397 10.047 8.668 524 HG2 GLN 74 HG2 GLN 74 -1.666 10.407 9.865 525 HG3 GLN 74 HG1 GLN 74 -3.062 9.768 10.715 526 HE21 GLN 74 HE21 GLN 74 -0.639 9.185 8.303 527 HE22 GLN 74 HE22 GLN 74 -0.915 7.485 8.163 528 H TYR 75 H TYR 75 -1.369 9.442 6.112 529 HA TYR 75 HA TYR 75 -3.630 8.231 4.667 530 HB2 TYR 75 HB2 TYR 75 -0.980 9.179 3.751 531 HB3 TYR 75 HB1 TYR 75 -1.583 7.693 3.019 532 HD1 TYR 75 HD1 TYR 75 -2.406 11.260 3.618 533 HD2 TYR 75 HD2 TYR 75 -3.262 7.743 1.387 534 HE1 TYR 75 HE1 TYR 75 -3.843 12.568 2.112 535 HE2 TYR 75 HE2 TYR 75 -4.698 9.041 -0.123 536 HH TYR 75 HH TYR 75 -5.866 11.037 -0.274 537 H ASN 76 H ASN 76 -4.034 6.227 5.173 538 HA ASN 76 HA ASN 76 -1.956 4.441 6.143 539 HB2 ASN 76 HB2 ASN 76 -4.913 4.052 5.635 540 HB3 ASN 76 HB1 ASN 76 -3.849 2.745 6.129 541 HD21 ASN 76 HD21 ASN 76 -3.575 6.030 7.296 542 HD22 ASN 76 HD22 ASN 76 -4.063 5.697 8.918 543 H ILE 77 H ILE 77 -0.626 3.603 4.648 544 HA ILE 77 HA ILE 77 -1.666 2.920 2.006 545 HB ILE 77 HB ILE 77 1.139 2.682 3.101 546 HG12 ILE 77 HG12 ILE 77 1.470 4.372 1.165 547 HG13 ILE 77 HG11 ILE 77 -0.220 4.723 1.402 548 HG21 ILE 77 HG21 ILE 77 1.589 2.498 0.542 549 HG22 ILE 77 HG22 ILE 77 -0.050 1.840 0.513 550 HG23 ILE 77 HG23 ILE 77 1.200 1.053 1.487 551 HD11 ILE 77 HD11 ILE 77 1.173 6.286 2.614 552 HD12 ILE 77 HD12 ILE 77 1.929 4.953 3.490 553 HD13 ILE 77 HD13 ILE 77 0.217 5.307 3.730 554 H THR 78 H THR 78 -2.591 1.073 1.742 555 HA THR 78 HA THR 78 -1.872 -1.140 3.503 556 HB THR 78 HB THR 78 -4.315 -0.781 1.789 557 HG1 THR 78 HG1 THR 78 -4.065 0.831 3.474 558 HG21 THR 78 HG21 THR 78 -3.855 -3.105 2.428 559 HG22 THR 78 HG22 THR 78 -5.280 -2.500 3.273 560 HG23 THR 78 HG23 THR 78 -3.738 -2.622 4.120 561 H ILE 79 H ILE 79 -0.481 -2.544 2.574 562 HA ILE 79 HA ILE 79 -0.510 -2.851 -0.355 563 HB ILE 79 HB ILE 79 1.419 -4.288 1.471 564 HG12 ILE 79 HG12 ILE 79 1.994 -2.042 1.968 565 HG13 ILE 79 HG11 ILE 79 3.121 -2.597 0.730 566 HG21 ILE 79 HG21 ILE 79 1.427 -5.203 -0.674 567 HG22 ILE 79 HG22 ILE 79 2.829 -4.123 -0.602 568 HG23 ILE 79 HG23 ILE 79 1.360 -3.610 -1.433 569 HD11 ILE 79 HD11 ILE 79 2.253 -1.241 -0.880 570 HD12 ILE 79 HD12 ILE 79 2.089 -0.246 0.583 571 HD13 ILE 79 HD13 ILE 79 0.687 -1.091 -0.070 572 H TYR 80 H TYR 80 -1.179 -4.661 -1.344 573 HA TYR 80 HA TYR 80 -2.060 -6.927 0.331 574 HB2 TYR 80 HB2 TYR 80 -3.273 -5.931 -2.264 575 HB3 TYR 80 HB1 TYR 80 -3.830 -7.312 -1.335 576 HD1 TYR 80 HD2 TYR 80 -3.700 -3.617 -1.478 577 HD2 TYR 80 HD1 TYR 80 -5.199 -7.032 0.597 578 HE1 TYR 80 HE2 TYR 80 -5.312 -2.196 -0.290 579 HE2 TYR 80 HE1 TYR 80 -6.814 -5.609 1.779 580 HH TYR 80 HH TYR 80 -7.238 -3.389 2.356 581 H ALA 81 H ALA 81 -0.541 -8.488 -0.030 582 HA ALA 81 HA ALA 81 0.565 -8.962 -2.662 583 HB1 ALA 81 HB1 ALA 81 0.754 -10.520 -0.064 584 HB2 ALA 81 HB2 ALA 81 2.000 -9.529 -0.821 585 HB3 ALA 81 HB3 ALA 81 1.510 -11.054 -1.576 586 H VAL 82 H VAL 82 -0.727 -9.781 -4.199 587 HA VAL 82 HA VAL 82 -3.015 -11.403 -3.251 588 HB VAL 82 HB VAL 82 -3.742 -9.473 -4.548 589 HG11 VAL 82 HG11 VAL 82 -2.164 -10.617 -6.822 590 HG12 VAL 82 HG12 VAL 82 -1.801 -9.130 -5.944 591 HG13 VAL 82 HG13 VAL 82 -3.271 -9.247 -6.912 592 HG21 VAL 82 HG21 VAL 82 -5.037 -11.556 -4.695 593 HG22 VAL 82 HG22 VAL 82 -4.099 -12.010 -6.125 594 HG23 VAL 82 HG23 VAL 82 -5.150 -10.590 -6.168 595 H GLU 83 H GLU 83 -3.399 -13.410 -3.941 596 HA GLU 83 HA GLU 83 -1.316 -14.688 -5.581 597 HB2 GLU 83 HB2 GLU 83 -1.398 -15.430 -3.278 598 HB3 GLU 83 HB1 GLU 83 -3.098 -15.842 -3.435 599 HG2 GLU 83 HG2 GLU 83 -1.927 -17.250 -5.469 600 HG3 GLU 83 HG1 GLU 83 -0.712 -17.314 -4.203 601 H GLU 84 H GLU 84 -2.165 -16.604 -6.826 602 HA GLU 84 HA GLU 84 -4.045 -16.138 -8.685 603 HB2 GLU 84 HB2 GLU 84 -3.629 -18.845 -7.411 604 HB3 GLU 84 HB1 GLU 84 -4.219 -18.531 -9.036 605 HG2 GLU 84 HG2 GLU 84 -2.066 -17.575 -9.645 606 HG3 GLU 84 HG1 GLU 84 -1.474 -17.858 -8.010 607 H ASN 85 H ASN 85 -4.725 -17.813 -5.589 608 HA ASN 85 HA ASN 85 -7.589 -17.316 -6.105 609 HB2 ASN 85 HB2 ASN 85 -6.323 -19.786 -4.902 610 HB3 ASN 85 HB1 ASN 85 -8.054 -19.484 -4.966 611 HD21 ASN 85 HD21 ASN 85 -6.404 -21.616 -6.147 612 HD22 ASN 85 HD22 ASN 85 -6.750 -21.583 -7.841 613 H GLN 86 H GLN 86 -5.251 -16.200 -4.219 614 HA GLN 86 HA GLN 86 -7.011 -15.995 -1.883 615 HB2 GLN 86 HB2 GLN 86 -4.088 -16.739 -1.693 616 HB3 GLN 86 HB1 GLN 86 -5.155 -16.414 -0.337 617 HG2 GLN 86 HG2 GLN 86 -6.547 -18.350 -1.079 618 HG3 GLN 86 HG1 GLN 86 -5.291 -18.716 -2.260 619 HE21 GLN 86 HE21 GLN 86 -3.230 -19.344 -1.516 620 HE22 GLN 86 HE22 GLN 86 -3.031 -20.018 0.067 621 H GLU 87 H GLU 87 -6.061 -14.412 -0.260 622 HA GLU 87 HA GLU 87 -4.322 -12.385 -1.470 623 HB2 GLU 87 HB2 GLU 87 -6.881 -11.817 0.046 624 HB3 GLU 87 HB1 GLU 87 -5.687 -10.603 -0.371 625 HG2 GLU 87 HG2 GLU 87 -6.090 -11.106 -2.766 626 HG3 GLU 87 HG1 GLU 87 -7.382 -12.202 -2.273 627 H SER 88 H SER 88 -2.610 -12.107 -0.179 628 HA SER 88 HA SER 88 -2.392 -13.265 2.380 629 HB2 SER 88 HB2 SER 88 -0.719 -11.056 1.169 630 HB3 SER 88 HB1 SER 88 -0.257 -12.082 2.525 631 HG SER 88 HG SER 88 0.644 -13.113 0.881 632 H THR 89 H THR 89 -1.754 -11.982 4.359 633 HA THR 89 HA THR 89 -3.772 -10.293 5.240 634 HB THR 89 HB THR 89 -1.878 -9.577 6.937 635 HG1 THR 89 HG1 THR 89 -0.019 -10.426 6.416 636 HG21 THR 89 HG21 THR 89 -2.936 -12.397 6.771 637 HG22 THR 89 HG22 THR 89 -3.760 -11.021 7.497 638 HG23 THR 89 HG23 THR 89 -2.271 -11.633 8.213 639 HA PRO 90 HA PRO 90 -2.642 -6.424 3.497 640 HB2 PRO 90 HB2 PRO 90 -4.010 -4.732 5.067 641 HB3 PRO 90 HB1 PRO 90 -4.826 -5.872 3.992 642 HG2 PRO 90 HG2 PRO 90 -4.406 -6.019 6.942 643 HG3 PRO 90 HG1 PRO 90 -5.806 -6.519 5.979 644 HD2 PRO 90 HD2 PRO 90 -3.832 -8.207 6.947 645 HD3 PRO 90 HD1 PRO 90 -4.952 -8.579 5.624 646 H VAL 91 H VAL 91 -0.930 -5.159 3.588 647 HA VAL 91 HA VAL 91 0.581 -4.600 5.999 648 HB VAL 91 HB VAL 91 0.725 -3.520 3.197 649 HG11 VAL 91 HG11 VAL 91 2.872 -2.556 3.923 650 HG12 VAL 91 HG12 VAL 91 2.509 -3.052 5.574 651 HG13 VAL 91 HG13 VAL 91 1.488 -1.864 4.763 652 HG21 VAL 91 HG21 VAL 91 2.587 -5.409 4.616 653 HG22 VAL 91 HG22 VAL 91 2.731 -4.815 2.959 654 HG23 VAL 91 HG23 VAL 91 1.390 -5.875 3.404 655 H VAL 92 H VAL 92 -0.214 -2.998 7.381 656 HA VAL 92 HA VAL 92 -1.366 -0.661 6.003 657 HB VAL 92 HB VAL 92 -1.875 -1.311 8.902 658 HG11 VAL 92 HG11 VAL 92 -3.229 0.496 6.903 659 HG12 VAL 92 HG12 VAL 92 -2.227 0.996 8.269 660 HG13 VAL 92 HG13 VAL 92 -3.785 0.220 8.556 661 HG21 VAL 92 HG21 VAL 92 -2.745 -3.163 7.558 662 HG22 VAL 92 HG22 VAL 92 -3.615 -2.019 6.536 663 HG23 VAL 92 HG23 VAL 92 -4.057 -2.197 8.234 664 H ILE 93 H ILE 93 0.264 0.697 5.763 665 HA ILE 93 HA ILE 93 1.813 1.401 8.168 666 HB ILE 93 HB ILE 93 3.535 2.320 6.498 667 HG12 ILE 93 HG12 ILE 93 2.333 0.345 4.592 668 HG13 ILE 93 HG11 ILE 93 1.859 2.024 4.573 669 HG21 ILE 93 HG21 ILE 93 4.605 0.131 6.239 670 HG22 ILE 93 HG22 ILE 93 3.088 -0.658 6.673 671 HG23 ILE 93 HG23 ILE 93 3.931 0.344 7.855 672 HD11 ILE 93 HD11 ILE 93 4.622 0.949 4.168 673 HD12 ILE 93 HD12 ILE 93 4.206 2.665 4.258 674 HD13 ILE 93 HD13 ILE 93 3.568 1.658 2.939 675 H GLN 94 H GLN 94 1.128 3.263 8.977 676 HA GLN 94 HA GLN 94 -0.224 5.108 7.152 677 HB2 GLN 94 HB2 GLN 94 -1.379 6.000 9.074 678 HB3 GLN 94 HB1 GLN 94 -1.537 4.252 9.050 679 HG2 GLN 94 HG2 GLN 94 0.253 4.089 10.736 680 HG3 GLN 94 HG1 GLN 94 0.312 5.849 10.806 681 HE21 GLN 94 HE21 GLN 94 -0.268 5.906 12.965 682 HE22 GLN 94 HE22 GLN 94 -1.864 5.533 13.510 683 H GLN 95 H GLN 95 0.588 6.985 6.658 684 HA GLN 95 HA GLN 95 2.597 8.247 8.374 685 HB2 GLN 95 HB2 GLN 95 3.524 6.765 6.443 686 HB3 GLN 95 HB1 GLN 95 2.983 8.053 5.400 687 HG2 GLN 95 HG2 GLN 95 4.908 8.429 7.675 688 HG3 GLN 95 HG1 GLN 95 5.402 8.087 6.024 689 HE21 GLN 95 HE21 GLN 95 3.274 9.801 4.888 690 HE22 GLN 95 HE22 GLN 95 3.795 11.417 5.173 691 H GLU 96 H GLU 96 2.289 10.450 8.500 692 HA GLU 96 HA GLU 96 0.053 11.569 7.019 693 HB2 GLU 96 HB2 GLU 96 1.804 12.731 9.187 694 HB3 GLU 96 HB1 GLU 96 0.529 13.634 8.380 695 HG2 GLU 96 HG2 GLU 96 -1.078 11.917 9.129 696 HG3 GLU 96 HG1 GLU 96 0.214 11.174 10.072 697 H THR 97 H THR 97 0.197 12.759 5.266 698 HA THR 97 HA THR 97 2.565 13.104 3.846 699 HB THR 97 HB THR 97 1.254 14.775 2.489 700 HG1 THR 97 HG1 THR 97 -1.085 14.731 3.124 701 HG21 THR 97 HG21 THR 97 -0.355 13.144 1.634 702 HG22 THR 97 HG22 THR 97 -0.164 12.175 3.096 703 HG23 THR 97 HG23 THR 97 1.189 12.364 1.981 704 H THR 98 H THR 98 4.211 14.376 4.200 705 HA THR 98 HA THR 98 4.297 16.328 6.240 706 HB THR 98 HB THR 98 6.239 15.952 3.947 707 HG1 THR 98 HG1 THR 98 6.017 14.595 6.454 708 HG21 THR 98 HG21 THR 98 6.584 17.990 5.292 709 HG22 THR 98 HG22 THR 98 7.900 16.836 5.508 710 HG23 THR 98 HG23 THR 98 6.663 17.006 6.753 711 H GLY 99 H GLY 99 3.759 16.351 2.824 712 HA2 GLY 99 HA2 GLY 99 2.666 18.039 1.635 713 HA3 GLY 99 HA1 GLY 99 2.967 19.139 2.963 714 H THR 100 H THR 100 3.966 20.772 1.960 715 HA THR 100 HA THR 100 6.066 20.270 0.053 716 HB THR 100 HB THR 100 5.194 22.915 1.209 717 HG1 THR 100 HG1 THR 100 3.837 21.188 -0.357 718 HG21 THR 100 HG21 THR 100 7.305 22.974 0.033 719 HG22 THR 100 HG22 THR 100 6.052 23.808 -0.881 720 HG23 THR 100 HG23 THR 100 6.567 22.192 -1.363 721 HA PRO 101 HA PRO 101 9.129 19.917 3.288 722 HB2 PRO 101 HB2 PRO 101 11.005 20.275 1.031 723 HB3 PRO 101 HB1 PRO 101 10.887 18.955 2.196 724 HG2 PRO 101 HG2 PRO 101 10.099 18.651 -0.344 725 HG3 PRO 101 HG1 PRO 101 9.249 17.862 0.996 726 HD2 PRO 101 HD2 PRO 101 8.478 20.286 -0.574 727 HD3 PRO 101 HD1 PRO 101 7.462 18.979 0.069 728 H ARG 102 H ARG 102 8.989 21.812 4.399 729 HA ARG 102 HA ARG 102 9.920 24.299 3.236 730 HB2 ARG 102 HB2 ARG 102 9.069 23.765 6.084 731 HB3 ARG 102 HB1 ARG 102 9.181 25.326 5.285 732 HG2 ARG 102 HG2 ARG 102 7.337 24.732 3.822 733 HG3 ARG 102 HG1 ARG 102 7.245 23.135 4.567 734 HD2 ARG 102 HD2 ARG 102 6.832 24.289 6.755 735 HD3 ARG 102 HD1 ARG 102 6.698 25.800 5.858 736 HE ARG 102 HE ARG 102 4.969 23.818 4.787 737 HH11 ARG 102 HH11 ARG 102 5.303 26.079 7.437 738 HH12 ARG 102 HH12 ARG 102 3.598 26.167 7.745 739 HH21 ARG 102 HH21 ARG 102 2.720 23.921 5.199 740 HH22 ARG 102 HH22 ARG 102 2.131 24.937 6.478 741 H SER 103 H SER 103 10.710 22.389 6.133 742 HA SER 103 HA SER 103 12.593 22.181 7.374 743 HB2 SER 103 HB2 SER 103 13.296 21.128 5.186 744 HB3 SER 103 HB1 SER 103 14.070 22.656 4.779 745 HG SER 103 HG SER 103 14.703 21.550 7.256 746 H ASP 104 H ASP 104 12.066 24.193 8.443 747 HA ASP 104 HA ASP 104 13.857 26.414 7.702 748 HB2 ASP 104 HB2 ASP 104 11.203 26.451 9.152 749 HB3 ASP 104 HB1 ASP 104 12.276 27.842 9.059 750 H GLY 105 H GLY 105 14.791 27.627 9.466 751 HA2 GLY 105 HA2 GLY 105 15.751 25.904 11.558 752 HA3 GLY 105 HA1 GLY 105 16.190 27.586 11.303 753 H THR 106 H THR 106 13.749 25.445 12.607 754 HA THR 106 HA THR 106 12.108 25.671 14.137 755 HB THR 106 HB THR 106 12.715 26.966 16.207 756 HG1 THR 106 HG1 THR 106 14.400 28.180 14.617 757 HG21 THR 106 HG21 THR 106 13.247 24.615 16.019 758 HG22 THR 106 HG22 THR 106 14.570 25.456 16.825 759 HG23 THR 106 HG23 THR 106 14.725 24.990 15.132 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 3.171 -26.440 9.729 2 H2 GLY 1 HT2 GLY 1 3.339 -24.826 10.193 3 H3 GLY 1 HT3 GLY 1 4.411 -25.497 9.071 4 HA2 GLY 1 HA1 GLY 1 2.787 -24.082 7.981 5 HA3 GLY 1 HA2 GLY 1 2.650 -25.758 7.468 6 H SER 2 H SER 2 0.507 -24.316 6.976 7 HA SER 2 HA SER 2 -1.349 -24.463 9.199 8 HB2 SER 2 HB2 SER 2 -1.766 -23.596 6.329 9 HB3 SER 2 HB1 SER 2 -2.952 -23.445 7.625 10 HG SER 2 HG SER 2 -2.036 -21.590 7.960 11 H HIS 3 H HIS 3 -0.964 -26.849 9.282 12 HA HIS 3 HA HIS 3 -2.207 -28.428 7.204 13 HB2 HIS 3 HB2 HIS 3 -0.195 -29.143 8.616 14 HB3 HIS 3 HB1 HIS 3 -1.341 -29.409 9.925 15 HD1 HIS 3 HD1 HIS 3 -0.263 -30.785 6.619 16 HD2 HIS 3 HD2 HIS 3 -2.957 -31.671 9.654 17 HE1 HIS 3 HE1 HIS 3 -1.095 -33.105 6.129 18 HE2 HIS 3 HE2 HIS 3 -2.847 -33.549 7.884 19 H MET 4 H MET 4 -4.176 -27.049 7.540 20 HA MET 4 HA MET 4 -5.938 -28.239 9.587 21 HB2 MET 4 HB2 MET 4 -7.107 -26.049 9.683 22 HB3 MET 4 HB1 MET 4 -5.433 -25.943 10.208 23 HG2 MET 4 HG2 MET 4 -4.791 -25.007 8.064 24 HG3 MET 4 HG1 MET 4 -6.445 -25.171 7.480 25 HE1 MET 4 HE1 MET 4 -5.264 -24.022 11.072 26 HE2 MET 4 HE2 MET 4 -5.169 -22.276 10.843 27 HE3 MET 4 HE3 MET 4 -4.054 -23.338 9.985 28 H GLY 5 H GLY 5 -5.617 -29.288 7.003 29 HA2 GLY 5 HA2 GLY 5 -7.077 -30.090 5.365 30 HA3 GLY 5 HA1 GLY 5 -8.273 -28.911 5.891 31 H THR 6 H THR 6 -7.358 -26.552 5.574 32 HA THR 6 HA THR 6 -6.832 -26.219 2.772 33 HB THR 6 HB THR 6 -6.744 -23.755 3.441 34 HG1 THR 6 HG1 THR 6 -6.398 -23.656 5.568 35 HG21 THR 6 HG21 THR 6 -9.181 -23.625 3.771 36 HG22 THR 6 HG22 THR 6 -9.219 -25.358 4.090 37 HG23 THR 6 HG23 THR 6 -8.747 -24.764 2.498 38 H THR 7 H THR 7 -4.782 -27.335 2.723 39 HA THR 7 HA THR 7 -2.545 -26.455 4.222 40 HB THR 7 HB THR 7 -1.238 -27.804 2.541 41 HG1 THR 7 HG1 THR 7 -2.575 -29.101 1.121 42 HG21 THR 7 HG21 THR 7 -3.618 -29.123 3.855 43 HG22 THR 7 HG22 THR 7 -2.051 -28.810 4.603 44 HG23 THR 7 HG23 THR 7 -2.180 -29.962 3.276 45 H THR 8 H THR 8 -0.566 -25.550 3.269 46 HA THR 8 HA THR 8 0.583 -23.915 2.198 47 HB THR 8 HB THR 8 -1.674 -23.900 0.182 48 HG1 THR 8 HG1 THR 8 -0.322 -25.893 0.507 49 HG21 THR 8 HG21 THR 8 -0.059 -22.806 -1.298 50 HG22 THR 8 HG22 THR 8 1.133 -22.797 0.002 51 HG23 THR 8 HG23 THR 8 -0.339 -21.839 0.151 52 H ALA 9 H ALA 9 0.758 -21.972 3.047 53 HA ALA 9 HA ALA 9 -1.592 -20.221 3.136 54 HB1 ALA 9 HB1 ALA 9 -1.425 -21.280 5.337 55 HB2 ALA 9 HB2 ALA 9 -1.085 -19.553 5.427 56 HB3 ALA 9 HB3 ALA 9 0.240 -20.715 5.482 57 HA PRO 10 HA PRO 10 1.660 -17.599 1.563 58 HB2 PRO 10 HB2 PRO 10 0.118 -15.542 0.781 59 HB3 PRO 10 HB1 PRO 10 0.155 -17.074 -0.102 60 HG2 PRO 10 HG2 PRO 10 -1.873 -16.072 1.861 61 HG3 PRO 10 HG1 PRO 10 -2.127 -16.934 0.333 62 HD2 PRO 10 HD2 PRO 10 -2.182 -18.135 2.795 63 HD3 PRO 10 HD1 PRO 10 -1.810 -18.971 1.317 64 H ASP 11 H ASP 11 2.108 -15.142 1.845 65 HA ASP 11 HA ASP 11 1.574 -14.306 4.594 66 HB2 ASP 11 HB2 ASP 11 4.340 -14.635 3.397 67 HB3 ASP 11 HB1 ASP 11 4.002 -13.827 4.922 68 H ALA 12 H ALA 12 2.215 -12.064 4.937 69 HA ALA 12 HA ALA 12 1.985 -10.473 2.479 70 HB1 ALA 12 HB1 ALA 12 0.456 -9.950 4.316 71 HB2 ALA 12 HB2 ALA 12 1.554 -8.604 4.016 72 HB3 ALA 12 HB3 ALA 12 1.824 -9.672 5.393 73 HA PRO 13 HA PRO 13 6.240 -9.075 2.837 74 HB2 PRO 13 HB2 PRO 13 5.363 -6.304 2.384 75 HB3 PRO 13 HB1 PRO 13 6.393 -7.325 1.378 76 HG2 PRO 13 HG2 PRO 13 3.910 -6.675 0.619 77 HG3 PRO 13 HG1 PRO 13 4.596 -8.276 0.271 78 HD2 PRO 13 HD2 PRO 13 2.713 -7.453 2.451 79 HD3 PRO 13 HD1 PRO 13 2.643 -8.881 1.392 80 HA PRO 14 HA PRO 14 6.498 -7.759 7.172 81 HB2 PRO 14 HB2 PRO 14 9.221 -7.201 6.052 82 HB3 PRO 14 HB1 PRO 14 8.778 -7.934 7.598 83 HG2 PRO 14 HG2 PRO 14 9.591 -9.451 5.574 84 HG3 PRO 14 HG1 PRO 14 8.271 -9.983 6.631 85 HD2 PRO 14 HD2 PRO 14 8.172 -8.970 3.840 86 HD3 PRO 14 HD1 PRO 14 7.098 -10.115 4.664 87 H ASP 15 H ASP 15 6.664 -5.834 8.196 88 HA ASP 15 HA ASP 15 5.319 -3.753 7.286 89 HB2 ASP 15 HB2 ASP 15 6.089 -4.030 9.596 90 HB3 ASP 15 HB1 ASP 15 7.709 -3.541 9.120 91 HA PRO 16 HA PRO 16 8.008 -2.053 4.035 92 HB2 PRO 16 HB2 PRO 16 5.479 -0.717 3.307 93 HB3 PRO 16 HB1 PRO 16 6.510 -1.767 2.303 94 HG2 PRO 16 HG2 PRO 16 4.161 -2.646 3.184 95 HG3 PRO 16 HG1 PRO 16 5.572 -3.716 3.208 96 HD2 PRO 16 HD2 PRO 16 4.419 -2.094 5.472 97 HD3 PRO 16 HD1 PRO 16 4.797 -3.838 5.446 98 H THR 17 H THR 17 8.793 -0.019 3.637 99 HA THR 17 HA THR 17 8.013 2.035 5.619 100 HB THR 17 HB THR 17 10.800 1.539 4.547 101 HG1 THR 17 HG1 THR 17 9.507 0.682 6.941 102 HG21 THR 17 HG21 THR 17 9.800 3.231 6.843 103 HG22 THR 17 HG22 THR 17 10.392 3.837 5.295 104 HG23 THR 17 HG23 THR 17 11.488 2.999 6.394 105 H VAL 18 H VAL 18 7.608 3.929 4.973 106 HA VAL 18 HA VAL 18 7.599 4.632 2.175 107 HB VAL 18 HB VAL 18 6.944 6.251 4.641 108 HG11 VAL 18 HG11 VAL 18 7.700 7.735 2.861 109 HG12 VAL 18 HG12 VAL 18 5.966 7.908 3.118 110 HG13 VAL 18 HG13 VAL 18 6.565 6.991 1.728 111 HG21 VAL 18 HG21 VAL 18 5.414 4.376 4.165 112 HG22 VAL 18 HG22 VAL 18 5.140 5.042 2.555 113 HG23 VAL 18 HG23 VAL 18 4.638 5.950 3.979 114 H ASP 19 H ASP 19 9.145 5.638 1.089 115 HA ASP 19 HA ASP 19 11.624 6.212 2.488 116 HB2 ASP 19 HB2 ASP 19 11.605 4.822 0.431 117 HB3 ASP 19 HB1 ASP 19 11.041 6.218 -0.480 118 H GLN 20 H GLN 20 9.394 7.900 0.285 119 HA GLN 20 HA GLN 20 10.297 10.438 1.443 120 HB2 GLN 20 HB2 GLN 20 9.993 9.912 -1.519 121 HB3 GLN 20 HB1 GLN 20 10.224 11.501 -0.802 122 HG2 GLN 20 HG2 GLN 20 12.389 10.707 0.114 123 HG3 GLN 20 HG1 GLN 20 12.158 9.198 -0.765 124 HE21 GLN 20 HE21 GLN 20 10.905 10.619 -3.030 125 HE22 GLN 20 HE22 GLN 20 12.188 11.361 -3.875 126 H VAL 21 H VAL 21 8.795 12.037 1.544 127 HA VAL 21 HA VAL 21 6.053 11.339 0.739 128 HB VAL 21 HB VAL 21 5.224 12.355 2.864 129 HG11 VAL 21 HG11 VAL 21 5.369 9.932 2.664 130 HG12 VAL 21 HG12 VAL 21 5.756 10.442 4.306 131 HG13 VAL 21 HG13 VAL 21 7.047 9.972 3.202 132 HG21 VAL 21 HG21 VAL 21 8.131 12.251 3.663 133 HG22 VAL 21 HG22 VAL 21 6.782 12.605 4.742 134 HG23 VAL 21 HG23 VAL 21 7.167 13.707 3.420 135 H ASP 22 H ASP 22 4.833 12.977 -0.070 136 HA ASP 22 HA ASP 22 5.759 15.752 0.246 137 HB2 ASP 22 HB2 ASP 22 4.908 14.446 -2.352 138 HB3 ASP 22 HB1 ASP 22 5.065 16.181 -2.135 139 H ASP 23 H ASP 23 3.595 16.705 -1.522 140 HA ASP 23 HA ASP 23 1.454 16.720 0.395 141 HB2 ASP 23 HB2 ASP 23 1.349 17.753 -2.442 142 HB3 ASP 23 HB1 ASP 23 0.298 18.205 -1.124 143 H THR 24 H THR 24 1.317 16.044 -3.064 144 HA THR 24 HA THR 24 -0.952 14.213 -2.622 145 HB THR 24 HB THR 24 -1.295 14.582 -5.091 146 HG1 THR 24 HG1 THR 24 0.504 15.340 -5.992 147 HG21 THR 24 HG21 THR 24 -1.208 17.092 -3.410 148 HG22 THR 24 HG22 THR 24 -2.505 15.895 -3.387 149 HG23 THR 24 HG23 THR 24 -2.196 16.835 -4.849 150 H SER 25 H SER 25 1.661 13.211 -2.086 151 HA SER 25 HA SER 25 1.901 10.995 -3.799 152 HB2 SER 25 HB2 SER 25 4.143 11.529 -4.775 153 HB3 SER 25 HB1 SER 25 2.837 12.527 -5.410 154 HG SER 25 HG SER 25 4.857 13.221 -3.558 155 H ILE 26 H ILE 26 2.942 9.399 -2.797 156 HA ILE 26 HA ILE 26 5.034 9.928 -0.817 157 HB ILE 26 HB ILE 26 2.352 8.761 -0.098 158 HG12 ILE 26 HG12 ILE 26 4.199 10.714 1.283 159 HG13 ILE 26 HG11 ILE 26 2.706 11.102 0.439 160 HG21 ILE 26 HG21 ILE 26 3.912 7.029 0.522 161 HG22 ILE 26 HG22 ILE 26 3.309 7.841 1.968 162 HG23 ILE 26 HG23 ILE 26 4.923 8.205 1.361 163 HD11 ILE 26 HD11 ILE 26 1.473 9.753 2.110 164 HD12 ILE 26 HD12 ILE 26 2.308 11.149 2.792 165 HD13 ILE 26 HD13 ILE 26 2.989 9.532 2.987 166 H VAL 27 H VAL 27 6.443 8.059 -0.580 167 HA VAL 27 HA VAL 27 5.722 5.926 -2.494 168 HB VAL 27 HB VAL 27 8.512 6.805 -1.785 169 HG11 VAL 27 HG11 VAL 27 7.734 4.396 -2.658 170 HG12 VAL 27 HG12 VAL 27 9.270 5.135 -3.133 171 HG13 VAL 27 HG13 VAL 27 7.877 5.228 -4.213 172 HG21 VAL 27 HG21 VAL 27 6.893 7.400 -4.260 173 HG22 VAL 27 HG22 VAL 27 8.603 7.774 -4.040 174 HG23 VAL 27 HG23 VAL 27 7.389 8.565 -3.035 175 H VAL 28 H VAL 28 5.699 3.877 -1.742 176 HA VAL 28 HA VAL 28 6.893 3.439 0.905 177 HB VAL 28 HB VAL 28 5.025 2.580 1.785 178 HG11 VAL 28 HG11 VAL 28 3.612 3.830 -0.520 179 HG12 VAL 28 HG12 VAL 28 4.294 4.714 0.842 180 HG13 VAL 28 HG13 VAL 28 3.000 3.552 1.109 181 HG21 VAL 28 HG21 VAL 28 4.258 1.428 -0.860 182 HG22 VAL 28 HG22 VAL 28 3.427 1.132 0.670 183 HG23 VAL 28 HG23 VAL 28 5.097 0.584 0.442 184 H ARG 29 H ARG 29 7.783 1.384 1.287 185 HA ARG 29 HA ARG 29 8.185 -0.282 -1.118 186 HB2 ARG 29 HB2 ARG 29 10.419 0.426 0.787 187 HB3 ARG 29 HB1 ARG 29 10.544 -0.368 -0.777 188 HG2 ARG 29 HG2 ARG 29 9.873 1.705 -1.886 189 HG3 ARG 29 HG1 ARG 29 9.742 2.501 -0.318 190 HD2 ARG 29 HD2 ARG 29 11.843 3.117 -1.213 191 HD3 ARG 29 HD1 ARG 29 12.165 1.929 0.045 192 HE ARG 29 HE ARG 29 11.947 0.858 -2.637 193 HH11 ARG 29 HH11 ARG 29 14.071 2.036 -0.112 194 HH12 ARG 29 HH12 ARG 29 15.503 1.380 -0.838 195 HH21 ARG 29 HH21 ARG 29 13.822 -0.016 -3.580 196 HH22 ARG 29 HH22 ARG 29 15.358 0.196 -2.803 197 H TRP 30 H TRP 30 7.835 -2.325 -0.766 198 HA TRP 30 HA TRP 30 7.703 -3.276 2.026 199 HB2 TRP 30 HB2 TRP 30 5.934 -4.866 1.232 200 HB3 TRP 30 HB1 TRP 30 5.470 -3.175 1.117 201 HD1 TRP 30 HD1 TRP 30 6.514 -6.099 -1.104 202 HE1 TRP 30 HE1 TRP 30 5.666 -5.655 -3.489 203 HE3 TRP 30 HE3 TRP 30 4.668 -1.422 -0.398 204 HZ2 TRP 30 HZ2 TRP 30 4.311 -3.596 -4.860 205 HZ3 TRP 30 HZ3 TRP 30 3.579 -0.294 -2.287 206 HH2 TRP 30 HH2 TRP 30 3.398 -1.345 -4.459 207 H SER 31 H SER 31 8.384 -5.332 2.531 208 HA SER 31 HA SER 31 10.277 -6.527 0.667 209 HB2 SER 31 HB2 SER 31 10.928 -6.093 3.039 210 HB3 SER 31 HB1 SER 31 9.691 -7.234 3.556 211 HG SER 31 HG SER 31 10.810 -8.860 2.413 212 H ARG 32 H ARG 32 8.863 -7.433 -0.787 213 HA ARG 32 HA ARG 32 6.529 -8.745 -0.504 214 HB2 ARG 32 HB2 ARG 32 7.346 -10.093 -2.580 215 HB3 ARG 32 HB1 ARG 32 7.152 -8.349 -2.687 216 HG2 ARG 32 HG2 ARG 32 9.788 -9.254 -1.819 217 HG3 ARG 32 HG1 ARG 32 9.359 -9.691 -3.473 218 HD2 ARG 32 HD2 ARG 32 8.917 -7.345 -3.975 219 HD3 ARG 32 HD1 ARG 32 9.281 -6.893 -2.306 220 HE ARG 32 HE ARG 32 11.230 -7.975 -4.245 221 HH11 ARG 32 HH11 ARG 32 10.499 -6.014 -1.422 222 HH12 ARG 32 HH12 ARG 32 12.143 -5.515 -1.198 223 HH21 ARG 32 HH21 ARG 32 13.378 -7.309 -3.945 224 HH22 ARG 32 HH22 ARG 32 13.776 -6.250 -2.628 225 HA PRO 33 HA PRO 33 6.846 -12.258 1.836 226 HB2 PRO 33 HB2 PRO 33 4.823 -13.709 0.376 227 HB3 PRO 33 HB1 PRO 33 4.643 -12.757 1.853 228 HG2 PRO 33 HG2 PRO 33 3.567 -12.069 -0.572 229 HG3 PRO 33 HG1 PRO 33 3.974 -10.900 0.706 230 HD2 PRO 33 HD2 PRO 33 5.509 -11.642 -1.744 231 HD3 PRO 33 HD1 PRO 33 5.250 -10.050 -1.019 232 H GLN 34 H GLN 34 7.091 -14.507 2.116 233 HA GLN 34 HA GLN 34 8.745 -15.911 0.296 234 HB2 GLN 34 HB2 GLN 34 8.792 -16.378 2.671 235 HB3 GLN 34 HB1 GLN 34 7.102 -16.856 2.650 236 HG2 GLN 34 HG2 GLN 34 7.779 -18.697 1.061 237 HG3 GLN 34 HG1 GLN 34 9.450 -18.285 1.439 238 HE21 GLN 34 HE21 GLN 34 6.815 -18.144 3.743 239 HE22 GLN 34 HE22 GLN 34 7.361 -19.448 4.734 240 H ALA 35 H ALA 35 5.344 -15.624 0.786 241 HA ALA 35 HA ALA 35 4.384 -17.917 -0.501 242 HB1 ALA 35 HB1 ALA 35 3.110 -16.237 0.920 243 HB2 ALA 35 HB2 ALA 35 2.278 -16.856 -0.508 244 HB3 ALA 35 HB3 ALA 35 3.007 -15.244 -0.540 245 HA PRO 36 HA PRO 36 4.980 -16.730 -4.811 246 HB2 PRO 36 HB2 PRO 36 3.046 -18.838 -5.411 247 HB3 PRO 36 HB1 PRO 36 4.745 -18.732 -5.873 248 HG2 PRO 36 HG2 PRO 36 3.814 -20.533 -4.069 249 HG3 PRO 36 HG1 PRO 36 5.457 -19.870 -4.016 250 HD2 PRO 36 HD2 PRO 36 3.064 -19.148 -2.377 251 HD3 PRO 36 HD1 PRO 36 4.770 -19.264 -1.896 252 H ILE 37 H ILE 37 3.905 -14.963 -5.374 253 HA ILE 37 HA ILE 37 0.983 -14.865 -4.989 254 HB ILE 37 HB ILE 37 1.229 -12.436 -4.619 255 HG12 ILE 37 HG12 ILE 37 3.973 -13.050 -5.451 256 HG13 ILE 37 HG11 ILE 37 3.065 -11.557 -5.584 257 HG21 ILE 37 HG21 ILE 37 1.949 -12.487 -2.363 258 HG22 ILE 37 HG22 ILE 37 3.114 -13.786 -2.679 259 HG23 ILE 37 HG23 ILE 37 1.386 -14.139 -2.690 260 HD11 ILE 37 HD11 ILE 37 4.933 -11.114 -4.228 261 HD12 ILE 37 HD12 ILE 37 4.649 -12.551 -3.248 262 HD13 ILE 37 HD13 ILE 37 3.539 -11.184 -3.149 263 H THR 38 H THR 38 -0.142 -13.429 -6.570 264 HA THR 38 HA THR 38 1.151 -13.665 -9.183 265 HB THR 38 HB THR 38 -1.201 -13.274 -10.062 266 HG1 THR 38 HG1 THR 38 -2.811 -13.959 -8.443 267 HG21 THR 38 HG21 THR 38 -0.114 -15.421 -10.121 268 HG22 THR 38 HG22 THR 38 -1.818 -15.606 -9.724 269 HG23 THR 38 HG23 THR 38 -0.600 -15.742 -8.457 270 H GLY 39 H GLY 39 -0.191 -11.227 -7.025 271 HA2 GLY 39 HA2 GLY 39 1.157 -9.220 -8.525 272 HA3 GLY 39 HA1 GLY 39 -0.581 -9.121 -8.747 273 H TYR 40 H TYR 40 -0.050 -6.943 -7.762 274 HA TYR 40 HA TYR 40 -0.523 -7.151 -4.871 275 HB2 TYR 40 HB2 TYR 40 1.603 -5.566 -6.243 276 HB3 TYR 40 HB1 TYR 40 0.801 -4.862 -4.843 277 HD1 TYR 40 HD2 TYR 40 1.948 -8.330 -5.615 278 HD2 TYR 40 HD1 TYR 40 2.158 -4.988 -2.990 279 HE1 TYR 40 HE2 TYR 40 3.460 -9.572 -4.151 280 HE2 TYR 40 HE1 TYR 40 3.636 -6.250 -1.508 281 HH TYR 40 HH TYR 40 5.123 -9.144 -2.466 282 H ARG 41 H ARG 41 -2.175 -6.001 -4.205 283 HA ARG 41 HA ARG 41 -3.063 -3.710 -5.831 284 HB2 ARG 41 HB2 ARG 41 -4.698 -4.860 -3.634 285 HB3 ARG 41 HB1 ARG 41 -5.197 -4.110 -5.156 286 HG2 ARG 41 HG2 ARG 41 -4.527 -6.070 -6.390 287 HG3 ARG 41 HG1 ARG 41 -3.836 -6.787 -4.931 288 HD2 ARG 41 HD2 ARG 41 -6.731 -6.236 -5.489 289 HD3 ARG 41 HD1 ARG 41 -5.960 -7.805 -5.440 290 HE ARG 41 HE ARG 41 -5.955 -6.167 -3.021 291 HH11 ARG 41 HH11 ARG 41 -7.159 -8.943 -4.783 292 HH12 ARG 41 HH12 ARG 41 -7.872 -9.678 -3.376 293 HH21 ARG 41 HH21 ARG 41 -6.923 -7.142 -1.170 294 HH22 ARG 41 HH22 ARG 41 -7.745 -8.663 -1.350 295 H ILE 42 H ILE 42 -3.496 -1.757 -4.743 296 HA ILE 42 HA ILE 42 -2.365 -1.629 -2.019 297 HB ILE 42 HB ILE 42 -1.527 0.243 -4.206 298 HG12 ILE 42 HG12 ILE 42 0.088 -1.991 -3.019 299 HG13 ILE 42 HG11 ILE 42 -0.809 -2.149 -4.520 300 HG21 ILE 42 HG21 ILE 42 -1.453 1.028 -1.814 301 HG22 ILE 42 HG22 ILE 42 0.087 1.062 -2.663 302 HG23 ILE 42 HG23 ILE 42 -0.257 -0.234 -1.518 303 HD11 ILE 42 HD11 ILE 42 1.485 -1.713 -4.994 304 HD12 ILE 42 HD12 ILE 42 1.464 -0.283 -3.968 305 HD13 ILE 42 HD13 ILE 42 0.523 -0.309 -5.458 306 H VAL 43 H VAL 43 -3.906 -0.776 -0.764 307 HA VAL 43 HA VAL 43 -5.470 1.441 -1.938 308 HB VAL 43 HB VAL 43 -6.313 -0.429 0.278 309 HG11 VAL 43 HG11 VAL 43 -7.805 1.862 -0.961 310 HG12 VAL 43 HG12 VAL 43 -7.119 1.822 0.662 311 HG13 VAL 43 HG13 VAL 43 -8.430 0.730 0.236 312 HG21 VAL 43 HG21 VAL 43 -6.397 -1.396 -1.993 313 HG22 VAL 43 HG22 VAL 43 -7.436 -0.058 -2.487 314 HG23 VAL 43 HG23 VAL 43 -7.993 -1.203 -1.269 315 H TYR 44 H TYR 44 -4.736 3.299 -1.286 316 HA TYR 44 HA TYR 44 -4.031 3.618 1.532 317 HB2 TYR 44 HB2 TYR 44 -2.761 5.711 0.565 318 HB3 TYR 44 HB1 TYR 44 -2.019 4.119 0.540 319 HD1 TYR 44 HD2 TYR 44 -2.248 2.758 -1.615 320 HD2 TYR 44 HD1 TYR 44 -2.974 6.938 -1.422 321 HE1 TYR 44 HE2 TYR 44 -1.910 2.903 -4.034 322 HE2 TYR 44 HE1 TYR 44 -2.632 7.111 -3.846 323 HH TYR 44 HH TYR 44 -1.565 5.919 -5.647 324 H SER 45 H SER 45 -5.098 4.890 2.692 325 HA SER 45 HA SER 45 -6.927 6.837 1.457 326 HB2 SER 45 HB2 SER 45 -8.698 6.019 3.093 327 HB3 SER 45 HB1 SER 45 -8.327 4.939 1.750 328 HG SER 45 HG SER 45 -7.147 3.652 3.114 329 HA PRO 46 HA PRO 46 -5.598 9.351 4.934 330 HB2 PRO 46 HB2 PRO 46 -7.133 11.478 4.412 331 HB3 PRO 46 HB1 PRO 46 -5.772 11.051 3.366 332 HG2 PRO 46 HG2 PRO 46 -8.693 10.564 2.969 333 HG3 PRO 46 HG1 PRO 46 -7.476 11.096 1.795 334 HD2 PRO 46 HD2 PRO 46 -8.368 8.506 2.039 335 HD3 PRO 46 HD1 PRO 46 -6.793 8.965 1.364 336 H SER 47 H SER 47 -6.331 9.742 6.968 337 HA SER 47 HA SER 47 -8.652 8.343 7.802 338 HB2 SER 47 HB2 SER 47 -6.549 8.566 9.143 339 HB3 SER 47 HB1 SER 47 -6.971 10.252 9.436 340 HG SER 47 HG SER 47 -8.523 7.982 10.160 341 H VAL 48 H VAL 48 -8.043 11.709 7.070 342 HA VAL 48 HA VAL 48 -10.726 12.347 8.094 343 HB VAL 48 HB VAL 48 -10.001 14.707 8.257 344 HG11 VAL 48 HG11 VAL 48 -8.591 14.419 10.249 345 HG12 VAL 48 HG12 VAL 48 -8.324 12.734 9.803 346 HG13 VAL 48 HG13 VAL 48 -9.943 13.289 10.224 347 HG21 VAL 48 HG21 VAL 48 -7.590 15.219 8.189 348 HG22 VAL 48 HG22 VAL 48 -8.224 14.724 6.620 349 HG23 VAL 48 HG23 VAL 48 -7.282 13.590 7.586 350 H GLU 49 H GLU 49 -8.564 12.677 5.346 351 HA GLU 49 HA GLU 49 -10.466 14.294 3.896 352 HB2 GLU 49 HB2 GLU 49 -7.787 13.170 3.083 353 HB3 GLU 49 HB1 GLU 49 -8.768 14.241 2.093 354 HG2 GLU 49 HG2 GLU 49 -7.486 14.866 4.731 355 HG3 GLU 49 HG1 GLU 49 -7.073 15.523 3.152 356 H GLY 50 H GLY 50 -10.247 13.411 1.316 357 HA2 GLY 50 HA2 GLY 50 -11.741 10.881 1.558 358 HA3 GLY 50 HA1 GLY 50 -12.255 12.211 0.539 359 H SER 51 H SER 51 -9.078 12.329 -0.096 360 HA SER 51 HA SER 51 -9.484 10.808 -2.510 361 HB2 SER 51 HB2 SER 51 -6.862 12.078 -1.603 362 HB3 SER 51 HB1 SER 51 -7.374 11.675 -3.245 363 HG SER 51 HG SER 51 -9.100 13.232 -2.942 364 H SER 52 H SER 52 -9.382 8.692 -2.459 365 HA SER 52 HA SER 52 -7.110 7.395 -1.111 366 HB2 SER 52 HB2 SER 52 -8.615 5.372 -0.893 367 HB3 SER 52 HB1 SER 52 -9.089 6.749 0.106 368 HG SER 52 HG SER 52 -10.262 6.922 -2.313 369 H THR 53 H THR 53 -6.115 5.669 -2.264 370 HA THR 53 HA THR 53 -7.160 5.267 -4.980 371 HB THR 53 HB THR 53 -4.250 5.919 -4.515 372 HG1 THR 53 HG1 THR 53 -4.786 7.961 -5.445 373 HG21 THR 53 HG21 THR 53 -4.699 4.561 -6.491 374 HG22 THR 53 HG22 THR 53 -4.197 6.189 -6.946 375 HG23 THR 53 HG23 THR 53 -5.900 5.734 -7.035 376 H GLU 54 H GLU 54 -6.585 3.332 -5.958 377 HA GLU 54 HA GLU 54 -5.142 1.376 -4.332 378 HB2 GLU 54 HB2 GLU 54 -7.574 0.913 -4.391 379 HB3 GLU 54 HB1 GLU 54 -7.519 0.887 -6.147 380 HG2 GLU 54 HG2 GLU 54 -5.985 -1.041 -6.040 381 HG3 GLU 54 HG1 GLU 54 -6.138 -1.034 -4.284 382 H LEU 55 H LEU 55 -3.234 0.978 -5.318 383 HA LEU 55 HA LEU 55 -3.166 1.143 -8.247 384 HB2 LEU 55 HB2 LEU 55 -0.857 1.212 -6.270 385 HB3 LEU 55 HB1 LEU 55 -0.676 1.135 -8.021 386 HG LEU 55 HG LEU 55 -1.710 3.366 -6.340 387 HD11 LEU 55 HD11 LEU 55 0.388 3.084 -8.462 388 HD12 LEU 55 HD12 LEU 55 0.584 3.548 -6.770 389 HD13 LEU 55 HD13 LEU 55 -0.195 4.650 -7.900 390 HD21 LEU 55 HD21 LEU 55 -2.463 4.509 -8.387 391 HD22 LEU 55 HD22 LEU 55 -3.425 3.081 -8.015 392 HD23 LEU 55 HD23 LEU 55 -2.208 3.017 -9.290 393 H ASN 56 H ASN 56 -1.756 -0.405 -9.377 394 HA ASN 56 HA ASN 56 -1.917 -3.073 -8.146 395 HB2 ASN 56 HB2 ASN 56 -3.680 -2.670 -9.910 396 HB3 ASN 56 HB1 ASN 56 -2.375 -2.478 -11.076 397 HD21 ASN 56 HD21 ASN 56 -4.112 -4.682 -9.053 398 HD22 ASN 56 HD22 ASN 56 -3.491 -6.139 -9.749 399 H LEU 57 H LEU 57 0.017 -3.969 -7.988 400 HA LEU 57 HA LEU 57 2.110 -3.110 -9.870 401 HB2 LEU 57 HB2 LEU 57 2.343 -3.703 -6.901 402 HB3 LEU 57 HB1 LEU 57 3.720 -3.596 -7.973 403 HG LEU 57 HG LEU 57 1.985 -1.454 -6.880 404 HD11 LEU 57 HD11 LEU 57 4.079 -0.355 -6.553 405 HD12 LEU 57 HD12 LEU 57 4.912 -1.551 -7.547 406 HD13 LEU 57 HD13 LEU 57 4.227 -2.022 -5.997 407 HD21 LEU 57 HD21 LEU 57 1.697 -1.152 -9.266 408 HD22 LEU 57 HD22 LEU 57 3.445 -1.212 -9.493 409 HD23 LEU 57 HD23 LEU 57 2.717 0.112 -8.581 410 HA PRO 58 HA PRO 58 2.715 -7.398 -10.724 411 HB2 PRO 58 HB2 PRO 58 5.472 -7.514 -10.781 412 HB3 PRO 58 HB1 PRO 58 4.458 -7.002 -12.130 413 HG2 PRO 58 HG2 PRO 58 6.024 -5.369 -10.207 414 HG3 PRO 58 HG1 PRO 58 5.665 -5.066 -11.914 415 HD2 PRO 58 HD2 PRO 58 4.405 -3.795 -9.853 416 HD3 PRO 58 HD1 PRO 58 3.657 -4.058 -11.435 417 H GLU 59 H GLU 59 3.216 -9.299 -9.719 418 HA GLU 59 HA GLU 59 3.246 -9.575 -6.990 419 HB2 GLU 59 HB2 GLU 59 4.027 -11.876 -7.367 420 HB3 GLU 59 HB1 GLU 59 2.787 -11.417 -8.526 421 HG2 GLU 59 HG2 GLU 59 4.510 -11.007 -10.208 422 HG3 GLU 59 HG1 GLU 59 5.752 -11.458 -9.045 423 H THR 60 H THR 60 5.897 -8.857 -9.042 424 HA THR 60 HA THR 60 7.868 -9.483 -6.971 425 HB THR 60 HB THR 60 8.301 -10.481 -9.153 426 HG1 THR 60 HG1 THR 60 10.323 -10.160 -8.691 427 HG21 THR 60 HG21 THR 60 8.330 -7.645 -10.180 428 HG22 THR 60 HG22 THR 60 7.173 -8.910 -10.600 429 HG23 THR 60 HG23 THR 60 8.859 -9.055 -11.096 430 H ALA 61 H ALA 61 6.005 -7.008 -7.404 431 HA ALA 61 HA ALA 61 7.913 -4.850 -7.645 432 HB1 ALA 61 HB1 ALA 61 5.019 -4.811 -6.810 433 HB2 ALA 61 HB2 ALA 61 5.631 -4.547 -8.441 434 HB3 ALA 61 HB3 ALA 61 6.007 -3.394 -7.162 435 H ASN 62 H ASN 62 8.139 -3.225 -5.897 436 HA ASN 62 HA ASN 62 7.724 -4.280 -3.220 437 HB2 ASN 62 HB2 ASN 62 10.018 -4.097 -2.551 438 HB3 ASN 62 HB1 ASN 62 9.927 -5.153 -3.955 439 HD21 ASN 62 HD21 ASN 62 12.115 -3.508 -2.827 440 HD22 ASN 62 HD22 ASN 62 12.671 -2.541 -4.147 441 H SER 63 H SER 63 7.067 -1.808 -5.021 442 HA SER 63 HA SER 63 7.004 0.009 -2.842 443 HB2 SER 63 HB2 SER 63 8.509 1.754 -3.936 444 HB3 SER 63 HB1 SER 63 9.334 0.365 -3.230 445 HG SER 63 HG SER 63 8.748 -0.228 -5.754 446 H VAL 64 H VAL 64 5.440 1.488 -3.177 447 HA VAL 64 HA VAL 64 4.537 1.946 -5.953 448 HB VAL 64 HB VAL 64 2.737 0.766 -4.863 449 HG11 VAL 64 HG11 VAL 64 2.016 1.058 -2.768 450 HG12 VAL 64 HG12 VAL 64 2.382 2.781 -2.753 451 HG13 VAL 64 HG13 VAL 64 3.674 1.599 -2.552 452 HG21 VAL 64 HG21 VAL 64 2.102 3.675 -4.896 453 HG22 VAL 64 HG22 VAL 64 0.955 2.335 -4.968 454 HG23 VAL 64 HG23 VAL 64 2.102 2.584 -6.280 455 H THR 65 H THR 65 4.450 4.032 -6.632 456 HA THR 65 HA THR 65 4.814 6.163 -4.692 457 HB THR 65 HB THR 65 4.757 6.053 -7.696 458 HG1 THR 65 HG1 THR 65 6.635 5.294 -6.394 459 HG21 THR 65 HG21 THR 65 5.459 8.427 -7.660 460 HG22 THR 65 HG22 THR 65 5.226 8.456 -5.913 461 HG23 THR 65 HG23 THR 65 3.844 8.211 -6.982 462 H LEU 66 H LEU 66 2.941 6.457 -3.679 463 HA LEU 66 HA LEU 66 0.363 6.364 -4.910 464 HB2 LEU 66 HB2 LEU 66 0.619 7.880 -2.432 465 HB3 LEU 66 HB1 LEU 66 -0.446 6.549 -2.823 466 HG LEU 66 HG LEU 66 2.443 6.124 -2.131 467 HD11 LEU 66 HD11 LEU 66 0.157 5.856 -0.239 468 HD12 LEU 66 HD12 LEU 66 1.108 7.331 -0.373 469 HD13 LEU 66 HD13 LEU 66 1.890 5.826 0.087 470 HD21 LEU 66 HD21 LEU 66 1.385 4.291 -3.290 471 HD22 LEU 66 HD22 LEU 66 0.003 4.371 -2.199 472 HD23 LEU 66 HD23 LEU 66 1.583 3.867 -1.587 473 H SER 67 H SER 67 -0.913 8.083 -5.532 474 HA SER 67 HA SER 67 0.277 10.748 -5.387 475 HB2 SER 67 HB2 SER 67 0.811 9.638 -7.601 476 HB3 SER 67 HB1 SER 67 -0.922 9.634 -7.932 477 HG SER 67 HG SER 67 0.822 11.838 -7.621 478 H ASP 68 H ASP 68 -1.368 12.403 -6.150 479 HA ASP 68 HA ASP 68 -3.315 13.488 -5.791 480 HB2 ASP 68 HB2 ASP 68 -4.424 10.734 -6.304 481 HB3 ASP 68 HB1 ASP 68 -5.461 12.121 -5.979 482 H LEU 69 H LEU 69 -1.810 12.487 -3.557 483 HA LEU 69 HA LEU 69 -3.736 11.837 -1.516 484 HB2 LEU 69 HB2 LEU 69 -1.048 13.005 -0.888 485 HB3 LEU 69 HB1 LEU 69 -1.995 11.834 0.008 486 HG LEU 69 HG LEU 69 -0.495 11.246 -2.532 487 HD11 LEU 69 HD11 LEU 69 0.047 10.498 0.334 488 HD12 LEU 69 HD12 LEU 69 0.949 11.683 -0.610 489 HD13 LEU 69 HD13 LEU 69 0.974 9.981 -1.074 490 HD21 LEU 69 HD21 LEU 69 -2.315 9.765 -2.463 491 HD22 LEU 69 HD22 LEU 69 -2.284 9.697 -0.701 492 HD23 LEU 69 HD23 LEU 69 -1.032 8.868 -1.635 493 H GLN 70 H GLN 70 -3.447 13.427 0.541 494 HA GLN 70 HA GLN 70 -3.767 16.179 -0.443 495 HB2 GLN 70 HB2 GLN 70 -5.916 15.156 0.243 496 HB3 GLN 70 HB1 GLN 70 -5.253 14.863 1.843 497 HG2 GLN 70 HG2 GLN 70 -6.671 16.803 1.887 498 HG3 GLN 70 HG1 GLN 70 -5.000 17.287 2.158 499 HE21 GLN 70 HE21 GLN 70 -5.455 19.381 1.547 500 HE22 GLN 70 HE22 GLN 70 -5.692 19.829 -0.108 501 HA PRO 71 HA PRO 71 -0.196 16.756 2.119 502 HB2 PRO 71 HB2 PRO 71 -0.176 19.469 2.131 503 HB3 PRO 71 HB1 PRO 71 0.364 18.482 0.764 504 HG2 PRO 71 HG2 PRO 71 -2.276 19.842 1.192 505 HG3 PRO 71 HG1 PRO 71 -1.272 19.785 -0.270 506 HD2 PRO 71 HD2 PRO 71 -3.411 18.191 0.038 507 HD3 PRO 71 HD1 PRO 71 -1.949 17.636 -0.801 508 H GLY 72 H GLY 72 0.113 16.776 4.259 509 HA2 GLY 72 HA2 GLY 72 -0.111 17.423 6.478 510 HA3 GLY 72 HA1 GLY 72 -1.388 18.532 6.001 511 H VAL 73 H VAL 73 -1.239 15.088 5.278 512 HA VAL 73 HA VAL 73 -3.507 14.609 7.091 513 HB VAL 73 HB VAL 73 -3.452 13.784 4.183 514 HG11 VAL 73 HG11 VAL 73 -5.377 13.298 6.414 515 HG12 VAL 73 HG12 VAL 73 -4.721 12.155 5.234 516 HG13 VAL 73 HG13 VAL 73 -5.916 13.365 4.737 517 HG21 VAL 73 HG21 VAL 73 -4.840 16.009 5.601 518 HG22 VAL 73 HG22 VAL 73 -5.547 15.248 4.181 519 HG23 VAL 73 HG23 VAL 73 -3.966 16.031 4.063 520 H GLN 74 H GLN 74 -3.792 12.454 7.715 521 HA GLN 74 HA GLN 74 -1.354 10.894 7.675 522 HB2 GLN 74 HB2 GLN 74 -2.477 11.264 9.785 523 HB3 GLN 74 HB1 GLN 74 -3.979 10.641 9.120 524 HG2 GLN 74 HG2 GLN 74 -3.234 8.819 10.306 525 HG3 GLN 74 HG1 GLN 74 -2.535 8.486 8.722 526 HE21 GLN 74 HE21 GLN 74 -0.293 8.790 8.414 527 HE22 GLN 74 HE22 GLN 74 0.794 8.877 9.756 528 H TYR 75 H TYR 75 -1.094 9.561 6.012 529 HA TYR 75 HA TYR 75 -3.460 8.393 4.760 530 HB2 TYR 75 HB2 TYR 75 -0.813 9.245 3.784 531 HB3 TYR 75 HB1 TYR 75 -1.431 7.744 3.083 532 HD1 TYR 75 HD1 TYR 75 -2.254 11.319 3.639 533 HD2 TYR 75 HD2 TYR 75 -3.161 7.756 1.501 534 HE1 TYR 75 HE1 TYR 75 -3.772 12.586 2.179 535 HE2 TYR 75 HE2 TYR 75 -4.673 9.014 0.030 536 HH TYR 75 HH TYR 75 -5.916 11.018 -0.037 537 H ASN 76 H ASN 76 -3.968 6.412 5.113 538 HA ASN 76 HA ASN 76 -2.046 4.545 6.255 539 HB2 ASN 76 HB2 ASN 76 -5.013 4.229 5.707 540 HB3 ASN 76 HB1 ASN 76 -4.003 3.091 6.591 541 HD21 ASN 76 HD21 ASN 76 -6.406 4.674 7.340 542 HD22 ASN 76 HD22 ASN 76 -5.953 5.512 8.783 543 H ILE 77 H ILE 77 -0.779 3.651 4.731 544 HA ILE 77 HA ILE 77 -1.900 2.878 2.147 545 HB ILE 77 HB ILE 77 0.938 2.658 3.160 546 HG12 ILE 77 HG12 ILE 77 1.195 4.347 1.191 547 HG13 ILE 77 HG11 ILE 77 -0.473 4.720 1.535 548 HG21 ILE 77 HG21 ILE 77 0.978 1.039 1.550 549 HG22 ILE 77 HG22 ILE 77 1.271 2.483 0.563 550 HG23 ILE 77 HG23 ILE 77 -0.345 1.782 0.640 551 HD11 ILE 77 HD11 ILE 77 1.015 6.254 2.675 552 HD12 ILE 77 HD12 ILE 77 1.804 4.902 3.489 553 HD13 ILE 77 HD13 ILE 77 0.116 5.277 3.836 554 H THR 78 H THR 78 -2.761 0.990 1.909 555 HA THR 78 HA THR 78 -1.912 -1.184 3.671 556 HB THR 78 HB THR 78 -4.455 -0.867 2.095 557 HG1 THR 78 HG1 THR 78 -4.128 0.651 3.874 558 HG21 THR 78 HG21 THR 78 -5.282 -2.699 3.517 559 HG22 THR 78 HG22 THR 78 -3.699 -2.811 4.286 560 HG23 THR 78 HG23 THR 78 -3.880 -3.208 2.576 561 H ILE 79 H ILE 79 -0.598 -2.628 2.712 562 HA ILE 79 HA ILE 79 -0.665 -2.865 -0.231 563 HB ILE 79 HB ILE 79 1.329 -4.292 1.540 564 HG12 ILE 79 HG12 ILE 79 1.893 -2.034 2.007 565 HG13 ILE 79 HG11 ILE 79 2.988 -2.577 0.733 566 HG21 ILE 79 HG21 ILE 79 2.684 -4.133 -0.573 567 HG22 ILE 79 HG22 ILE 79 1.183 -3.656 -1.373 568 HG23 ILE 79 HG23 ILE 79 1.304 -5.235 -0.590 569 HD11 ILE 79 HD11 ILE 79 2.062 -1.229 -0.838 570 HD12 ILE 79 HD12 ILE 79 1.889 -0.243 0.629 571 HD13 ILE 79 HD13 ILE 79 0.504 -1.131 -0.004 572 H TYR 80 H TYR 80 -1.493 -4.587 -1.208 573 HA TYR 80 HA TYR 80 -2.210 -6.936 0.421 574 HB2 TYR 80 HB2 TYR 80 -3.561 -5.970 -2.118 575 HB3 TYR 80 HB1 TYR 80 -4.068 -7.325 -1.108 576 HD1 TYR 80 HD2 TYR 80 -4.013 -3.662 -1.460 577 HD2 TYR 80 HD1 TYR 80 -5.252 -6.943 0.966 578 HE1 TYR 80 HE2 TYR 80 -5.539 -2.185 -0.235 579 HE2 TYR 80 HE1 TYR 80 -6.783 -5.461 2.193 580 HH TYR 80 HH TYR 80 -7.038 -3.068 2.679 581 H ALA 81 H ALA 81 -0.694 -8.474 -0.042 582 HA ALA 81 HA ALA 81 0.218 -8.818 -2.773 583 HB1 ALA 81 HB1 ALA 81 1.872 -9.425 -1.162 584 HB2 ALA 81 HB2 ALA 81 1.273 -10.970 -1.792 585 HB3 ALA 81 HB3 ALA 81 0.726 -10.370 -0.212 586 H VAL 82 H VAL 82 -0.740 -10.066 -4.241 587 HA VAL 82 HA VAL 82 -2.995 -11.707 -3.244 588 HB VAL 82 HB VAL 82 -3.919 -9.835 -4.436 589 HG11 VAL 82 HG11 VAL 82 -2.216 -10.650 -6.763 590 HG12 VAL 82 HG12 VAL 82 -2.064 -9.174 -5.807 591 HG13 VAL 82 HG13 VAL 82 -3.492 -9.434 -6.808 592 HG21 VAL 82 HG21 VAL 82 -5.223 -10.991 -6.135 593 HG22 VAL 82 HG22 VAL 82 -5.019 -12.007 -4.708 594 HG23 VAL 82 HG23 VAL 82 -4.043 -12.304 -6.152 595 H GLU 83 H GLU 83 -3.176 -13.754 -3.915 596 HA GLU 83 HA GLU 83 -1.124 -14.693 -5.798 597 HB2 GLU 83 HB2 GLU 83 -2.453 -16.537 -3.837 598 HB3 GLU 83 HB1 GLU 83 -0.904 -16.673 -4.648 599 HG2 GLU 83 HG2 GLU 83 -0.365 -16.291 -2.449 600 HG3 GLU 83 HG1 GLU 83 -0.137 -14.764 -3.279 601 H GLU 84 H GLU 84 -1.849 -16.867 -6.785 602 HA GLU 84 HA GLU 84 -3.567 -16.408 -8.786 603 HB2 GLU 84 HB2 GLU 84 -3.285 -19.105 -7.465 604 HB3 GLU 84 HB1 GLU 84 -3.726 -18.795 -9.139 605 HG2 GLU 84 HG2 GLU 84 -1.520 -17.827 -9.542 606 HG3 GLU 84 HG1 GLU 84 -1.082 -18.139 -7.864 607 H ASN 85 H ASN 85 -4.583 -18.062 -5.779 608 HA ASN 85 HA ASN 85 -7.354 -17.354 -6.484 609 HB2 ASN 85 HB2 ASN 85 -6.513 -19.856 -6.815 610 HB3 ASN 85 HB1 ASN 85 -6.815 -19.938 -5.086 611 HD21 ASN 85 HD21 ASN 85 -9.060 -17.992 -5.318 612 HD22 ASN 85 HD22 ASN 85 -10.368 -18.900 -5.994 613 H GLN 86 H GLN 86 -5.197 -16.370 -4.518 614 HA GLN 86 HA GLN 86 -6.924 -16.367 -2.158 615 HB2 GLN 86 HB2 GLN 86 -4.024 -17.214 -2.142 616 HB3 GLN 86 HB1 GLN 86 -4.913 -16.763 -0.697 617 HG2 GLN 86 HG2 GLN 86 -5.734 -19.009 -2.519 618 HG3 GLN 86 HG1 GLN 86 -4.689 -19.218 -1.115 619 HE21 GLN 86 HE21 GLN 86 -6.110 -20.537 -0.045 620 HE22 GLN 86 HE22 GLN 86 -7.587 -19.978 0.632 621 H GLU 87 H GLU 87 -5.962 -14.846 -0.462 622 HA GLU 87 HA GLU 87 -4.380 -12.670 -1.636 623 HB2 GLU 87 HB2 GLU 87 -6.740 -12.192 0.187 624 HB3 GLU 87 HB1 GLU 87 -5.799 -10.991 -0.678 625 HG2 GLU 87 HG2 GLU 87 -6.773 -11.528 -2.726 626 HG3 GLU 87 HG1 GLU 87 -7.394 -13.068 -2.131 627 H SER 88 H SER 88 -2.673 -12.262 -0.369 628 HA SER 88 HA SER 88 -2.367 -13.526 2.168 629 HB2 SER 88 HB2 SER 88 -0.687 -11.391 0.839 630 HB3 SER 88 HB1 SER 88 -0.198 -12.372 2.221 631 HG SER 88 HG SER 88 -0.908 -13.384 -0.350 632 H THR 89 H THR 89 -1.555 -12.184 4.091 633 HA THR 89 HA THR 89 -3.625 -10.518 5.001 634 HB THR 89 HB THR 89 -1.845 -9.937 6.817 635 HG1 THR 89 HG1 THR 89 0.055 -10.591 6.016 636 HG21 THR 89 HG21 THR 89 -2.780 -12.775 6.385 637 HG22 THR 89 HG22 THR 89 -3.706 -11.485 7.152 638 HG23 THR 89 HG23 THR 89 -2.237 -12.092 7.917 639 HA PRO 90 HA PRO 90 -2.358 -6.616 3.450 640 HB2 PRO 90 HB2 PRO 90 -3.781 -4.968 4.994 641 HB3 PRO 90 HB1 PRO 90 -4.562 -6.107 3.891 642 HG2 PRO 90 HG2 PRO 90 -4.192 -6.285 6.850 643 HG3 PRO 90 HG1 PRO 90 -5.579 -6.766 5.860 644 HD2 PRO 90 HD2 PRO 90 -3.623 -8.479 6.824 645 HD3 PRO 90 HD1 PRO 90 -4.728 -8.822 5.481 646 H VAL 91 H VAL 91 -0.733 -5.255 3.615 647 HA VAL 91 HA VAL 91 0.729 -4.655 6.042 648 HB VAL 91 HB VAL 91 0.781 -3.582 3.227 649 HG11 VAL 91 HG11 VAL 91 1.211 -1.794 4.886 650 HG12 VAL 91 HG12 VAL 91 2.588 -2.131 3.846 651 HG13 VAL 91 HG13 VAL 91 2.566 -2.740 5.498 652 HG21 VAL 91 HG21 VAL 91 1.800 -5.798 3.609 653 HG22 VAL 91 HG22 VAL 91 2.889 -5.060 4.787 654 HG23 VAL 91 HG23 VAL 91 2.959 -4.574 3.091 655 H VAL 92 H VAL 92 0.014 -3.035 7.446 656 HA VAL 92 HA VAL 92 -1.355 -0.774 6.146 657 HB VAL 92 HB VAL 92 -1.738 -1.500 9.050 658 HG11 VAL 92 HG11 VAL 92 -3.706 -0.016 8.808 659 HG12 VAL 92 HG12 VAL 92 -3.200 0.331 7.153 660 HG13 VAL 92 HG13 VAL 92 -2.176 0.811 8.509 661 HG21 VAL 92 HG21 VAL 92 -2.609 -3.340 7.711 662 HG22 VAL 92 HG22 VAL 92 -3.516 -2.204 6.713 663 HG23 VAL 92 HG23 VAL 92 -3.933 -2.409 8.414 664 H ILE 93 H ILE 93 0.145 0.720 5.898 665 HA ILE 93 HA ILE 93 1.798 1.429 8.229 666 HB ILE 93 HB ILE 93 3.456 2.358 6.507 667 HG12 ILE 93 HG12 ILE 93 2.206 0.363 4.649 668 HG13 ILE 93 HG11 ILE 93 1.753 2.048 4.617 669 HG21 ILE 93 HG21 ILE 93 4.558 0.198 6.243 670 HG22 ILE 93 HG22 ILE 93 3.063 -0.623 6.688 671 HG23 ILE 93 HG23 ILE 93 3.897 0.387 7.867 672 HD11 ILE 93 HD11 ILE 93 3.418 1.651 2.955 673 HD12 ILE 93 HD12 ILE 93 4.487 0.926 4.161 674 HD13 ILE 93 HD13 ILE 93 4.106 2.651 4.250 675 H GLN 94 H GLN 94 1.242 3.341 9.025 676 HA GLN 94 HA GLN 94 -0.164 5.193 7.248 677 HB2 GLN 94 HB2 GLN 94 -0.920 6.315 9.328 678 HB3 GLN 94 HB1 GLN 94 -1.441 4.642 9.191 679 HG2 GLN 94 HG2 GLN 94 0.238 3.942 10.766 680 HG3 GLN 94 HG1 GLN 94 0.915 5.567 10.821 681 HE21 GLN 94 HE21 GLN 94 -2.524 4.940 10.725 682 HE22 GLN 94 HE22 GLN 94 -2.855 5.459 12.342 683 H GLN 95 H GLN 95 0.753 6.921 6.540 684 HA GLN 95 HA GLN 95 2.952 8.162 8.036 685 HB2 GLN 95 HB2 GLN 95 3.164 6.782 5.564 686 HB3 GLN 95 HB1 GLN 95 3.332 8.492 5.209 687 HG2 GLN 95 HG2 GLN 95 4.978 6.895 7.159 688 HG3 GLN 95 HG1 GLN 95 5.493 7.469 5.576 689 HE21 GLN 95 HE21 GLN 95 4.081 10.059 5.995 690 HE22 GLN 95 HE22 GLN 95 5.106 10.948 7.070 691 H GLU 96 H GLU 96 2.746 10.357 8.174 692 HA GLU 96 HA GLU 96 0.411 11.559 6.945 693 HB2 GLU 96 HB2 GLU 96 2.515 12.703 8.784 694 HB3 GLU 96 HB1 GLU 96 1.157 13.621 8.156 695 HG2 GLU 96 HG2 GLU 96 -0.371 12.030 9.271 696 HG3 GLU 96 HG1 GLU 96 1.037 11.243 9.988 697 H THR 97 H THR 97 0.396 12.938 5.287 698 HA THR 97 HA THR 97 2.702 13.189 3.642 699 HB THR 97 HB THR 97 1.261 14.809 2.358 700 HG1 THR 97 HG1 THR 97 -1.048 14.639 3.080 701 HG21 THR 97 HG21 THR 97 1.320 12.386 1.853 702 HG22 THR 97 HG22 THR 97 -0.256 13.104 1.518 703 HG23 THR 97 HG23 THR 97 -0.017 12.141 2.977 704 H THR 98 H THR 98 4.344 14.442 4.136 705 HA THR 98 HA THR 98 4.227 16.551 6.034 706 HB THR 98 HB THR 98 6.381 15.991 3.986 707 HG1 THR 98 HG1 THR 98 7.319 14.759 5.723 708 HG21 THR 98 HG21 THR 98 6.619 18.172 5.056 709 HG22 THR 98 HG22 THR 98 7.876 17.071 5.617 710 HG23 THR 98 HG23 THR 98 6.488 17.423 6.648 711 H GLY 99 H GLY 99 3.995 16.302 2.597 712 HA2 GLY 99 HA2 GLY 99 2.876 17.811 1.217 713 HA3 GLY 99 HA1 GLY 99 2.971 19.009 2.488 714 H THR 100 H THR 100 3.715 20.604 1.148 715 HA THR 100 HA THR 100 5.975 20.332 -0.536 716 HB THR 100 HB THR 100 5.004 22.912 0.679 717 HG1 THR 100 HG1 THR 100 3.652 21.127 -0.928 718 HG21 THR 100 HG21 THR 100 6.152 22.232 -2.013 719 HG22 THR 100 HG22 THR 100 6.994 23.041 -0.690 720 HG23 THR 100 HG23 THR 100 5.632 23.830 -1.479 721 HA PRO 101 HA PRO 101 9.129 19.829 2.565 722 HB2 PRO 101 HB2 PRO 101 10.640 21.335 0.460 723 HB3 PRO 101 HB1 PRO 101 11.121 19.899 1.375 724 HG2 PRO 101 HG2 PRO 101 10.243 19.671 -1.126 725 HG3 PRO 101 HG1 PRO 101 9.786 18.483 0.108 726 HD2 PRO 101 HD2 PRO 101 8.160 20.623 -1.149 727 HD3 PRO 101 HD1 PRO 101 7.651 19.064 -0.472 728 H ARG 102 H ARG 102 8.823 21.094 4.286 729 HA ARG 102 HA ARG 102 8.794 23.970 4.088 730 HB2 ARG 102 HB2 ARG 102 8.434 23.869 6.559 731 HB3 ARG 102 HB1 ARG 102 7.242 22.974 5.628 732 HG2 ARG 102 HG2 ARG 102 8.274 20.889 6.189 733 HG3 ARG 102 HG1 ARG 102 9.634 21.714 6.949 734 HD2 ARG 102 HD2 ARG 102 6.771 21.869 7.882 735 HD3 ARG 102 HD1 ARG 102 8.004 20.821 8.578 736 HE ARG 102 HE ARG 102 8.526 23.695 8.514 737 HH11 ARG 102 HH11 ARG 102 7.638 20.862 10.370 738 HH12 ARG 102 HH12 ARG 102 8.001 21.598 11.897 739 HH21 ARG 102 HH21 ARG 102 9.010 24.666 10.517 740 HH22 ARG 102 HH22 ARG 102 8.789 23.764 11.984 741 H SER 103 H SER 103 10.518 25.212 4.207 742 HA SER 103 HA SER 103 13.087 24.198 4.907 743 HB2 SER 103 HB2 SER 103 12.203 27.076 4.577 744 HB3 SER 103 HB1 SER 103 13.858 26.469 4.518 745 HG SER 103 HG SER 103 12.632 25.032 2.771 746 H ASP 104 H ASP 104 14.310 24.610 6.743 747 HA ASP 104 HA ASP 104 14.676 24.742 8.970 748 HB2 ASP 104 HB2 ASP 104 12.618 26.941 8.748 749 HB3 ASP 104 HB1 ASP 104 13.427 26.540 10.260 750 H GLY 105 H GLY 105 13.257 22.668 8.213 751 HA2 GLY 105 HA2 GLY 105 11.879 21.856 10.534 752 HA3 GLY 105 HA1 GLY 105 10.709 22.262 9.284 753 H THR 106 H THR 106 11.949 21.427 7.015 754 HA THR 106 HA THR 106 12.256 18.535 7.425 755 HB THR 106 HB THR 106 11.645 20.050 4.871 756 HG1 THR 106 HG1 THR 106 9.957 18.478 6.557 757 HG21 THR 106 HG21 THR 106 12.811 17.937 4.462 758 HG22 THR 106 HG22 THR 106 11.128 17.836 3.946 759 HG23 THR 106 HG23 THR 106 11.633 17.087 5.460 Start of MODEL 21 1 H1 GLY 1 HT1 GLY 1 -4.192 -31.558 13.856 2 H2 GLY 1 HT2 GLY 1 -2.851 -32.483 14.298 3 H3 GLY 1 HT3 GLY 1 -4.391 -32.914 14.841 4 HA2 GLY 1 HA1 GLY 1 -3.714 -34.370 13.059 5 HA3 GLY 1 HA2 GLY 1 -5.095 -33.391 12.587 6 H SER 2 H SER 2 -4.440 -33.837 10.386 7 HA SER 2 HA SER 2 -3.483 -33.311 8.399 8 HB2 SER 2 HB2 SER 2 -2.752 -30.726 9.797 9 HB3 SER 2 HB1 SER 2 -2.892 -30.974 8.055 10 HG SER 2 HG SER 2 -5.104 -31.666 9.592 11 H HIS 3 H HIS 3 -1.868 -34.913 9.970 12 HA HIS 3 HA HIS 3 0.796 -33.850 10.136 13 HB2 HIS 3 HB2 HIS 3 -0.265 -36.666 10.401 14 HB3 HIS 3 HB1 HIS 3 1.432 -36.247 10.597 15 HD1 HIS 3 HD1 HIS 3 -0.491 -37.441 12.846 16 HD2 HIS 3 HD2 HIS 3 0.673 -33.471 12.422 17 HE1 HIS 3 HE1 HIS 3 -0.709 -36.423 15.135 18 HE2 HIS 3 HE2 HIS 3 0.185 -34.080 14.885 19 H MET 4 H MET 4 2.333 -33.840 8.649 20 HA MET 4 HA MET 4 3.337 -33.947 6.624 21 HB2 MET 4 HB2 MET 4 3.641 -36.306 7.230 22 HB3 MET 4 HB1 MET 4 2.075 -36.696 6.534 23 HG2 MET 4 HG2 MET 4 3.942 -37.297 5.064 24 HG3 MET 4 HG1 MET 4 2.857 -36.117 4.332 25 HE1 MET 4 HE1 MET 4 5.649 -36.672 3.083 26 HE2 MET 4 HE2 MET 4 6.253 -35.040 2.801 27 HE3 MET 4 HE3 MET 4 4.561 -35.419 2.485 28 H GLY 5 H GLY 5 1.759 -32.260 6.134 29 HA2 GLY 5 HA2 GLY 5 0.736 -32.330 3.602 30 HA3 GLY 5 HA1 GLY 5 -0.590 -32.889 4.615 31 H THR 6 H THR 6 1.899 -30.369 4.740 32 HA THR 6 HA THR 6 0.358 -28.654 6.367 33 HB THR 6 HB THR 6 2.699 -28.387 6.521 34 HG1 THR 6 HG1 THR 6 2.218 -26.119 4.941 35 HG21 THR 6 HG21 THR 6 2.766 -27.854 3.550 36 HG22 THR 6 HG22 THR 6 3.344 -29.314 4.354 37 HG23 THR 6 HG23 THR 6 4.146 -27.771 4.645 38 H THR 7 H THR 7 -1.387 -27.590 5.787 39 HA THR 7 HA THR 7 -1.819 -26.711 3.065 40 HB THR 7 HB THR 7 -3.444 -25.886 5.476 41 HG1 THR 7 HG1 THR 7 -3.291 -28.374 4.160 42 HG21 THR 7 HG21 THR 7 -5.269 -25.811 3.835 43 HG22 THR 7 HG22 THR 7 -4.152 -26.316 2.568 44 HG23 THR 7 HG23 THR 7 -3.939 -24.754 3.360 45 H THR 8 H THR 8 0.166 -25.474 2.990 46 HA THR 8 HA THR 8 0.806 -23.460 4.838 47 HB THR 8 HB THR 8 1.772 -23.733 1.990 48 HG1 THR 8 HG1 THR 8 3.588 -24.734 3.421 49 HG21 THR 8 HG21 THR 8 3.020 -22.403 4.402 50 HG22 THR 8 HG22 THR 8 2.318 -21.570 3.014 51 HG23 THR 8 HG23 THR 8 3.764 -22.560 2.810 52 H ALA 9 H ALA 9 0.050 -21.514 5.102 53 HA ALA 9 HA ALA 9 -1.666 -20.297 3.070 54 HB1 ALA 9 HB1 ALA 9 -2.313 -18.751 4.847 55 HB2 ALA 9 HB2 ALA 9 -1.108 -19.462 5.920 56 HB3 ALA 9 HB3 ALA 9 -2.486 -20.422 5.384 57 HA PRO 10 HA PRO 10 1.535 -17.516 1.820 58 HB2 PRO 10 HB2 PRO 10 0.074 -15.515 0.760 59 HB3 PRO 10 HB1 PRO 10 0.190 -17.103 -0.009 60 HG2 PRO 10 HG2 PRO 10 -1.991 -16.002 1.733 61 HG3 PRO 10 HG1 PRO 10 -2.127 -16.905 0.213 62 HD2 PRO 10 HD2 PRO 10 -2.431 -18.076 2.632 63 HD3 PRO 10 HD1 PRO 10 -1.792 -18.925 1.256 64 H ASP 11 H ASP 11 2.570 -15.618 2.429 65 HA ASP 11 HA ASP 11 1.474 -14.333 4.832 66 HB2 ASP 11 HB2 ASP 11 3.805 -13.889 5.480 67 HB3 ASP 11 HB1 ASP 11 3.522 -15.610 5.265 68 H ALA 12 H ALA 12 1.947 -12.073 5.111 69 HA ALA 12 HA ALA 12 1.984 -10.606 2.570 70 HB1 ALA 12 HB1 ALA 12 1.211 -8.710 3.907 71 HB2 ALA 12 HB2 ALA 12 1.380 -9.666 5.379 72 HB3 ALA 12 HB3 ALA 12 0.186 -10.121 4.164 73 HA PRO 13 HA PRO 13 6.085 -8.982 3.217 74 HB2 PRO 13 HB2 PRO 13 5.106 -6.284 2.529 75 HB3 PRO 13 HB1 PRO 13 6.298 -7.291 1.699 76 HG2 PRO 13 HG2 PRO 13 3.890 -6.882 0.638 77 HG3 PRO 13 HG1 PRO 13 4.675 -8.471 0.528 78 HD2 PRO 13 HD2 PRO 13 2.559 -7.534 2.435 79 HD3 PRO 13 HD1 PRO 13 2.626 -9.045 1.496 80 HA PRO 14 HA PRO 14 6.086 -7.310 7.424 81 HB2 PRO 14 HB2 PRO 14 8.872 -6.735 6.513 82 HB3 PRO 14 HB1 PRO 14 8.318 -7.467 8.023 83 HG2 PRO 14 HG2 PRO 14 9.368 -8.975 6.101 84 HG3 PRO 14 HG1 PRO 14 7.980 -9.546 7.046 85 HD2 PRO 14 HD2 PRO 14 8.078 -8.519 4.250 86 HD3 PRO 14 HD1 PRO 14 7.036 -9.767 4.961 87 H ASP 15 H ASP 15 6.281 -5.249 8.339 88 HA ASP 15 HA ASP 15 4.957 -3.288 7.070 89 HB2 ASP 15 HB2 ASP 15 7.068 -2.915 9.197 90 HB3 ASP 15 HB1 ASP 15 5.930 -1.666 8.709 91 HA PRO 16 HA PRO 16 7.907 -2.027 3.906 92 HB2 PRO 16 HB2 PRO 16 5.523 -0.460 3.086 93 HB3 PRO 16 HB1 PRO 16 6.520 -1.574 2.117 94 HG2 PRO 16 HG2 PRO 16 4.109 -2.311 2.910 95 HG3 PRO 16 HG1 PRO 16 5.454 -3.458 3.007 96 HD2 PRO 16 HD2 PRO 16 4.250 -1.791 5.198 97 HD3 PRO 16 HD1 PRO 16 4.627 -3.533 5.208 98 H THR 17 H THR 17 8.983 -0.186 3.446 99 HA THR 17 HA THR 17 8.638 2.004 5.391 100 HB THR 17 HB THR 17 11.101 1.269 3.794 101 HG1 THR 17 HG1 THR 17 10.806 -0.389 5.223 102 HG21 THR 17 HG21 THR 17 12.266 2.687 5.437 103 HG22 THR 17 HG22 THR 17 10.714 3.099 6.164 104 HG23 THR 17 HG23 THR 17 11.072 3.595 4.510 105 H VAL 18 H VAL 18 8.100 3.870 4.767 106 HA VAL 18 HA VAL 18 7.783 4.522 1.964 107 HB VAL 18 HB VAL 18 7.268 6.147 4.459 108 HG11 VAL 18 HG11 VAL 18 6.650 6.828 1.572 109 HG12 VAL 18 HG12 VAL 18 7.810 7.647 2.626 110 HG13 VAL 18 HG13 VAL 18 6.086 7.726 2.988 111 HG21 VAL 18 HG21 VAL 18 4.924 5.760 3.965 112 HG22 VAL 18 HG22 VAL 18 5.769 4.221 4.141 113 HG23 VAL 18 HG23 VAL 18 5.360 4.826 2.537 114 H ASP 19 H ASP 19 9.217 5.501 0.735 115 HA ASP 19 HA ASP 19 11.774 6.251 1.910 116 HB2 ASP 19 HB2 ASP 19 11.834 4.755 0.007 117 HB3 ASP 19 HB1 ASP 19 10.896 5.888 -0.961 118 H GLN 20 H GLN 20 9.137 7.720 0.104 119 HA GLN 20 HA GLN 20 10.303 10.354 0.657 120 HB2 GLN 20 HB2 GLN 20 9.275 9.366 -1.999 121 HB3 GLN 20 HB1 GLN 20 9.393 11.078 -1.617 122 HG2 GLN 20 HG2 GLN 20 11.812 10.774 -1.209 123 HG3 GLN 20 HG1 GLN 20 11.654 9.097 -1.725 124 HE21 GLN 20 HE21 GLN 20 9.702 9.736 -3.792 125 HE22 GLN 20 HE22 GLN 20 10.568 10.479 -5.059 126 H VAL 21 H VAL 21 8.920 11.818 1.357 127 HA VAL 21 HA VAL 21 6.047 11.262 1.129 128 HB VAL 21 HB VAL 21 7.424 12.315 3.601 129 HG11 VAL 21 HG11 VAL 21 5.223 13.288 3.298 130 HG12 VAL 21 HG12 VAL 21 5.216 12.154 4.648 131 HG13 VAL 21 HG13 VAL 21 4.522 11.682 3.099 132 HG21 VAL 21 HG21 VAL 21 6.093 9.652 3.135 133 HG22 VAL 21 HG22 VAL 21 6.742 10.230 4.670 134 HG23 VAL 21 HG23 VAL 21 7.825 9.932 3.311 135 H ASP 22 H ASP 22 5.150 12.847 0.014 136 HA ASP 22 HA ASP 22 5.959 15.604 0.625 137 HB2 ASP 22 HB2 ASP 22 5.417 14.368 -2.068 138 HB3 ASP 22 HB1 ASP 22 5.259 16.099 -1.809 139 H ASP 23 H ASP 23 3.947 16.772 -1.019 140 HA ASP 23 HA ASP 23 1.757 16.591 0.814 141 HB2 ASP 23 HB2 ASP 23 2.021 18.151 -1.759 142 HB3 ASP 23 HB1 ASP 23 0.727 18.342 -0.598 143 H THR 24 H THR 24 2.027 16.128 -2.700 144 HA THR 24 HA THR 24 -0.450 14.530 -2.607 145 HB THR 24 HB THR 24 -0.660 15.159 -5.037 146 HG1 THR 24 HG1 THR 24 1.408 15.810 -5.549 147 HG21 THR 24 HG21 THR 24 -1.917 16.319 -3.264 148 HG22 THR 24 HG22 THR 24 -1.500 17.406 -4.591 149 HG23 THR 24 HG23 THR 24 -0.587 17.464 -3.083 150 H SER 25 H SER 25 2.101 13.391 -2.062 151 HA SER 25 HA SER 25 2.216 11.237 -3.858 152 HB2 SER 25 HB2 SER 25 4.481 11.607 -4.811 153 HB3 SER 25 HB1 SER 25 3.310 12.798 -5.378 154 HG SER 25 HG SER 25 4.152 14.234 -3.766 155 H ILE 26 H ILE 26 3.016 9.541 -2.799 156 HA ILE 26 HA ILE 26 5.175 9.873 -0.846 157 HB ILE 26 HB ILE 26 2.444 8.797 -0.120 158 HG12 ILE 26 HG12 ILE 26 4.293 10.722 1.295 159 HG13 ILE 26 HG11 ILE 26 2.887 11.176 0.343 160 HG21 ILE 26 HG21 ILE 26 5.029 8.277 1.331 161 HG22 ILE 26 HG22 ILE 26 3.992 7.079 0.551 162 HG23 ILE 26 HG23 ILE 26 3.421 7.948 1.977 163 HD11 ILE 26 HD11 ILE 26 2.927 9.650 2.932 164 HD12 ILE 26 HD12 ILE 26 1.487 9.878 1.941 165 HD13 ILE 26 HD13 ILE 26 2.298 11.277 2.646 166 H VAL 27 H VAL 27 6.473 7.957 -0.709 167 HA VAL 27 HA VAL 27 5.587 5.873 -2.609 168 HB VAL 27 HB VAL 27 8.437 6.678 -2.064 169 HG11 VAL 27 HG11 VAL 27 7.625 4.285 -2.843 170 HG12 VAL 27 HG12 VAL 27 9.076 5.029 -3.528 171 HG13 VAL 27 HG13 VAL 27 7.555 5.081 -4.421 172 HG21 VAL 27 HG21 VAL 27 8.430 7.668 -4.300 173 HG22 VAL 27 HG22 VAL 27 7.260 8.461 -3.246 174 HG23 VAL 27 HG23 VAL 27 6.711 7.305 -4.459 175 H VAL 28 H VAL 28 5.594 3.815 -1.874 176 HA VAL 28 HA VAL 28 6.890 3.376 0.728 177 HB VAL 28 HB VAL 28 5.062 2.499 1.673 178 HG11 VAL 28 HG11 VAL 28 3.606 3.869 -0.538 179 HG12 VAL 28 HG12 VAL 28 4.310 4.657 0.871 180 HG13 VAL 28 HG13 VAL 28 3.003 3.500 1.076 181 HG21 VAL 28 HG21 VAL 28 5.060 0.544 0.251 182 HG22 VAL 28 HG22 VAL 28 4.125 1.436 -0.955 183 HG23 VAL 28 HG23 VAL 28 3.414 1.083 0.620 184 H ARG 29 H ARG 29 7.788 1.333 1.083 185 HA ARG 29 HA ARG 29 8.052 -0.375 -1.313 186 HB2 ARG 29 HB2 ARG 29 10.368 0.222 0.522 187 HB3 ARG 29 HB1 ARG 29 10.406 -0.514 -1.073 188 HG2 ARG 29 HG2 ARG 29 9.727 1.652 -2.049 189 HG3 ARG 29 HG1 ARG 29 9.807 2.367 -0.440 190 HD2 ARG 29 HD2 ARG 29 12.073 1.150 -2.006 191 HD3 ARG 29 HD1 ARG 29 11.845 2.851 -1.607 192 HE ARG 29 HE ARG 29 12.029 1.089 0.675 193 HH11 ARG 29 HH11 ARG 29 13.791 3.105 -1.581 194 HH12 ARG 29 HH12 ARG 29 15.160 3.296 -0.532 195 HH21 ARG 29 HH21 ARG 29 13.828 1.343 2.051 196 HH22 ARG 29 HH22 ARG 29 15.179 2.297 1.530 197 H TRP 30 H TRP 30 7.619 -2.392 -0.921 198 HA TRP 30 HA TRP 30 7.521 -3.273 1.896 199 HB2 TRP 30 HB2 TRP 30 5.742 -4.893 1.126 200 HB3 TRP 30 HB1 TRP 30 5.290 -3.196 1.015 201 HD1 TRP 30 HD1 TRP 30 6.195 -6.160 -1.177 202 HE1 TRP 30 HE1 TRP 30 5.365 -5.723 -3.565 203 HE3 TRP 30 HE3 TRP 30 4.610 -1.383 -0.561 204 HZ2 TRP 30 HZ2 TRP 30 4.127 -3.627 -4.977 205 HZ3 TRP 30 HZ3 TRP 30 3.580 -0.240 -2.474 206 HH2 TRP 30 HH2 TRP 30 3.338 -1.327 -4.620 207 H SER 31 H SER 31 8.312 -5.244 2.492 208 HA SER 31 HA SER 31 10.167 -6.503 0.648 209 HB2 SER 31 HB2 SER 31 9.599 -7.161 3.550 210 HB3 SER 31 HB1 SER 31 10.981 -7.702 2.599 211 HG SER 31 HG SER 31 11.924 -5.847 2.910 212 H ARG 32 H ARG 32 9.048 -7.688 -0.775 213 HA ARG 32 HA ARG 32 6.648 -8.905 -0.594 214 HB2 ARG 32 HB2 ARG 32 8.954 -10.074 -2.134 215 HB3 ARG 32 HB1 ARG 32 7.247 -10.202 -2.514 216 HG2 ARG 32 HG2 ARG 32 7.858 -8.571 -3.986 217 HG3 ARG 32 HG1 ARG 32 7.404 -7.587 -2.592 218 HD2 ARG 32 HD2 ARG 32 9.470 -6.824 -2.288 219 HD3 ARG 32 HD1 ARG 32 10.189 -8.425 -2.534 220 HE ARG 32 HE ARG 32 9.261 -7.226 -4.969 221 HH11 ARG 32 HH11 ARG 32 11.924 -7.347 -2.699 222 HH12 ARG 32 HH12 ARG 32 13.114 -6.888 -3.875 223 HH21 ARG 32 HH21 ARG 32 10.818 -6.628 -6.520 224 HH22 ARG 32 HH22 ARG 32 12.482 -6.458 -6.050 225 HA PRO 33 HA PRO 33 6.811 -12.418 1.963 226 HB2 PRO 33 HB2 PRO 33 4.805 -13.796 0.423 227 HB3 PRO 33 HB1 PRO 33 4.581 -12.820 1.879 228 HG2 PRO 33 HG2 PRO 33 3.632 -12.126 -0.595 229 HG3 PRO 33 HG1 PRO 33 4.036 -10.948 0.677 230 HD2 PRO 33 HD2 PRO 33 5.672 -11.840 -1.665 231 HD3 PRO 33 HD1 PRO 33 5.406 -10.202 -1.054 232 H GLN 34 H GLN 34 6.925 -14.772 2.085 233 HA GLN 34 HA GLN 34 8.681 -15.907 0.094 234 HB2 GLN 34 HB2 GLN 34 9.034 -16.356 2.463 235 HB3 GLN 34 HB1 GLN 34 7.448 -17.102 2.580 236 HG2 GLN 34 HG2 GLN 34 8.188 -18.844 1.005 237 HG3 GLN 34 HG1 GLN 34 9.790 -18.105 0.973 238 HE21 GLN 34 HE21 GLN 34 11.109 -18.262 2.781 239 HE22 GLN 34 HE22 GLN 34 10.800 -19.397 4.049 240 H ALA 35 H ALA 35 5.365 -15.724 0.755 241 HA ALA 35 HA ALA 35 4.368 -18.078 -0.414 242 HB1 ALA 35 HB1 ALA 35 3.121 -16.373 0.984 243 HB2 ALA 35 HB2 ALA 35 2.264 -17.001 -0.422 244 HB3 ALA 35 HB3 ALA 35 3.003 -15.398 -0.484 245 HA PRO 36 HA PRO 36 4.786 -17.054 -4.788 246 HB2 PRO 36 HB2 PRO 36 2.668 -19.019 -5.243 247 HB3 PRO 36 HB1 PRO 36 4.348 -19.060 -5.779 248 HG2 PRO 36 HG2 PRO 36 3.372 -20.733 -3.883 249 HG3 PRO 36 HG1 PRO 36 5.056 -20.180 -3.905 250 HD2 PRO 36 HD2 PRO 36 2.772 -19.236 -2.220 251 HD3 PRO 36 HD1 PRO 36 4.476 -19.479 -1.781 252 H ILE 37 H ILE 37 3.842 -15.225 -5.376 253 HA ILE 37 HA ILE 37 0.947 -14.892 -4.948 254 HB ILE 37 HB ILE 37 1.372 -12.493 -4.565 255 HG12 ILE 37 HG12 ILE 37 4.140 -13.334 -5.238 256 HG13 ILE 37 HG11 ILE 37 3.278 -11.863 -5.653 257 HG21 ILE 37 HG21 ILE 37 1.428 -14.240 -2.661 258 HG22 ILE 37 HG22 ILE 37 2.055 -12.620 -2.317 259 HG23 ILE 37 HG23 ILE 37 3.173 -13.958 -2.640 260 HD11 ILE 37 HD11 ILE 37 3.543 -11.195 -3.232 261 HD12 ILE 37 HD12 ILE 37 5.006 -11.216 -4.218 262 HD13 ILE 37 HD13 ILE 37 4.674 -12.538 -3.101 263 H THR 38 H THR 38 -0.146 -13.591 -6.554 264 HA THR 38 HA THR 38 1.164 -13.809 -9.157 265 HB THR 38 HB THR 38 -1.205 -13.376 -10.017 266 HG1 THR 38 HG1 THR 38 -2.562 -12.901 -8.465 267 HG21 THR 38 HG21 THR 38 -0.113 -15.537 -10.095 268 HG22 THR 38 HG22 THR 38 -1.825 -15.704 -9.725 269 HG23 THR 38 HG23 THR 38 -0.628 -15.869 -8.442 270 H GLY 39 H GLY 39 -0.274 -11.377 -7.051 271 HA2 GLY 39 HA2 GLY 39 1.119 -9.353 -8.515 272 HA3 GLY 39 HA1 GLY 39 -0.625 -9.248 -8.700 273 H TYR 40 H TYR 40 -0.173 -7.105 -7.666 274 HA TYR 40 HA TYR 40 -0.663 -7.415 -4.783 275 HB2 TYR 40 HB2 TYR 40 1.410 -5.698 -6.091 276 HB3 TYR 40 HB1 TYR 40 0.577 -5.089 -4.666 277 HD1 TYR 40 HD1 TYR 40 2.008 -8.408 -5.623 278 HD2 TYR 40 HD2 TYR 40 1.838 -5.263 -2.773 279 HE1 TYR 40 HE1 TYR 40 3.616 -9.601 -4.215 280 HE2 TYR 40 HE2 TYR 40 3.411 -6.472 -1.341 281 HH TYR 40 HH TYR 40 5.183 -9.165 -2.463 282 H ARG 41 H ARG 41 -2.399 -6.303 -4.114 283 HA ARG 41 HA ARG 41 -3.279 -4.005 -5.741 284 HB2 ARG 41 HB2 ARG 41 -4.765 -5.023 -3.357 285 HB3 ARG 41 HB1 ARG 41 -5.369 -4.203 -4.797 286 HG2 ARG 41 HG2 ARG 41 -5.059 -6.175 -6.121 287 HG3 ARG 41 HG1 ARG 41 -4.213 -6.977 -4.786 288 HD2 ARG 41 HD2 ARG 41 -6.536 -7.765 -5.018 289 HD3 ARG 41 HD1 ARG 41 -6.261 -6.966 -3.469 290 HE ARG 41 HE ARG 41 -7.203 -5.001 -5.162 291 HH11 ARG 41 HH11 ARG 41 -8.373 -8.068 -3.928 292 HH12 ARG 41 HH12 ARG 41 -10.043 -7.604 -4.024 293 HH21 ARG 41 HH21 ARG 41 -9.366 -4.387 -5.273 294 HH22 ARG 41 HH22 ARG 41 -10.610 -5.496 -4.785 295 H ILE 42 H ILE 42 -3.607 -1.990 -4.700 296 HA ILE 42 HA ILE 42 -2.408 -1.758 -2.022 297 HB ILE 42 HB ILE 42 -1.668 0.056 -4.297 298 HG12 ILE 42 HG12 ILE 42 0.048 -2.075 -3.061 299 HG13 ILE 42 HG11 ILE 42 -0.858 -2.307 -4.547 300 HG21 ILE 42 HG21 ILE 42 -0.046 0.984 -2.818 301 HG22 ILE 42 HG22 ILE 42 -0.340 -0.270 -1.616 302 HG23 ILE 42 HG23 ILE 42 -1.575 0.943 -1.942 303 HD11 ILE 42 HD11 ILE 42 1.448 -1.786 -5.004 304 HD12 ILE 42 HD12 ILE 42 1.306 -0.289 -4.089 305 HD13 ILE 42 HD13 ILE 42 0.395 -0.496 -5.583 306 H VAL 43 H VAL 43 -4.026 -0.937 -0.814 307 HA VAL 43 HA VAL 43 -5.549 1.277 -2.033 308 HB VAL 43 HB VAL 43 -6.369 -0.512 0.261 309 HG11 VAL 43 HG11 VAL 43 -8.469 0.761 0.239 310 HG12 VAL 43 HG12 VAL 43 -7.732 1.911 -0.877 311 HG13 VAL 43 HG13 VAL 43 -7.081 1.713 0.748 312 HG21 VAL 43 HG21 VAL 43 -6.634 -1.487 -1.987 313 HG22 VAL 43 HG22 VAL 43 -7.606 -0.089 -2.450 314 HG23 VAL 43 HG23 VAL 43 -8.182 -1.187 -1.197 315 H TYR 44 H TYR 44 -4.691 3.111 -1.507 316 HA TYR 44 HA TYR 44 -3.898 3.535 1.270 317 HB2 TYR 44 HB2 TYR 44 -2.728 5.626 0.195 318 HB3 TYR 44 HB1 TYR 44 -1.952 4.051 0.143 319 HD1 TYR 44 HD1 TYR 44 -2.399 2.641 -1.996 320 HD2 TYR 44 HD2 TYR 44 -2.957 6.847 -1.779 321 HE1 TYR 44 HE1 TYR 44 -2.186 2.769 -4.425 322 HE2 TYR 44 HE2 TYR 44 -2.746 7.001 -4.221 323 HH TYR 44 HH TYR 44 -1.802 5.753 -6.069 324 H SER 45 H SER 45 -4.990 4.770 2.435 325 HA SER 45 HA SER 45 -6.813 6.736 1.268 326 HB2 SER 45 HB2 SER 45 -7.741 4.618 3.221 327 HB3 SER 45 HB1 SER 45 -8.732 5.856 2.451 328 HG SER 45 HG SER 45 -7.450 4.509 0.551 329 HA PRO 46 HA PRO 46 -5.426 8.967 4.900 330 HB2 PRO 46 HB2 PRO 46 -7.026 11.113 4.557 331 HB3 PRO 46 HB1 PRO 46 -5.589 10.830 3.569 332 HG2 PRO 46 HG2 PRO 46 -8.460 10.337 2.921 333 HG3 PRO 46 HG1 PRO 46 -7.173 10.991 1.893 334 HD2 PRO 46 HD2 PRO 46 -8.037 8.404 1.784 335 HD3 PRO 46 HD1 PRO 46 -6.396 8.915 1.340 336 H SER 47 H SER 47 -6.068 8.730 6.941 337 HA SER 47 HA SER 47 -8.525 7.550 7.631 338 HB2 SER 47 HB2 SER 47 -6.504 7.286 8.997 339 HB3 SER 47 HB1 SER 47 -6.544 9.000 9.405 340 HG SER 47 HG SER 47 -8.844 8.337 10.134 341 H VAL 48 H VAL 48 -7.611 10.868 7.255 342 HA VAL 48 HA VAL 48 -10.070 11.763 8.567 343 HB VAL 48 HB VAL 48 -9.157 14.061 8.164 344 HG11 VAL 48 HG11 VAL 48 -8.957 12.971 10.333 345 HG12 VAL 48 HG12 VAL 48 -7.519 13.933 9.993 346 HG13 VAL 48 HG13 VAL 48 -7.470 12.180 9.811 347 HG21 VAL 48 HG21 VAL 48 -6.676 12.534 7.404 348 HG22 VAL 48 HG22 VAL 48 -6.767 14.274 7.675 349 HG23 VAL 48 HG23 VAL 48 -7.646 13.544 6.333 350 H GLU 49 H GLU 49 -9.602 10.472 5.851 351 HA GLU 49 HA GLU 49 -10.767 10.370 3.917 352 HB2 GLU 49 HB2 GLU 49 -12.655 11.336 5.273 353 HB3 GLU 49 HB1 GLU 49 -12.163 12.925 4.703 354 HG2 GLU 49 HG2 GLU 49 -12.563 12.221 2.400 355 HG3 GLU 49 HG1 GLU 49 -13.055 10.629 2.973 356 H GLY 50 H GLY 50 -10.753 11.259 1.792 357 HA2 GLY 50 HA2 GLY 50 -9.883 13.578 0.780 358 HA3 GLY 50 HA1 GLY 50 -8.383 12.880 1.383 359 H SER 51 H SER 51 -7.291 12.134 -0.360 360 HA SER 51 HA SER 51 -8.785 10.882 -2.528 361 HB2 SER 51 HB2 SER 51 -5.812 11.454 -2.310 362 HB3 SER 51 HB1 SER 51 -6.690 10.974 -3.766 363 HG SER 51 HG SER 51 -6.278 13.267 -3.562 364 H SER 52 H SER 52 -9.126 8.752 -2.508 365 HA SER 52 HA SER 52 -7.075 7.031 -1.271 366 HB2 SER 52 HB2 SER 52 -10.020 6.383 -1.595 367 HB3 SER 52 HB1 SER 52 -8.814 5.433 -0.720 368 HG SER 52 HG SER 52 -10.105 7.805 0.005 369 H THR 53 H THR 53 -6.292 5.339 -2.459 370 HA THR 53 HA THR 53 -7.481 4.866 -5.095 371 HB THR 53 HB THR 53 -4.571 5.628 -4.796 372 HG1 THR 53 HG1 THR 53 -6.876 7.129 -5.353 373 HG21 THR 53 HG21 THR 53 -4.611 5.758 -7.244 374 HG22 THR 53 HG22 THR 53 -6.284 5.202 -7.244 375 HG23 THR 53 HG23 THR 53 -4.999 4.136 -6.673 376 H GLU 54 H GLU 54 -6.849 2.914 -6.070 377 HA GLU 54 HA GLU 54 -5.273 1.081 -4.422 378 HB2 GLU 54 HB2 GLU 54 -7.719 0.540 -4.499 379 HB3 GLU 54 HB1 GLU 54 -7.577 0.349 -6.239 380 HG2 GLU 54 HG2 GLU 54 -5.938 -1.463 -5.868 381 HG3 GLU 54 HG1 GLU 54 -6.199 -1.302 -4.133 382 H LEU 55 H LEU 55 -3.359 0.793 -5.413 383 HA LEU 55 HA LEU 55 -3.327 0.780 -8.344 384 HB2 LEU 55 HB2 LEU 55 -1.012 0.991 -6.381 385 HB3 LEU 55 HB1 LEU 55 -0.823 0.803 -8.123 386 HG LEU 55 HG LEU 55 -1.972 3.117 -6.618 387 HD11 LEU 55 HD11 LEU 55 0.321 3.384 -6.825 388 HD12 LEU 55 HD12 LEU 55 -0.338 4.325 -8.163 389 HD13 LEU 55 HD13 LEU 55 0.349 2.727 -8.461 390 HD21 LEU 55 HD21 LEU 55 -2.214 2.555 -9.566 391 HD22 LEU 55 HD22 LEU 55 -2.502 4.129 -8.823 392 HD23 LEU 55 HD23 LEU 55 -3.526 2.757 -8.403 393 H ASN 56 H ASN 56 -1.952 -0.866 -9.411 394 HA ASN 56 HA ASN 56 -2.019 -3.413 -7.952 395 HB2 ASN 56 HB2 ASN 56 -2.973 -2.903 -10.773 396 HB3 ASN 56 HB1 ASN 56 -2.667 -4.509 -10.127 397 HD21 ASN 56 HD21 ASN 56 -4.029 -5.353 -8.568 398 HD22 ASN 56 HD22 ASN 56 -5.597 -4.693 -8.268 399 H LEU 57 H LEU 57 -0.047 -4.190 -7.817 400 HA LEU 57 HA LEU 57 1.895 -3.357 -9.865 401 HB2 LEU 57 HB2 LEU 57 2.286 -3.876 -6.900 402 HB3 LEU 57 HB1 LEU 57 3.610 -3.745 -8.035 403 HG LEU 57 HG LEU 57 1.887 -1.646 -6.872 404 HD11 LEU 57 HD11 LEU 57 3.976 -0.417 -6.896 405 HD12 LEU 57 HD12 LEU 57 4.743 -1.718 -7.808 406 HD13 LEU 57 HD13 LEU 57 4.188 -2.005 -6.162 407 HD21 LEU 57 HD21 LEU 57 1.324 -1.435 -9.222 408 HD22 LEU 57 HD22 LEU 57 3.039 -1.403 -9.637 409 HD23 LEU 57 HD23 LEU 57 2.337 -0.097 -8.682 410 HA PRO 58 HA PRO 58 2.626 -7.601 -10.744 411 HB2 PRO 58 HB2 PRO 58 5.380 -7.594 -10.972 412 HB3 PRO 58 HB1 PRO 58 4.262 -7.136 -12.256 413 HG2 PRO 58 HG2 PRO 58 5.872 -5.424 -10.447 414 HG3 PRO 58 HG1 PRO 58 5.382 -5.143 -12.124 415 HD2 PRO 58 HD2 PRO 58 4.210 -3.929 -9.976 416 HD3 PRO 58 HD1 PRO 58 3.371 -4.225 -11.506 417 H GLU 59 H GLU 59 3.192 -9.457 -9.744 418 HA GLU 59 HA GLU 59 3.357 -9.744 -7.040 419 HB2 GLU 59 HB2 GLU 59 4.199 -12.025 -7.463 420 HB3 GLU 59 HB1 GLU 59 2.873 -11.592 -8.535 421 HG2 GLU 59 HG2 GLU 59 4.394 -11.204 -10.350 422 HG3 GLU 59 HG1 GLU 59 5.781 -11.441 -9.291 423 H THR 60 H THR 60 5.927 -8.867 -9.123 424 HA THR 60 HA THR 60 7.976 -9.584 -7.164 425 HB THR 60 HB THR 60 8.434 -10.390 -9.380 426 HG1 THR 60 HG1 THR 60 10.330 -9.768 -8.492 427 HG21 THR 60 HG21 THR 60 8.067 -7.536 -10.278 428 HG22 THR 60 HG22 THR 60 7.054 -8.923 -10.689 429 HG23 THR 60 HG23 THR 60 8.709 -8.830 -11.290 430 H ALA 61 H ALA 61 6.020 -7.049 -7.630 431 HA ALA 61 HA ALA 61 7.919 -4.880 -7.759 432 HB1 ALA 61 HB1 ALA 61 4.975 -4.907 -7.110 433 HB2 ALA 61 HB2 ALA 61 5.709 -4.550 -8.674 434 HB3 ALA 61 HB3 ALA 61 5.948 -3.450 -7.317 435 H ASN 62 H ASN 62 8.113 -3.267 -6.030 436 HA ASN 62 HA ASN 62 7.531 -4.273 -3.362 437 HB2 ASN 62 HB2 ASN 62 9.807 -4.072 -2.577 438 HB3 ASN 62 HB1 ASN 62 9.743 -5.206 -3.917 439 HD21 ASN 62 HD21 ASN 62 11.953 -3.611 -2.819 440 HD22 ASN 62 HD22 ASN 62 12.584 -2.713 -4.157 441 H SER 63 H SER 63 6.936 -1.830 -5.182 442 HA SER 63 HA SER 63 6.902 0.026 -3.027 443 HB2 SER 63 HB2 SER 63 8.392 1.746 -4.162 444 HB3 SER 63 HB1 SER 63 9.226 0.358 -3.464 445 HG SER 63 HG SER 63 8.625 -0.301 -5.939 446 H VAL 64 H VAL 64 5.326 1.477 -3.332 447 HA VAL 64 HA VAL 64 4.367 1.947 -6.086 448 HB VAL 64 HB VAL 64 2.590 0.768 -4.947 449 HG11 VAL 64 HG11 VAL 64 3.559 1.683 -2.656 450 HG12 VAL 64 HG12 VAL 64 1.933 1.052 -2.844 451 HG13 VAL 64 HG13 VAL 64 2.205 2.795 -2.865 452 HG21 VAL 64 HG21 VAL 64 1.982 3.681 -5.045 453 HG22 VAL 64 HG22 VAL 64 0.813 2.359 -5.036 454 HG23 VAL 64 HG23 VAL 64 1.928 2.538 -6.387 455 H THR 65 H THR 65 4.248 4.020 -6.761 456 HA THR 65 HA THR 65 4.773 6.161 -4.865 457 HB THR 65 HB THR 65 4.630 6.014 -7.864 458 HG1 THR 65 HG1 THR 65 6.509 5.110 -7.085 459 HG21 THR 65 HG21 THR 65 5.514 8.336 -7.858 460 HG22 THR 65 HG22 THR 65 5.309 8.391 -6.108 461 HG23 THR 65 HG23 THR 65 3.900 8.237 -7.157 462 H LEU 66 H LEU 66 2.926 6.630 -3.835 463 HA LEU 66 HA LEU 66 0.341 6.651 -5.106 464 HB2 LEU 66 HB2 LEU 66 0.620 8.010 -2.541 465 HB3 LEU 66 HB1 LEU 66 -0.496 6.751 -3.025 466 HG LEU 66 HG LEU 66 2.361 6.108 -2.407 467 HD11 LEU 66 HD11 LEU 66 1.189 7.377 -0.562 468 HD12 LEU 66 HD12 LEU 66 1.916 5.824 -0.184 469 HD13 LEU 66 HD13 LEU 66 0.169 5.947 -0.405 470 HD21 LEU 66 HD21 LEU 66 1.099 4.407 -3.566 471 HD22 LEU 66 HD22 LEU 66 -0.219 4.568 -2.405 472 HD23 LEU 66 HD23 LEU 66 1.341 3.917 -1.885 473 H SER 67 H SER 67 -0.858 8.472 -5.642 474 HA SER 67 HA SER 67 0.582 11.027 -5.556 475 HB2 SER 67 HB2 SER 67 1.000 9.887 -7.747 476 HB3 SER 67 HB1 SER 67 -0.739 9.915 -8.042 477 HG SER 67 HG SER 67 -0.260 11.768 -8.931 478 H ASP 68 H ASP 68 -0.863 12.823 -6.331 479 HA ASP 68 HA ASP 68 -2.623 14.169 -5.904 480 HB2 ASP 68 HB2 ASP 68 -3.995 11.636 -6.695 481 HB3 ASP 68 HB1 ASP 68 -4.951 12.986 -6.095 482 H LEU 69 H LEU 69 -1.371 12.796 -3.652 483 HA LEU 69 HA LEU 69 -3.373 12.242 -1.713 484 HB2 LEU 69 HB2 LEU 69 -0.682 13.352 -0.980 485 HB3 LEU 69 HB1 LEU 69 -1.702 12.235 -0.094 486 HG LEU 69 HG LEU 69 -0.162 11.540 -2.582 487 HD11 LEU 69 HD11 LEU 69 1.258 11.985 -0.658 488 HD12 LEU 69 HD12 LEU 69 1.222 10.264 -1.045 489 HD13 LEU 69 HD13 LEU 69 0.289 10.883 0.318 490 HD21 LEU 69 HD21 LEU 69 -2.011 10.098 -2.525 491 HD22 LEU 69 HD22 LEU 69 -2.056 10.111 -0.761 492 HD23 LEU 69 HD23 LEU 69 -0.793 9.202 -1.601 493 H GLN 70 H GLN 70 -3.033 13.771 0.440 494 HA GLN 70 HA GLN 70 -3.462 16.527 -0.466 495 HB2 GLN 70 HB2 GLN 70 -5.618 15.475 0.042 496 HB3 GLN 70 HB1 GLN 70 -5.047 15.062 1.654 497 HG2 GLN 70 HG2 GLN 70 -4.791 17.466 2.136 498 HG3 GLN 70 HG1 GLN 70 -5.463 17.828 0.548 499 HE21 GLN 70 HE21 GLN 70 -7.396 15.649 0.654 500 HE22 GLN 70 HE22 GLN 70 -8.624 16.157 1.763 501 HA PRO 71 HA PRO 71 -0.109 17.212 2.349 502 HB2 PRO 71 HB2 PRO 71 -0.329 19.934 2.471 503 HB3 PRO 71 HB1 PRO 71 0.473 19.040 1.173 504 HG2 PRO 71 HG2 PRO 71 -2.278 20.217 1.256 505 HG3 PRO 71 HG1 PRO 71 -1.108 20.192 -0.077 506 HD2 PRO 71 HD2 PRO 71 -3.208 18.502 0.029 507 HD3 PRO 71 HD1 PRO 71 -1.649 18.030 -0.675 508 H GLY 72 H GLY 72 -0.023 17.041 4.478 509 HA2 GLY 72 HA2 GLY 72 -0.393 17.660 6.705 510 HA3 GLY 72 HA1 GLY 72 -1.743 18.658 6.182 511 H VAL 73 H VAL 73 -1.464 15.405 5.058 512 HA VAL 73 HA VAL 73 -3.732 14.647 6.775 513 HB VAL 73 HB VAL 73 -3.484 14.247 3.794 514 HG11 VAL 73 HG11 VAL 73 -5.853 13.363 4.114 515 HG12 VAL 73 HG12 VAL 73 -5.365 13.065 5.786 516 HG13 VAL 73 HG13 VAL 73 -4.501 12.279 4.460 517 HG21 VAL 73 HG21 VAL 73 -4.343 16.370 4.065 518 HG22 VAL 73 HG22 VAL 73 -5.226 15.928 5.529 519 HG23 VAL 73 HG23 VAL 73 -5.787 15.354 3.955 520 H GLN 74 H GLN 74 -3.909 12.505 7.335 521 HA GLN 74 HA GLN 74 -1.413 11.045 7.323 522 HB2 GLN 74 HB2 GLN 74 -2.637 11.453 9.388 523 HB3 GLN 74 HB1 GLN 74 -4.054 10.674 8.707 524 HG2 GLN 74 HG2 GLN 74 -3.183 9.007 10.037 525 HG3 GLN 74 HG1 GLN 74 -2.463 8.626 8.475 526 HE21 GLN 74 HE21 GLN 74 -0.251 8.953 8.166 527 HE22 GLN 74 HE22 GLN 74 0.825 9.249 9.486 528 H TYR 75 H TYR 75 -1.122 9.789 5.549 529 HA TYR 75 HA TYR 75 -3.459 8.492 4.377 530 HB2 TYR 75 HB2 TYR 75 -0.793 9.297 3.333 531 HB3 TYR 75 HB1 TYR 75 -1.581 7.899 2.596 532 HD1 TYR 75 HD1 TYR 75 -2.047 11.499 3.380 533 HD2 TYR 75 HD2 TYR 75 -3.366 8.161 1.104 534 HE1 TYR 75 HE1 TYR 75 -3.509 12.976 2.065 535 HE2 TYR 75 HE2 TYR 75 -4.821 9.629 -0.219 536 HH TYR 75 HH TYR 75 -4.621 13.004 -0.152 537 H ASN 76 H ASN 76 -3.924 6.535 4.921 538 HA ASN 76 HA ASN 76 -1.907 4.764 6.051 539 HB2 ASN 76 HB2 ASN 76 -4.860 4.269 5.596 540 HB3 ASN 76 HB1 ASN 76 -3.778 3.320 6.610 541 HD21 ASN 76 HD21 ASN 76 -3.221 4.076 8.634 542 HD22 ASN 76 HD22 ASN 76 -4.003 5.432 9.373 543 H ILE 77 H ILE 77 -0.677 3.781 4.548 544 HA ILE 77 HA ILE 77 -1.846 2.964 2.003 545 HB ILE 77 HB ILE 77 1.010 2.749 2.968 546 HG12 ILE 77 HG12 ILE 77 1.227 4.423 0.977 547 HG13 ILE 77 HG11 ILE 77 -0.429 4.813 1.362 548 HG21 ILE 77 HG21 ILE 77 1.003 1.123 1.369 549 HG22 ILE 77 HG22 ILE 77 1.288 2.559 0.365 550 HG23 ILE 77 HG23 ILE 77 -0.331 1.870 0.478 551 HD11 ILE 77 HD11 ILE 77 1.901 4.982 3.256 552 HD12 ILE 77 HD12 ILE 77 0.227 5.381 3.641 553 HD13 ILE 77 HD13 ILE 77 1.109 6.337 2.450 554 H THR 78 H THR 78 -2.763 1.096 1.854 555 HA THR 78 HA THR 78 -1.893 -1.062 3.622 556 HB THR 78 HB THR 78 -4.472 -0.731 2.103 557 HG1 THR 78 HG1 THR 78 -3.974 0.785 3.913 558 HG21 THR 78 HG21 THR 78 -5.286 -2.519 3.601 559 HG22 THR 78 HG22 THR 78 -3.671 -2.652 4.300 560 HG23 THR 78 HG23 THR 78 -3.936 -3.069 2.607 561 H ILE 79 H ILE 79 -0.624 -2.541 2.673 562 HA ILE 79 HA ILE 79 -0.738 -2.812 -0.269 563 HB ILE 79 HB ILE 79 1.292 -4.222 1.473 564 HG12 ILE 79 HG12 ILE 79 1.830 -1.944 1.915 565 HG13 ILE 79 HG11 ILE 79 2.932 -2.515 0.662 566 HG21 ILE 79 HG21 ILE 79 1.217 -5.164 -0.663 567 HG22 ILE 79 HG22 ILE 79 2.609 -4.067 -0.659 568 HG23 ILE 79 HG23 ILE 79 1.101 -3.579 -1.437 569 HD11 ILE 79 HD11 ILE 79 0.458 -1.051 -0.088 570 HD12 ILE 79 HD12 ILE 79 1.994 -1.215 -0.959 571 HD13 ILE 79 HD13 ILE 79 1.882 -0.189 0.483 572 H TYR 80 H TYR 80 -1.174 -4.749 -1.262 573 HA TYR 80 HA TYR 80 -2.042 -6.981 0.446 574 HB2 TYR 80 HB2 TYR 80 -3.404 -6.030 -2.085 575 HB3 TYR 80 HB1 TYR 80 -3.903 -7.385 -1.085 576 HD1 TYR 80 HD1 TYR 80 -4.877 -6.955 1.157 577 HD2 TYR 80 HD2 TYR 80 -4.065 -3.781 -1.572 578 HE1 TYR 80 HE1 TYR 80 -6.425 -5.507 2.392 579 HE2 TYR 80 HE2 TYR 80 -5.608 -2.330 -0.332 580 HH TYR 80 HH TYR 80 -6.826 -3.114 2.740 581 H ALA 81 H ALA 81 -0.531 -8.538 0.006 582 HA ALA 81 HA ALA 81 0.421 -9.013 -2.685 583 HB1 ALA 81 HB1 ALA 81 0.679 -10.624 -0.119 584 HB2 ALA 81 HB2 ALA 81 1.920 -9.644 -0.900 585 HB3 ALA 81 HB3 ALA 81 1.366 -11.141 -1.671 586 H VAL 82 H VAL 82 -0.709 -10.102 -4.178 587 HA VAL 82 HA VAL 82 -2.951 -11.760 -3.180 588 HB VAL 82 HB VAL 82 -3.873 -9.894 -4.396 589 HG11 VAL 82 HG11 VAL 82 -3.446 -9.495 -6.752 590 HG12 VAL 82 HG12 VAL 82 -2.209 -10.752 -6.735 591 HG13 VAL 82 HG13 VAL 82 -1.990 -9.285 -5.780 592 HG21 VAL 82 HG21 VAL 82 -4.007 -12.366 -6.109 593 HG22 VAL 82 HG22 VAL 82 -5.195 -11.058 -6.060 594 HG23 VAL 82 HG23 VAL 82 -4.961 -12.088 -4.648 595 H GLU 83 H GLU 83 -3.166 -13.806 -3.857 596 HA GLU 83 HA GLU 83 -1.073 -14.813 -5.658 597 HB2 GLU 83 HB2 GLU 83 -2.529 -16.527 -3.653 598 HB3 GLU 83 HB1 GLU 83 -1.013 -16.818 -4.482 599 HG2 GLU 83 HG2 GLU 83 -0.450 -16.408 -2.273 600 HG3 GLU 83 HG1 GLU 83 -0.017 -14.992 -3.205 601 H GLU 84 H GLU 84 -1.852 -16.996 -6.648 602 HA GLU 84 HA GLU 84 -3.513 -16.473 -8.684 603 HB2 GLU 84 HB2 GLU 84 -3.178 -19.139 -7.319 604 HB3 GLU 84 HB1 GLU 84 -3.893 -18.923 -8.910 605 HG2 GLU 84 HG2 GLU 84 -1.777 -17.933 -9.697 606 HG3 GLU 84 HG1 GLU 84 -1.076 -18.240 -8.108 607 H ASN 85 H ASN 85 -4.696 -18.165 -5.742 608 HA ASN 85 HA ASN 85 -7.403 -17.311 -6.558 609 HB2 ASN 85 HB2 ASN 85 -6.527 -19.980 -5.461 610 HB3 ASN 85 HB1 ASN 85 -8.207 -19.461 -5.456 611 HD21 ASN 85 HD21 ASN 85 -6.848 -21.679 -6.840 612 HD22 ASN 85 HD22 ASN 85 -7.216 -21.472 -8.515 613 H GLN 86 H GLN 86 -5.230 -16.522 -4.388 614 HA GLN 86 HA GLN 86 -7.174 -16.191 -2.254 615 HB2 GLN 86 HB2 GLN 86 -5.471 -16.993 -0.612 616 HB3 GLN 86 HB1 GLN 86 -6.070 -18.221 -1.717 617 HG2 GLN 86 HG2 GLN 86 -4.054 -17.908 -3.105 618 HG3 GLN 86 HG1 GLN 86 -3.430 -16.819 -1.869 619 HE21 GLN 86 HE21 GLN 86 -5.299 -19.635 -1.045 620 HE22 GLN 86 HE22 GLN 86 -3.999 -20.540 -0.372 621 H GLU 87 H GLU 87 -6.026 -14.856 -0.421 622 HA GLU 87 HA GLU 87 -4.182 -12.884 -1.556 623 HB2 GLU 87 HB2 GLU 87 -6.703 -12.160 -0.044 624 HB3 GLU 87 HB1 GLU 87 -5.476 -11.034 -0.597 625 HG2 GLU 87 HG2 GLU 87 -5.996 -11.625 -2.917 626 HG3 GLU 87 HG1 GLU 87 -7.253 -12.720 -2.343 627 H SER 88 H SER 88 -2.638 -12.250 -0.153 628 HA SER 88 HA SER 88 -2.493 -13.529 2.413 629 HB2 SER 88 HB2 SER 88 -0.689 -11.445 1.165 630 HB3 SER 88 HB1 SER 88 -0.315 -12.406 2.596 631 HG SER 88 HG SER 88 -0.773 -13.391 -0.043 632 H THR 89 H THR 89 -1.665 -12.064 4.311 633 HA THR 89 HA THR 89 -3.788 -10.418 5.128 634 HB THR 89 HB THR 89 -1.919 -9.683 6.874 635 HG1 THR 89 HG1 THR 89 -0.158 -10.898 6.849 636 HG21 THR 89 HG21 THR 89 -3.886 -11.015 7.411 637 HG22 THR 89 HG22 THR 89 -2.454 -11.694 8.185 638 HG23 THR 89 HG23 THR 89 -3.117 -12.450 6.738 639 HA PRO 90 HA PRO 90 -2.557 -6.490 3.570 640 HB2 PRO 90 HB2 PRO 90 -3.849 -4.814 5.203 641 HB3 PRO 90 HB1 PRO 90 -4.715 -5.931 4.141 642 HG2 PRO 90 HG2 PRO 90 -4.235 -6.091 7.073 643 HG3 PRO 90 HG1 PRO 90 -5.638 -6.622 6.130 644 HD2 PRO 90 HD2 PRO 90 -3.544 -8.232 7.069 645 HD3 PRO 90 HD1 PRO 90 -4.766 -8.689 5.868 646 H VAL 91 H VAL 91 -0.888 -5.176 3.619 647 HA VAL 91 HA VAL 91 0.680 -4.545 5.977 648 HB VAL 91 HB VAL 91 0.668 -3.595 3.121 649 HG11 VAL 91 HG11 VAL 91 1.069 -1.659 4.541 650 HG12 VAL 91 HG12 VAL 91 2.527 -2.112 3.671 651 HG13 VAL 91 HG13 VAL 91 2.359 -2.523 5.373 652 HG21 VAL 91 HG21 VAL 91 2.901 -4.493 3.042 653 HG22 VAL 91 HG22 VAL 91 1.774 -5.737 3.595 654 HG23 VAL 91 HG23 VAL 91 2.824 -4.915 4.754 655 H VAL 92 H VAL 92 0.084 -2.874 7.349 656 HA VAL 92 HA VAL 92 -1.378 -0.652 6.086 657 HB VAL 92 HB VAL 92 -1.657 -1.273 9.015 658 HG11 VAL 92 HG11 VAL 92 -3.715 0.046 8.758 659 HG12 VAL 92 HG12 VAL 92 -3.341 0.269 7.047 660 HG13 VAL 92 HG13 VAL 92 -2.278 0.952 8.279 661 HG21 VAL 92 HG21 VAL 92 -3.442 -2.290 6.802 662 HG22 VAL 92 HG22 VAL 92 -3.779 -2.403 8.529 663 HG23 VAL 92 HG23 VAL 92 -2.409 -3.274 7.839 664 H ILE 93 H ILE 93 0.135 0.841 5.787 665 HA ILE 93 HA ILE 93 1.799 1.581 8.095 666 HB ILE 93 HB ILE 93 3.476 2.452 6.360 667 HG12 ILE 93 HG12 ILE 93 2.253 0.387 4.563 668 HG13 ILE 93 HG11 ILE 93 1.783 2.065 4.465 669 HG21 ILE 93 HG21 ILE 93 4.554 0.250 6.157 670 HG22 ILE 93 HG22 ILE 93 3.059 -0.513 6.701 671 HG23 ILE 93 HG23 ILE 93 3.947 0.559 7.784 672 HD11 ILE 93 HD11 ILE 93 4.518 0.932 4.045 673 HD12 ILE 93 HD12 ILE 93 4.164 2.660 4.132 674 HD13 ILE 93 HD13 ILE 93 3.460 1.669 2.837 675 H GLN 94 H GLN 94 1.154 3.472 8.858 676 HA GLN 94 HA GLN 94 -0.225 5.304 7.056 677 HB2 GLN 94 HB2 GLN 94 -0.838 6.517 9.159 678 HB3 GLN 94 HB1 GLN 94 -1.443 4.872 9.050 679 HG2 GLN 94 HG2 GLN 94 0.264 4.094 10.561 680 HG3 GLN 94 HG1 GLN 94 1.018 5.686 10.581 681 HE21 GLN 94 HE21 GLN 94 -1.660 3.768 11.672 682 HE22 GLN 94 HE22 GLN 94 -2.231 4.878 12.865 683 H GLN 95 H GLN 95 0.817 6.873 6.136 684 HA GLN 95 HA GLN 95 2.966 8.221 7.625 685 HB2 GLN 95 HB2 GLN 95 3.157 6.868 5.142 686 HB3 GLN 95 HB1 GLN 95 3.258 8.585 4.791 687 HG2 GLN 95 HG2 GLN 95 5.004 7.033 6.687 688 HG3 GLN 95 HG1 GLN 95 5.462 7.657 5.106 689 HE21 GLN 95 HE21 GLN 95 3.995 10.180 5.557 690 HE22 GLN 95 HE22 GLN 95 4.982 11.094 6.641 691 H GLU 96 H GLU 96 2.563 10.304 7.973 692 HA GLU 96 HA GLU 96 0.291 11.529 6.634 693 HB2 GLU 96 HB2 GLU 96 0.367 11.735 9.028 694 HB3 GLU 96 HB1 GLU 96 1.986 12.412 8.973 695 HG2 GLU 96 HG2 GLU 96 1.137 14.415 7.920 696 HG3 GLU 96 HG1 GLU 96 -0.483 13.718 7.850 697 H THR 97 H THR 97 0.422 12.979 5.122 698 HA THR 97 HA THR 97 2.770 13.354 3.658 699 HB THR 97 HB THR 97 1.430 15.084 2.433 700 HG1 THR 97 HG1 THR 97 -0.953 14.677 3.418 701 HG21 THR 97 HG21 THR 97 -0.080 12.528 2.993 702 HG22 THR 97 HG22 THR 97 1.315 12.641 1.921 703 HG23 THR 97 HG23 THR 97 -0.170 13.514 1.532 704 H THR 98 H THR 98 4.087 15.132 3.357 705 HA THR 98 HA THR 98 4.865 16.352 5.788 706 HB THR 98 HB THR 98 5.800 17.061 3.004 707 HG1 THR 98 HG1 THR 98 6.932 15.234 2.980 708 HG21 THR 98 HG21 THR 98 6.602 18.548 4.783 709 HG22 THR 98 HG22 THR 98 7.918 17.578 4.125 710 HG23 THR 98 HG23 THR 98 7.205 17.154 5.680 711 H GLY 99 H GLY 99 3.085 17.495 2.973 712 HA2 GLY 99 HA2 GLY 99 1.879 19.417 2.629 713 HA3 GLY 99 HA1 GLY 99 1.804 19.565 4.366 714 H THR 100 H THR 100 3.799 20.161 1.581 715 HA THR 100 HA THR 100 5.791 21.704 2.857 716 HB THR 100 HB THR 100 5.030 21.955 -0.043 717 HG1 THR 100 HG1 THR 100 5.074 19.703 0.523 718 HG21 THR 100 HG21 THR 100 7.684 21.967 1.367 719 HG22 THR 100 HG22 THR 100 6.812 23.381 0.777 720 HG23 THR 100 HG23 THR 100 7.415 22.183 -0.362 721 HA PRO 101 HA PRO 101 3.489 25.536 3.331 722 HB2 PRO 101 HB2 PRO 101 6.150 26.769 3.597 723 HB3 PRO 101 HB1 PRO 101 4.819 26.723 4.755 724 HG2 PRO 101 HG2 PRO 101 7.053 25.287 5.121 725 HG3 PRO 101 HG1 PRO 101 5.461 24.685 5.615 726 HD2 PRO 101 HD2 PRO 101 7.090 23.976 3.208 727 HD3 PRO 101 HD1 PRO 101 6.120 22.929 4.265 728 H ARG 102 H ARG 102 3.118 25.246 0.922 729 HA ARG 102 HA ARG 102 4.871 26.761 -0.813 730 HB2 ARG 102 HB2 ARG 102 3.809 24.655 -1.565 731 HB3 ARG 102 HB1 ARG 102 2.231 25.406 -1.397 732 HG2 ARG 102 HG2 ARG 102 2.834 25.402 -3.704 733 HG3 ARG 102 HG1 ARG 102 2.891 27.064 -3.118 734 HD2 ARG 102 HD2 ARG 102 5.344 25.330 -3.232 735 HD3 ARG 102 HD1 ARG 102 4.801 26.263 -4.622 736 HE ARG 102 HE ARG 102 5.843 27.331 -2.100 737 HH11 ARG 102 HH11 ARG 102 4.683 27.881 -5.361 738 HH12 ARG 102 HH12 ARG 102 5.270 29.511 -5.426 739 HH21 ARG 102 HH21 ARG 102 6.621 29.464 -2.186 740 HH22 ARG 102 HH22 ARG 102 6.382 30.411 -3.620 741 H SER 103 H SER 103 1.458 26.914 0.163 742 HA SER 103 HA SER 103 1.485 29.705 0.553 743 HB2 SER 103 HB2 SER 103 1.556 29.792 -1.898 744 HB3 SER 103 HB1 SER 103 0.133 28.757 -1.986 745 HG SER 103 HG SER 103 0.310 31.400 -0.965 746 H ASP 104 H ASP 104 -0.599 26.991 -0.432 747 HA ASP 104 HA ASP 104 -2.126 27.313 2.006 748 HB2 ASP 104 HB2 ASP 104 -4.245 27.703 1.059 749 HB3 ASP 104 HB1 ASP 104 -3.180 28.829 0.229 750 H GLY 105 H GLY 105 -1.448 25.582 -0.955 751 HA2 GLY 105 HA2 GLY 105 -1.067 23.303 -1.150 752 HA3 GLY 105 HA1 GLY 105 -1.648 23.091 0.493 753 H THR 106 H THR 106 -3.936 23.038 0.850 754 HA THR 106 HA THR 106 -5.489 22.343 -1.535 755 HB THR 106 HB THR 106 -4.693 20.237 -0.565 756 HG1 THR 106 HG1 THR 106 -7.430 20.424 0.144 757 HG21 THR 106 HG21 THR 106 -4.366 20.915 1.735 758 HG22 THR 106 HG22 THR 106 -5.445 19.525 1.668 759 HG23 THR 106 HG23 THR 106 -6.101 21.137 1.944 Start of MODEL 22 1 H1 GLY 1 HT1 GLY 1 12.168 -38.862 8.014 2 H2 GLY 1 HT2 GLY 1 11.652 -38.323 6.499 3 H3 GLY 1 HT3 GLY 1 10.584 -39.156 7.504 4 HA2 GLY 1 HA1 GLY 1 10.658 -37.357 9.117 5 HA3 GLY 1 HA2 GLY 1 11.753 -36.487 8.052 6 H SER 2 H SER 2 9.574 -35.152 8.726 7 HA SER 2 HA SER 2 8.151 -34.911 6.231 8 HB2 SER 2 HB2 SER 2 6.870 -36.654 7.514 9 HB3 SER 2 HB1 SER 2 6.590 -35.452 8.771 10 HG SER 2 HG SER 2 5.859 -35.033 6.066 11 H HIS 3 H HIS 3 6.917 -32.913 6.133 12 HA HIS 3 HA HIS 3 7.656 -30.991 8.242 13 HB2 HIS 3 HB2 HIS 3 7.643 -30.507 5.254 14 HB3 HIS 3 HB1 HIS 3 7.829 -29.246 6.461 15 HD1 HIS 3 HD1 HIS 3 10.097 -29.252 7.823 16 HD2 HIS 3 HD2 HIS 3 9.921 -31.916 4.637 17 HE1 HIS 3 HE1 HIS 3 12.474 -29.923 7.371 18 HE2 HIS 3 HE2 HIS 3 12.323 -31.665 5.558 19 H MET 4 H MET 4 6.298 -28.892 7.878 20 HA MET 4 HA MET 4 3.587 -29.540 6.977 21 HB2 MET 4 HB2 MET 4 3.768 -29.774 9.481 22 HB3 MET 4 HB1 MET 4 4.172 -28.065 9.551 23 HG2 MET 4 HG2 MET 4 2.008 -27.509 8.564 24 HG3 MET 4 HG1 MET 4 1.603 -29.223 8.496 25 HE1 MET 4 HE1 MET 4 -0.653 -28.763 9.793 26 HE2 MET 4 HE2 MET 4 -0.274 -27.043 9.879 27 HE3 MET 4 HE3 MET 4 -0.746 -27.917 11.337 28 H GLY 5 H GLY 5 5.132 -28.302 5.316 29 HA2 GLY 5 HA2 GLY 5 5.278 -25.453 5.708 30 HA3 GLY 5 HA1 GLY 5 5.705 -26.332 4.246 31 H THR 6 H THR 6 3.157 -24.777 6.023 32 HA THR 6 HA THR 6 1.166 -25.337 3.999 33 HB THR 6 HB THR 6 0.913 -23.442 6.339 34 HG1 THR 6 HG1 THR 6 1.347 -25.313 7.355 35 HG21 THR 6 HG21 THR 6 -0.860 -23.292 4.647 36 HG22 THR 6 HG22 THR 6 -1.473 -23.974 6.153 37 HG23 THR 6 HG23 THR 6 -1.135 -25.029 4.782 38 H THR 7 H THR 7 2.345 -24.353 2.240 39 HA THR 7 HA THR 7 2.784 -21.498 2.294 40 HB THR 7 HB THR 7 3.474 -21.850 -0.111 41 HG1 THR 7 HG1 THR 7 3.782 -24.551 0.199 42 HG21 THR 7 HG21 THR 7 4.842 -23.520 2.003 43 HG22 THR 7 HG22 THR 7 5.117 -21.806 1.690 44 HG23 THR 7 HG23 THR 7 5.568 -23.007 0.479 45 H THR 8 H THR 8 0.169 -23.504 1.692 46 HA THR 8 HA THR 8 -1.166 -21.880 -0.235 47 HB THR 8 HB THR 8 -1.764 -24.264 0.113 48 HG1 THR 8 HG1 THR 8 -3.434 -23.283 -0.840 49 HG21 THR 8 HG21 THR 8 -3.128 -24.889 2.052 50 HG22 THR 8 HG22 THR 8 -2.910 -23.271 2.721 51 HG23 THR 8 HG23 THR 8 -1.523 -24.342 2.538 52 H ALA 9 H ALA 9 -0.330 -21.466 2.864 53 HA ALA 9 HA ALA 9 -2.354 -19.380 3.312 54 HB1 ALA 9 HB1 ALA 9 -0.620 -20.793 5.343 55 HB2 ALA 9 HB2 ALA 9 -2.346 -21.058 5.086 56 HB3 ALA 9 HB3 ALA 9 -1.774 -19.505 5.694 57 HA PRO 10 HA PRO 10 1.532 -17.267 2.218 58 HB2 PRO 10 HB2 PRO 10 0.444 -15.286 0.793 59 HB3 PRO 10 HB1 PRO 10 0.559 -16.926 0.141 60 HG2 PRO 10 HG2 PRO 10 -1.784 -15.545 1.381 61 HG3 PRO 10 HG1 PRO 10 -1.722 -16.546 -0.082 62 HD2 PRO 10 HD2 PRO 10 -2.534 -17.475 2.348 63 HD3 PRO 10 HD1 PRO 10 -1.838 -18.488 1.120 64 H ASP 11 H ASP 11 2.436 -15.233 2.795 65 HA ASP 11 HA ASP 11 0.923 -13.837 4.903 66 HB2 ASP 11 HB2 ASP 11 3.185 -15.222 5.333 67 HB3 ASP 11 HB1 ASP 11 3.892 -13.688 4.836 68 H ALA 12 H ALA 12 1.853 -11.558 5.224 69 HA ALA 12 HA ALA 12 1.946 -10.265 2.591 70 HB1 ALA 12 HB1 ALA 12 1.390 -8.227 3.793 71 HB2 ALA 12 HB2 ALA 12 1.573 -9.054 5.338 72 HB3 ALA 12 HB3 ALA 12 0.267 -9.510 4.245 73 HA PRO 13 HA PRO 13 6.187 -8.877 3.141 74 HB2 PRO 13 HB2 PRO 13 5.285 -6.121 2.582 75 HB3 PRO 13 HB1 PRO 13 6.465 -7.108 1.716 76 HG2 PRO 13 HG2 PRO 13 4.068 -6.583 0.665 77 HG3 PRO 13 HG1 PRO 13 4.839 -8.166 0.442 78 HD2 PRO 13 HD2 PRO 13 2.659 -7.364 2.325 79 HD3 PRO 13 HD1 PRO 13 2.821 -8.844 1.355 80 HA PRO 14 HA PRO 14 6.163 -7.350 7.422 81 HB2 PRO 14 HB2 PRO 14 8.983 -6.868 6.564 82 HB3 PRO 14 HB1 PRO 14 8.374 -7.595 8.055 83 HG2 PRO 14 HG2 PRO 14 9.392 -9.118 6.129 84 HG3 PRO 14 HG1 PRO 14 7.968 -9.643 7.046 85 HD2 PRO 14 HD2 PRO 14 8.147 -8.597 4.260 86 HD3 PRO 14 HD1 PRO 14 7.035 -9.796 4.951 87 H ASP 15 H ASP 15 6.562 -5.317 8.403 88 HA ASP 15 HA ASP 15 5.275 -3.245 7.327 89 HB2 ASP 15 HB2 ASP 15 6.071 -3.388 9.665 90 HB3 ASP 15 HB1 ASP 15 7.687 -2.953 9.125 91 HA PRO 16 HA PRO 16 8.057 -1.961 3.972 92 HB2 PRO 16 HB2 PRO 16 5.632 -0.457 3.190 93 HB3 PRO 16 HB1 PRO 16 6.590 -1.612 2.234 94 HG2 PRO 16 HG2 PRO 16 4.192 -2.293 3.136 95 HG3 PRO 16 HG1 PRO 16 5.527 -3.455 3.203 96 HD2 PRO 16 HD2 PRO 16 4.461 -1.700 5.404 97 HD3 PRO 16 HD1 PRO 16 4.767 -3.456 5.443 98 H THR 17 H THR 17 9.149 -0.108 3.605 99 HA THR 17 HA THR 17 8.666 2.072 5.537 100 HB THR 17 HB THR 17 11.177 1.631 3.920 101 HG1 THR 17 HG1 THR 17 10.463 0.557 6.470 102 HG21 THR 17 HG21 THR 17 10.916 3.834 4.951 103 HG22 THR 17 HG22 THR 17 12.215 2.929 5.726 104 HG23 THR 17 HG23 THR 17 10.647 3.078 6.521 105 H VAL 18 H VAL 18 8.091 3.943 4.937 106 HA VAL 18 HA VAL 18 7.729 4.597 2.141 107 HB VAL 18 HB VAL 18 7.201 6.212 4.639 108 HG11 VAL 18 HG11 VAL 18 7.675 7.753 2.850 109 HG12 VAL 18 HG12 VAL 18 5.936 7.735 3.136 110 HG13 VAL 18 HG13 VAL 18 6.609 6.879 1.743 111 HG21 VAL 18 HG21 VAL 18 5.300 4.859 2.733 112 HG22 VAL 18 HG22 VAL 18 4.865 5.771 4.175 113 HG23 VAL 18 HG23 VAL 18 5.746 4.251 4.326 114 H ASP 19 H ASP 19 9.202 5.456 0.917 115 HA ASP 19 HA ASP 19 11.760 6.238 1.989 116 HB2 ASP 19 HB2 ASP 19 11.713 4.933 -0.042 117 HB3 ASP 19 HB1 ASP 19 10.682 6.120 -0.834 118 H GLN 20 H GLN 20 9.157 7.841 0.204 119 HA GLN 20 HA GLN 20 10.166 10.416 1.159 120 HB2 GLN 20 HB2 GLN 20 9.658 9.635 -1.691 121 HB3 GLN 20 HB1 GLN 20 9.462 11.305 -1.180 122 HG2 GLN 20 HG2 GLN 20 11.745 11.459 -0.537 123 HG3 GLN 20 HG1 GLN 20 11.981 9.726 -0.752 124 HE21 GLN 20 HE21 GLN 20 12.226 8.898 -2.787 125 HE22 GLN 20 HE22 GLN 20 12.500 9.874 -4.165 126 H VAL 21 H VAL 21 8.662 11.904 1.618 127 HA VAL 21 HA VAL 21 5.851 11.112 1.251 128 HB VAL 21 HB VAL 21 6.856 12.527 3.711 129 HG11 VAL 21 HG11 VAL 21 4.355 10.918 3.307 130 HG12 VAL 21 HG12 VAL 21 4.448 12.654 3.039 131 HG13 VAL 21 HG13 VAL 21 4.746 11.994 4.649 132 HG21 VAL 21 HG21 VAL 21 6.720 10.380 4.899 133 HG22 VAL 21 HG22 VAL 21 7.974 10.377 3.658 134 HG23 VAL 21 HG23 VAL 21 6.438 9.562 3.361 135 H ASP 22 H ASP 22 4.906 12.583 -0.020 136 HA ASP 22 HA ASP 22 5.565 15.424 0.403 137 HB2 ASP 22 HB2 ASP 22 5.096 13.967 -2.201 138 HB3 ASP 22 HB1 ASP 22 5.003 15.720 -2.067 139 H ASP 23 H ASP 23 3.606 16.477 -1.315 140 HA ASP 23 HA ASP 23 1.353 16.377 0.415 141 HB2 ASP 23 HB2 ASP 23 0.309 17.857 -1.377 142 HB3 ASP 23 HB1 ASP 23 1.772 18.454 -0.623 143 H THR 24 H THR 24 1.509 15.707 -3.052 144 HA THR 24 HA THR 24 -0.906 14.026 -2.787 145 HB THR 24 HB THR 24 -1.173 14.588 -5.232 146 HG1 THR 24 HG1 THR 24 0.717 16.666 -4.782 147 HG21 THR 24 HG21 THR 24 -0.986 16.954 -3.356 148 HG22 THR 24 HG22 THR 24 -2.349 15.834 -3.459 149 HG23 THR 24 HG23 THR 24 -1.952 16.870 -4.832 150 H SER 25 H SER 25 1.724 13.025 -2.256 151 HA SER 25 HA SER 25 2.062 10.876 -4.061 152 HB2 SER 25 HB2 SER 25 4.188 13.039 -4.197 153 HB3 SER 25 HB1 SER 25 4.257 11.467 -4.993 154 HG SER 25 HG SER 25 1.989 12.549 -5.742 155 H ILE 26 H ILE 26 2.984 9.271 -2.952 156 HA ILE 26 HA ILE 26 5.072 9.827 -0.960 157 HB ILE 26 HB ILE 26 2.445 8.503 -0.269 158 HG12 ILE 26 HG12 ILE 26 4.038 10.654 1.128 159 HG13 ILE 26 HG11 ILE 26 2.597 10.913 0.153 160 HG21 ILE 26 HG21 ILE 26 3.416 7.757 1.843 161 HG22 ILE 26 HG22 ILE 26 5.002 8.316 1.309 162 HG23 ILE 26 HG23 ILE 26 4.202 6.990 0.461 163 HD11 ILE 26 HD11 ILE 26 1.316 9.542 1.754 164 HD12 ILE 26 HD12 ILE 26 2.020 10.986 2.481 165 HD13 ILE 26 HD13 ILE 26 2.764 9.407 2.753 166 H VAL 27 H VAL 27 6.461 7.925 -0.623 167 HA VAL 27 HA VAL 27 5.832 5.819 -2.604 168 HB VAL 27 HB VAL 27 8.588 6.748 -1.817 169 HG11 VAL 27 HG11 VAL 27 8.008 5.100 -4.226 170 HG12 VAL 27 HG12 VAL 27 7.945 4.311 -2.649 171 HG13 VAL 27 HG13 VAL 27 9.434 5.110 -3.183 172 HG21 VAL 27 HG21 VAL 27 8.735 7.712 -4.060 173 HG22 VAL 27 HG22 VAL 27 7.445 8.464 -3.121 174 HG23 VAL 27 HG23 VAL 27 7.054 7.272 -4.362 175 H VAL 28 H VAL 28 5.855 3.745 -1.851 176 HA VAL 28 HA VAL 28 7.082 3.354 0.786 177 HB VAL 28 HB VAL 28 5.259 2.490 1.743 178 HG11 VAL 28 HG11 VAL 28 4.501 4.638 0.914 179 HG12 VAL 28 HG12 VAL 28 3.199 3.481 1.150 180 HG13 VAL 28 HG13 VAL 28 3.786 3.824 -0.476 181 HG21 VAL 28 HG21 VAL 28 4.311 1.387 -0.859 182 HG22 VAL 28 HG22 VAL 28 3.603 1.064 0.726 183 HG23 VAL 28 HG23 VAL 28 5.247 0.515 0.355 184 H ARG 29 H ARG 29 7.960 1.320 1.193 185 HA ARG 29 HA ARG 29 8.317 -0.421 -1.172 186 HB2 ARG 29 HB2 ARG 29 10.539 0.203 0.763 187 HB3 ARG 29 HB1 ARG 29 10.658 -0.578 -0.803 188 HG2 ARG 29 HG2 ARG 29 10.254 1.501 -1.931 189 HG3 ARG 29 HG1 ARG 29 9.932 2.313 -0.395 190 HD2 ARG 29 HD2 ARG 29 12.545 1.155 -1.353 191 HD3 ARG 29 HD1 ARG 29 12.169 2.850 -1.046 192 HE ARG 29 HE ARG 29 12.134 0.872 1.139 193 HH11 ARG 29 HH11 ARG 29 13.407 3.817 -0.257 194 HH12 ARG 29 HH12 ARG 29 14.202 4.313 1.200 195 HH21 ARG 29 HH21 ARG 29 13.207 1.508 3.050 196 HH22 ARG 29 HH22 ARG 29 14.086 3.006 3.075 197 H TRP 30 H TRP 30 7.855 -2.424 -0.743 198 HA TRP 30 HA TRP 30 7.742 -3.274 2.079 199 HB2 TRP 30 HB2 TRP 30 5.986 -4.902 1.302 200 HB3 TRP 30 HB1 TRP 30 5.519 -3.213 1.166 201 HD1 TRP 30 HD1 TRP 30 6.560 -6.172 -1.007 202 HE1 TRP 30 HE1 TRP 30 5.736 -5.762 -3.407 203 HE3 TRP 30 HE3 TRP 30 4.752 -1.470 -0.394 204 HZ2 TRP 30 HZ2 TRP 30 4.414 -3.714 -4.825 205 HZ3 TRP 30 HZ3 TRP 30 3.688 -0.364 -2.309 206 HH2 TRP 30 HH2 TRP 30 3.516 -1.450 -4.464 207 H SER 31 H SER 31 8.542 -5.264 2.683 208 HA SER 31 HA SER 31 10.329 -6.552 0.783 209 HB2 SER 31 HB2 SER 31 11.031 -6.056 3.163 210 HB3 SER 31 HB1 SER 31 9.872 -7.276 3.688 211 HG SER 31 HG SER 31 12.211 -7.612 2.124 212 H ARG 32 H ARG 32 9.042 -7.586 -0.601 213 HA ARG 32 HA ARG 32 6.606 -8.743 -0.297 214 HB2 ARG 32 HB2 ARG 32 7.500 -10.284 -2.254 215 HB3 ARG 32 HB1 ARG 32 7.206 -8.566 -2.487 216 HG2 ARG 32 HG2 ARG 32 9.882 -9.245 -1.525 217 HG3 ARG 32 HG1 ARG 32 9.504 -9.826 -3.148 218 HD2 ARG 32 HD2 ARG 32 8.983 -7.594 -3.872 219 HD3 ARG 32 HD1 ARG 32 9.121 -6.971 -2.222 220 HE ARG 32 HE ARG 32 11.499 -7.390 -2.343 221 HH11 ARG 32 HH11 ARG 32 9.788 -7.573 -5.395 222 HH12 ARG 32 HH12 ARG 32 11.198 -7.250 -6.346 223 HH21 ARG 32 HH21 ARG 32 13.347 -6.955 -3.595 224 HH22 ARG 32 HH22 ARG 32 13.229 -6.903 -5.326 225 HA PRO 33 HA PRO 33 6.828 -12.440 1.983 226 HB2 PRO 33 HB2 PRO 33 4.856 -13.787 0.341 227 HB3 PRO 33 HB1 PRO 33 4.640 -13.016 1.916 228 HG2 PRO 33 HG2 PRO 33 3.557 -12.072 -0.412 229 HG3 PRO 33 HG1 PRO 33 3.944 -11.048 0.990 230 HD2 PRO 33 HD2 PRO 33 5.478 -11.474 -1.533 231 HD3 PRO 33 HD1 PRO 33 5.204 -9.980 -0.626 232 H GLN 34 H GLN 34 7.064 -14.771 1.957 233 HA GLN 34 HA GLN 34 8.812 -15.724 -0.136 234 HB2 GLN 34 HB2 GLN 34 9.351 -16.245 2.156 235 HB3 GLN 34 HB1 GLN 34 7.783 -16.991 2.406 236 HG2 GLN 34 HG2 GLN 34 8.375 -18.759 0.832 237 HG3 GLN 34 HG1 GLN 34 9.945 -17.999 0.571 238 HE21 GLN 34 HE21 GLN 34 7.950 -19.756 2.818 239 HE22 GLN 34 HE22 GLN 34 9.223 -20.217 3.895 240 H ALA 35 H ALA 35 5.518 -15.716 0.608 241 HA ALA 35 HA ALA 35 4.611 -18.096 -0.588 242 HB1 ALA 35 HB1 ALA 35 3.307 -16.482 0.869 243 HB2 ALA 35 HB2 ALA 35 2.465 -17.121 -0.542 244 HB3 ALA 35 HB3 ALA 35 3.124 -15.481 -0.579 245 HA PRO 36 HA PRO 36 4.840 -16.971 -4.964 246 HB2 PRO 36 HB2 PRO 36 2.642 -18.896 -5.300 247 HB3 PRO 36 HB1 PRO 36 4.258 -18.918 -6.011 248 HG2 PRO 36 HG2 PRO 36 3.513 -20.669 -4.107 249 HG3 PRO 36 HG1 PRO 36 5.172 -20.054 -4.224 250 HD2 PRO 36 HD2 PRO 36 2.974 -19.240 -2.358 251 HD3 PRO 36 HD1 PRO 36 4.707 -19.463 -2.031 252 H ILE 37 H ILE 37 3.925 -15.093 -5.415 253 HA ILE 37 HA ILE 37 1.032 -14.720 -4.983 254 HB ILE 37 HB ILE 37 1.555 -12.303 -4.655 255 HG12 ILE 37 HG12 ILE 37 4.316 -13.324 -5.128 256 HG13 ILE 37 HG11 ILE 37 3.545 -11.860 -5.709 257 HG21 ILE 37 HG21 ILE 37 2.323 -12.440 -2.367 258 HG22 ILE 37 HG22 ILE 37 3.072 -14.021 -2.671 259 HG23 ILE 37 HG23 ILE 37 1.315 -13.859 -2.707 260 HD11 ILE 37 HD11 ILE 37 3.654 -11.095 -3.262 261 HD12 ILE 37 HD12 ILE 37 5.127 -11.081 -4.232 262 HD13 ILE 37 HD13 ILE 37 4.839 -12.389 -3.083 263 H THR 38 H THR 38 -0.008 -13.286 -6.591 264 HA THR 38 HA THR 38 1.311 -13.525 -9.196 265 HB THR 38 HB THR 38 -1.014 -13.175 -10.119 266 HG1 THR 38 HG1 THR 38 -2.239 -12.440 -8.487 267 HG21 THR 38 HG21 THR 38 -0.443 -15.594 -8.431 268 HG22 THR 38 HG22 THR 38 0.014 -15.336 -10.114 269 HG23 THR 38 HG23 THR 38 -1.683 -15.498 -9.680 270 H GLY 39 H GLY 39 -0.107 -11.155 -7.036 271 HA2 GLY 39 HA2 GLY 39 1.106 -9.065 -8.572 272 HA3 GLY 39 HA1 GLY 39 -0.650 -9.035 -8.620 273 H TYR 40 H TYR 40 -0.079 -6.857 -7.620 274 HA TYR 40 HA TYR 40 -0.483 -7.210 -4.733 275 HB2 TYR 40 HB2 TYR 40 1.590 -5.526 -6.057 276 HB3 TYR 40 HB1 TYR 40 0.774 -4.882 -4.635 277 HD1 TYR 40 HD1 TYR 40 2.117 -8.243 -5.566 278 HD2 TYR 40 HD2 TYR 40 2.050 -5.066 -2.745 279 HE1 TYR 40 HE1 TYR 40 3.688 -9.469 -4.148 280 HE2 TYR 40 HE2 TYR 40 3.587 -6.310 -1.307 281 HH TYR 40 HH TYR 40 5.243 -9.097 -2.398 282 H ARG 41 H ARG 41 -2.211 -6.172 -4.040 283 HA ARG 41 HA ARG 41 -3.259 -3.906 -5.587 284 HB2 ARG 41 HB2 ARG 41 -4.548 -4.844 -3.089 285 HB3 ARG 41 HB1 ARG 41 -5.257 -4.208 -4.567 286 HG2 ARG 41 HG2 ARG 41 -3.923 -6.889 -4.517 287 HG3 ARG 41 HG1 ARG 41 -5.590 -6.700 -3.970 288 HD2 ARG 41 HD2 ARG 41 -6.014 -7.164 -6.145 289 HD3 ARG 41 HD1 ARG 41 -5.778 -5.433 -6.274 290 HE ARG 41 HE ARG 41 -3.477 -5.937 -7.012 291 HH11 ARG 41 HH11 ARG 41 -5.936 -8.423 -7.224 292 HH12 ARG 41 HH12 ARG 41 -5.225 -9.188 -8.608 293 HH21 ARG 41 HH21 ARG 41 -2.544 -6.949 -8.858 294 HH22 ARG 41 HH22 ARG 41 -3.295 -8.367 -9.526 295 H ILE 42 H ILE 42 -3.460 -1.865 -4.592 296 HA ILE 42 HA ILE 42 -2.250 -1.649 -1.911 297 HB ILE 42 HB ILE 42 -1.454 0.138 -4.187 298 HG12 ILE 42 HG12 ILE 42 0.184 -2.040 -2.927 299 HG13 ILE 42 HG11 ILE 42 -0.719 -2.253 -4.417 300 HG21 ILE 42 HG21 ILE 42 -0.177 -0.208 -1.480 301 HG22 ILE 42 HG22 ILE 42 -1.348 1.054 -1.859 302 HG23 ILE 42 HG23 ILE 42 0.200 1.013 -2.699 303 HD11 ILE 42 HD11 ILE 42 0.604 -0.453 -5.431 304 HD12 ILE 42 HD12 ILE 42 1.578 -1.827 -4.904 305 HD13 ILE 42 HD13 ILE 42 1.541 -0.353 -3.943 306 H VAL 43 H VAL 43 -3.818 -0.805 -0.691 307 HA VAL 43 HA VAL 43 -5.410 1.372 -1.884 308 HB VAL 43 HB VAL 43 -6.146 -0.456 0.406 309 HG11 VAL 43 HG11 VAL 43 -6.962 1.764 0.834 310 HG12 VAL 43 HG12 VAL 43 -8.292 0.692 0.409 311 HG13 VAL 43 HG13 VAL 43 -7.672 1.842 -0.777 312 HG21 VAL 43 HG21 VAL 43 -7.884 -1.267 -1.054 313 HG22 VAL 43 HG22 VAL 43 -6.322 -1.445 -1.852 314 HG23 VAL 43 HG23 VAL 43 -7.401 -0.127 -2.307 315 H TYR 44 H TYR 44 -4.636 3.257 -1.314 316 HA TYR 44 HA TYR 44 -3.899 3.655 1.481 317 HB2 TYR 44 HB2 TYR 44 -2.725 5.773 0.452 318 HB3 TYR 44 HB1 TYR 44 -1.927 4.208 0.447 319 HD1 TYR 44 HD1 TYR 44 -2.150 2.792 -1.675 320 HD2 TYR 44 HD2 TYR 44 -3.004 6.951 -1.549 321 HE1 TYR 44 HE1 TYR 44 -1.851 2.903 -4.101 322 HE2 TYR 44 HE2 TYR 44 -2.709 7.090 -3.981 323 HH TYR 44 HH TYR 44 -1.518 5.825 -5.759 324 H SER 45 H SER 45 -4.996 4.885 2.642 325 HA SER 45 HA SER 45 -6.871 6.792 1.443 326 HB2 SER 45 HB2 SER 45 -8.001 4.565 1.749 327 HB3 SER 45 HB1 SER 45 -7.722 4.727 3.481 328 HG SER 45 HG SER 45 -9.828 5.460 2.561 329 HA PRO 46 HA PRO 46 -5.568 9.166 5.014 330 HB2 PRO 46 HB2 PRO 46 -7.611 11.060 4.512 331 HB3 PRO 46 HB1 PRO 46 -5.912 11.171 4.080 332 HG2 PRO 46 HG2 PRO 46 -7.981 10.984 2.275 333 HG3 PRO 46 HG1 PRO 46 -6.298 10.545 1.936 334 HD2 PRO 46 HD2 PRO 46 -8.617 8.803 2.622 335 HD3 PRO 46 HD1 PRO 46 -7.290 8.523 1.476 336 H SER 47 H SER 47 -6.198 9.522 7.083 337 HA SER 47 HA SER 47 -8.436 8.092 8.069 338 HB2 SER 47 HB2 SER 47 -6.716 10.101 9.535 339 HB3 SER 47 HB1 SER 47 -7.696 8.821 10.252 340 HG SER 47 HG SER 47 -5.847 7.789 10.140 341 H VAL 48 H VAL 48 -7.903 11.469 7.279 342 HA VAL 48 HA VAL 48 -10.647 12.026 8.178 343 HB VAL 48 HB VAL 48 -9.193 13.334 9.526 344 HG11 VAL 48 HG11 VAL 48 -7.185 13.192 8.172 345 HG12 VAL 48 HG12 VAL 48 -7.526 14.868 8.600 346 HG13 VAL 48 HG13 VAL 48 -7.894 14.278 6.980 347 HG21 VAL 48 HG21 VAL 48 -10.298 15.073 7.326 348 HG22 VAL 48 HG22 VAL 48 -9.838 15.623 8.937 349 HG23 VAL 48 HG23 VAL 48 -11.183 14.501 8.740 350 H GLU 49 H GLU 49 -8.266 12.669 5.650 351 HA GLU 49 HA GLU 49 -10.089 14.141 4.012 352 HB2 GLU 49 HB2 GLU 49 -7.644 14.515 3.964 353 HB3 GLU 49 HB1 GLU 49 -7.420 12.902 3.308 354 HG2 GLU 49 HG2 GLU 49 -7.262 14.634 1.597 355 HG3 GLU 49 HG1 GLU 49 -8.593 13.521 1.292 356 H GLY 50 H GLY 50 -10.481 13.384 1.670 357 HA2 GLY 50 HA2 GLY 50 -11.377 10.578 1.865 358 HA3 GLY 50 HA1 GLY 50 -12.288 11.845 1.069 359 H SER 51 H SER 51 -8.869 11.924 0.391 360 HA SER 51 HA SER 51 -9.496 10.776 -2.226 361 HB2 SER 51 HB2 SER 51 -8.106 12.960 -1.874 362 HB3 SER 51 HB1 SER 51 -6.763 11.877 -1.482 363 HG SER 51 HG SER 51 -6.500 11.726 -3.551 364 H SER 52 H SER 52 -9.373 8.673 -2.375 365 HA SER 52 HA SER 52 -7.155 7.246 -1.074 366 HB2 SER 52 HB2 SER 52 -8.750 5.271 -0.980 367 HB3 SER 52 HB1 SER 52 -9.158 6.612 0.094 368 HG SER 52 HG SER 52 -11.016 6.626 -0.873 369 H THR 53 H THR 53 -6.187 5.560 -2.276 370 HA THR 53 HA THR 53 -7.296 5.065 -4.931 371 HB THR 53 HB THR 53 -4.459 6.052 -4.582 372 HG1 THR 53 HG1 THR 53 -6.749 7.379 -4.874 373 HG21 THR 53 HG21 THR 53 -4.656 4.372 -6.351 374 HG22 THR 53 HG22 THR 53 -4.352 5.973 -7.025 375 HG23 THR 53 HG23 THR 53 -5.976 5.285 -7.080 376 H GLU 54 H GLU 54 -6.780 3.089 -5.790 377 HA GLU 54 HA GLU 54 -5.020 1.350 -4.234 378 HB2 GLU 54 HB2 GLU 54 -7.386 0.637 -4.189 379 HB3 GLU 54 HB1 GLU 54 -7.393 0.579 -5.945 380 HG2 GLU 54 HG2 GLU 54 -5.646 -1.170 -5.856 381 HG3 GLU 54 HG1 GLU 54 -5.760 -1.149 -4.098 382 H LEU 55 H LEU 55 -3.139 1.036 -5.255 383 HA LEU 55 HA LEU 55 -3.134 1.068 -8.185 384 HB2 LEU 55 HB2 LEU 55 -0.792 1.206 -6.247 385 HB3 LEU 55 HB1 LEU 55 -0.633 1.058 -7.995 386 HG LEU 55 HG LEU 55 -1.729 3.353 -6.423 387 HD11 LEU 55 HD11 LEU 55 -0.080 4.594 -7.865 388 HD12 LEU 55 HD12 LEU 55 0.544 3.016 -8.345 389 HD13 LEU 55 HD13 LEU 55 0.596 3.510 -6.653 390 HD21 LEU 55 HD21 LEU 55 -1.979 2.890 -9.387 391 HD22 LEU 55 HD22 LEU 55 -2.272 4.430 -8.582 392 HD23 LEU 55 HD23 LEU 55 -3.295 3.040 -8.221 393 H ASN 56 H ASN 56 -1.863 -0.575 -9.316 394 HA ASN 56 HA ASN 56 -1.851 -3.134 -7.874 395 HB2 ASN 56 HB2 ASN 56 -3.758 -3.132 -9.400 396 HB3 ASN 56 HB1 ASN 56 -2.715 -2.660 -10.738 397 HD21 ASN 56 HD21 ASN 56 -3.359 -4.509 -11.885 398 HD22 ASN 56 HD22 ASN 56 -2.738 -6.079 -11.491 399 H LEU 57 H LEU 57 0.082 -4.011 -7.809 400 HA LEU 57 HA LEU 57 2.061 -3.158 -9.815 401 HB2 LEU 57 HB2 LEU 57 2.444 -3.817 -6.876 402 HB3 LEU 57 HB1 LEU 57 3.763 -3.670 -8.014 403 HG LEU 57 HG LEU 57 2.087 -1.578 -6.759 404 HD11 LEU 57 HD11 LEU 57 4.210 -0.446 -6.617 405 HD12 LEU 57 HD12 LEU 57 4.964 -1.685 -7.622 406 HD13 LEU 57 HD13 LEU 57 4.364 -2.097 -6.019 407 HD21 LEU 57 HD21 LEU 57 2.689 0.047 -8.472 408 HD22 LEU 57 HD22 LEU 57 1.601 -1.195 -9.093 409 HD23 LEU 57 HD23 LEU 57 3.321 -1.255 -9.480 410 HA PRO 58 HA PRO 58 2.606 -7.441 -10.740 411 HB2 PRO 58 HB2 PRO 58 5.339 -7.571 -11.030 412 HB3 PRO 58 HB1 PRO 58 4.230 -7.000 -12.278 413 HG2 PRO 58 HG2 PRO 58 5.965 -5.453 -10.429 414 HG3 PRO 58 HG1 PRO 58 5.492 -5.091 -12.096 415 HD2 PRO 58 HD2 PRO 58 4.400 -3.875 -9.902 416 HD3 PRO 58 HD1 PRO 58 3.550 -4.057 -11.443 417 H GLU 59 H GLU 59 3.154 -9.334 -9.777 418 HA GLU 59 HA GLU 59 3.330 -9.669 -7.077 419 HB2 GLU 59 HB2 GLU 59 4.239 -11.944 -7.582 420 HB3 GLU 59 HB1 GLU 59 2.809 -11.515 -8.511 421 HG2 GLU 59 HG2 GLU 59 4.087 -11.122 -10.465 422 HG3 GLU 59 HG1 GLU 59 5.602 -11.198 -9.569 423 H THR 60 H THR 60 5.886 -8.826 -9.187 424 HA THR 60 HA THR 60 7.921 -9.559 -7.212 425 HB THR 60 HB THR 60 8.157 -10.509 -9.491 426 HG1 THR 60 HG1 THR 60 10.170 -10.463 -8.887 427 HG21 THR 60 HG21 THR 60 8.564 -7.636 -10.320 428 HG22 THR 60 HG22 THR 60 7.214 -8.675 -10.779 429 HG23 THR 60 HG23 THR 60 8.846 -9.049 -11.338 430 H ALA 61 H ALA 61 6.100 -7.053 -7.484 431 HA ALA 61 HA ALA 61 8.101 -4.954 -7.732 432 HB1 ALA 61 HB1 ALA 61 5.878 -4.528 -8.621 433 HB2 ALA 61 HB2 ALA 61 6.232 -3.417 -7.298 434 HB3 ALA 61 HB3 ALA 61 5.171 -4.800 -7.031 435 H ASN 62 H ASN 62 8.322 -3.341 -5.963 436 HA ASN 62 HA ASN 62 7.791 -4.426 -3.310 437 HB2 ASN 62 HB2 ASN 62 10.055 -4.339 -2.578 438 HB3 ASN 62 HB1 ASN 62 10.030 -5.276 -4.066 439 HD21 ASN 62 HD21 ASN 62 11.221 -2.498 -2.477 440 HD22 ASN 62 HD22 ASN 62 12.198 -1.897 -3.773 441 H SER 63 H SER 63 7.192 -1.931 -5.102 442 HA SER 63 HA SER 63 7.124 -0.110 -2.916 443 HB2 SER 63 HB2 SER 63 8.629 1.623 -4.004 444 HB3 SER 63 HB1 SER 63 9.462 0.217 -3.339 445 HG SER 63 HG SER 63 8.899 -0.436 -5.793 446 H VAL 64 H VAL 64 5.549 1.360 -3.246 447 HA VAL 64 HA VAL 64 4.600 1.782 -6.012 448 HB VAL 64 HB VAL 64 2.823 0.630 -4.854 449 HG11 VAL 64 HG11 VAL 64 2.154 0.973 -2.752 450 HG12 VAL 64 HG12 VAL 64 2.507 2.698 -2.792 451 HG13 VAL 64 HG13 VAL 64 3.813 1.532 -2.587 452 HG21 VAL 64 HG21 VAL 64 2.136 2.385 -6.304 453 HG22 VAL 64 HG22 VAL 64 2.209 3.541 -4.972 454 HG23 VAL 64 HG23 VAL 64 1.042 2.217 -4.936 455 H THR 65 H THR 65 4.427 3.842 -6.733 456 HA THR 65 HA THR 65 4.852 6.043 -4.879 457 HB THR 65 HB THR 65 4.689 5.820 -7.874 458 HG1 THR 65 HG1 THR 65 6.959 6.903 -6.860 459 HG21 THR 65 HG21 THR 65 3.763 7.994 -7.193 460 HG22 THR 65 HG22 THR 65 5.334 8.202 -7.969 461 HG23 THR 65 HG23 THR 65 5.197 8.304 -6.212 462 H LEU 66 H LEU 66 2.992 6.360 -3.812 463 HA LEU 66 HA LEU 66 0.384 6.243 -4.986 464 HB2 LEU 66 HB2 LEU 66 0.698 7.782 -2.530 465 HB3 LEU 66 HB1 LEU 66 -0.381 6.453 -2.887 466 HG LEU 66 HG LEU 66 2.523 6.020 -2.264 467 HD11 LEU 66 HD11 LEU 66 2.069 5.811 -0.044 468 HD12 LEU 66 HD12 LEU 66 0.329 5.678 -0.299 469 HD13 LEU 66 HD13 LEU 66 1.132 7.232 -0.492 470 HD21 LEU 66 HD21 LEU 66 0.072 4.284 -2.293 471 HD22 LEU 66 HD22 LEU 66 1.644 3.771 -1.673 472 HD23 LEU 66 HD23 LEU 66 1.456 4.176 -3.380 473 H SER 67 H SER 67 -0.942 7.956 -5.529 474 HA SER 67 HA SER 67 0.285 10.605 -5.643 475 HB2 SER 67 HB2 SER 67 -0.514 10.785 -8.036 476 HB3 SER 67 HB1 SER 67 0.833 9.673 -7.788 477 HG SER 67 HG SER 67 -0.376 8.158 -8.565 478 H ASP 68 H ASP 68 -1.351 12.261 -6.342 479 HA ASP 68 HA ASP 68 -3.283 13.373 -5.974 480 HB2 ASP 68 HB2 ASP 68 -4.392 10.627 -6.507 481 HB3 ASP 68 HB1 ASP 68 -5.444 11.986 -6.130 482 H LEU 69 H LEU 69 -1.809 12.530 -3.725 483 HA LEU 69 HA LEU 69 -3.751 11.820 -1.695 484 HB2 LEU 69 HB2 LEU 69 -1.053 12.928 -1.022 485 HB3 LEU 69 HB1 LEU 69 -2.026 11.749 -0.165 486 HG LEU 69 HG LEU 69 -0.527 11.183 -2.712 487 HD11 LEU 69 HD11 LEU 69 0.953 9.914 -1.245 488 HD12 LEU 69 HD12 LEU 69 0.057 10.497 0.159 489 HD13 LEU 69 HD13 LEU 69 0.955 11.632 -0.846 490 HD21 LEU 69 HD21 LEU 69 -2.281 9.623 -0.854 491 HD22 LEU 69 HD22 LEU 69 -1.029 8.804 -1.792 492 HD23 LEU 69 HD23 LEU 69 -2.327 9.676 -2.619 493 H GLN 70 H GLN 70 -3.398 13.376 0.397 494 HA GLN 70 HA GLN 70 -3.681 16.148 -0.535 495 HB2 GLN 70 HB2 GLN 70 -5.863 15.163 0.057 496 HB3 GLN 70 HB1 GLN 70 -5.251 14.795 1.664 497 HG2 GLN 70 HG2 GLN 70 -6.592 16.762 1.790 498 HG3 GLN 70 HG1 GLN 70 -4.907 17.220 2.029 499 HE21 GLN 70 HE21 GLN 70 -5.267 19.335 1.425 500 HE22 GLN 70 HE22 GLN 70 -5.573 19.796 -0.214 501 HA PRO 71 HA PRO 71 -0.219 16.714 2.207 502 HB2 PRO 71 HB2 PRO 71 -0.365 19.452 2.305 503 HB3 PRO 71 HB1 PRO 71 0.419 18.521 1.029 504 HG2 PRO 71 HG2 PRO 71 -2.289 19.774 1.068 505 HG3 PRO 71 HG1 PRO 71 -1.118 19.680 -0.257 506 HD2 PRO 71 HD2 PRO 71 -3.271 18.070 -0.131 507 HD3 PRO 71 HD1 PRO 71 -1.724 17.521 -0.806 508 H GLY 72 H GLY 72 -0.049 16.658 4.344 509 HA2 GLY 72 HA2 GLY 72 -0.308 17.412 6.538 510 HA3 GLY 72 HA1 GLY 72 -1.639 18.431 6.010 511 H VAL 73 H VAL 73 -1.552 15.070 5.130 512 HA VAL 73 HA VAL 73 -3.656 14.524 7.119 513 HB VAL 73 HB VAL 73 -3.770 13.602 4.251 514 HG11 VAL 73 HG11 VAL 73 -5.651 13.445 6.572 515 HG12 VAL 73 HG12 VAL 73 -5.028 12.130 5.571 516 HG13 VAL 73 HG13 VAL 73 -6.187 13.292 4.903 517 HG21 VAL 73 HG21 VAL 73 -4.161 15.879 4.022 518 HG22 VAL 73 HG22 VAL 73 -4.985 15.979 5.582 519 HG23 VAL 73 HG23 VAL 73 -5.775 15.181 4.218 520 H GLN 74 H GLN 74 -3.881 12.408 7.771 521 HA GLN 74 HA GLN 74 -1.494 10.823 7.766 522 HB2 GLN 74 HB2 GLN 74 -3.251 11.290 9.629 523 HB3 GLN 74 HB1 GLN 74 -4.169 10.013 8.858 524 HG2 GLN 74 HG2 GLN 74 -2.968 9.048 10.666 525 HG3 GLN 74 HG1 GLN 74 -2.234 8.489 9.166 526 HE21 GLN 74 HE21 GLN 74 -0.144 9.121 8.664 527 HE22 GLN 74 HE22 GLN 74 0.887 9.909 9.806 528 H TYR 75 H TYR 75 -1.102 9.629 5.966 529 HA TYR 75 HA TYR 75 -3.388 8.412 4.612 530 HB2 TYR 75 HB2 TYR 75 -0.773 9.412 3.718 531 HB3 TYR 75 HB1 TYR 75 -1.294 7.902 2.964 532 HD1 TYR 75 HD2 TYR 75 -2.270 11.421 3.570 533 HD2 TYR 75 HD1 TYR 75 -3.030 7.859 1.377 534 HE1 TYR 75 HE2 TYR 75 -3.812 12.656 2.107 535 HE2 TYR 75 HE1 TYR 75 -4.579 9.079 -0.085 536 HH TYR 75 HH TYR 75 -5.893 11.033 -0.120 537 H ASN 76 H ASN 76 -3.865 6.459 5.075 538 HA ASN 76 HA ASN 76 -1.899 4.613 6.151 539 HB2 ASN 76 HB2 ASN 76 -4.850 4.196 5.602 540 HB3 ASN 76 HB1 ASN 76 -3.802 3.118 6.514 541 HD21 ASN 76 HD21 ASN 76 -5.603 6.069 6.541 542 HD22 ASN 76 HD22 ASN 76 -5.446 6.392 8.236 543 H ILE 77 H ILE 77 -0.623 3.721 4.660 544 HA ILE 77 HA ILE 77 -1.723 2.898 2.086 545 HB ILE 77 HB ILE 77 1.107 2.697 3.117 546 HG12 ILE 77 HG12 ILE 77 1.372 4.352 1.123 547 HG13 ILE 77 HG11 ILE 77 -0.296 4.735 1.460 548 HG21 ILE 77 HG21 ILE 77 1.144 1.048 1.537 549 HG22 ILE 77 HG22 ILE 77 1.466 2.476 0.533 550 HG23 ILE 77 HG23 ILE 77 -0.159 1.792 0.597 551 HD11 ILE 77 HD11 ILE 77 1.983 4.941 3.410 552 HD12 ILE 77 HD12 ILE 77 0.296 5.327 3.752 553 HD13 ILE 77 HD13 ILE 77 1.199 6.280 2.574 554 H THR 78 H THR 78 -2.634 1.036 1.938 555 HA THR 78 HA THR 78 -1.782 -1.115 3.718 556 HB THR 78 HB THR 78 -4.364 -0.709 2.219 557 HG1 THR 78 HG1 THR 78 -3.672 -0.441 4.973 558 HG21 THR 78 HG21 THR 78 -5.194 -2.604 3.557 559 HG22 THR 78 HG22 THR 78 -3.585 -2.814 4.247 560 HG23 THR 78 HG23 THR 78 -3.849 -3.089 2.526 561 H ILE 79 H ILE 79 -0.528 -2.612 2.791 562 HA ILE 79 HA ILE 79 -0.574 -2.848 -0.152 563 HB ILE 79 HB ILE 79 1.398 -4.272 1.651 564 HG12 ILE 79 HG12 ILE 79 1.974 -2.000 2.054 565 HG13 ILE 79 HG11 ILE 79 3.075 -2.600 0.812 566 HG21 ILE 79 HG21 ILE 79 1.275 -3.699 -1.276 567 HG22 ILE 79 HG22 ILE 79 1.361 -5.266 -0.460 568 HG23 ILE 79 HG23 ILE 79 2.759 -4.180 -0.456 569 HD11 ILE 79 HD11 ILE 79 0.622 -1.133 0.004 570 HD12 ILE 79 HD12 ILE 79 2.185 -1.290 -0.815 571 HD13 ILE 79 HD13 ILE 79 2.022 -0.258 0.619 572 H TYR 80 H TYR 80 -1.128 -4.708 -1.181 573 HA TYR 80 HA TYR 80 -2.002 -6.989 0.471 574 HB2 TYR 80 HB2 TYR 80 -3.307 -6.000 -2.074 575 HB3 TYR 80 HB1 TYR 80 -3.829 -7.367 -1.104 576 HD1 TYR 80 HD1 TYR 80 -3.750 -3.688 -1.354 577 HD2 TYR 80 HD2 TYR 80 -5.099 -7.042 0.913 578 HE1 TYR 80 HE1 TYR 80 -5.334 -2.248 -0.154 579 HE2 TYR 80 HE2 TYR 80 -6.680 -5.597 2.116 580 HH TYR 80 HH TYR 80 -7.474 -2.485 1.080 581 H ALA 81 H ALA 81 -0.528 -8.581 0.001 582 HA ALA 81 HA ALA 81 0.433 -8.866 -2.724 583 HB1 ALA 81 HB1 ALA 81 1.511 -11.004 -1.768 584 HB2 ALA 81 HB2 ALA 81 0.912 -10.466 -0.183 585 HB3 ALA 81 HB3 ALA 81 2.060 -9.469 -1.078 586 H VAL 82 H VAL 82 -0.649 -9.932 -4.235 587 HA VAL 82 HA VAL 82 -2.897 -11.620 -3.278 588 HB VAL 82 HB VAL 82 -3.742 -9.676 -4.471 589 HG11 VAL 82 HG11 VAL 82 -2.090 -10.610 -6.784 590 HG12 VAL 82 HG12 VAL 82 -1.826 -9.152 -5.828 591 HG13 VAL 82 HG13 VAL 82 -3.275 -9.303 -6.823 592 HG21 VAL 82 HG21 VAL 82 -5.104 -10.760 -6.145 593 HG22 VAL 82 HG22 VAL 82 -4.918 -11.829 -4.750 594 HG23 VAL 82 HG23 VAL 82 -3.972 -12.116 -6.218 595 H GLU 83 H GLU 83 -3.186 -13.656 -4.127 596 HA GLU 83 HA GLU 83 -1.208 -14.462 -6.134 597 HB2 GLU 83 HB2 GLU 83 -2.076 -16.691 -4.494 598 HB3 GLU 83 HB1 GLU 83 -0.469 -16.179 -4.950 599 HG2 GLU 83 HG2 GLU 83 -0.210 -15.868 -2.786 600 HG3 GLU 83 HG1 GLU 83 -1.002 -14.346 -3.156 601 H GLU 84 H GLU 84 -1.934 -16.692 -7.077 602 HA GLU 84 HA GLU 84 -3.699 -16.211 -8.997 603 HB2 GLU 84 HB2 GLU 84 -3.400 -18.899 -7.666 604 HB3 GLU 84 HB1 GLU 84 -4.002 -18.620 -9.293 605 HG2 GLU 84 HG2 GLU 84 -1.819 -17.660 -9.908 606 HG3 GLU 84 HG1 GLU 84 -1.232 -18.024 -8.286 607 H ASN 85 H ASN 85 -4.753 -17.903 -6.006 608 HA ASN 85 HA ASN 85 -7.505 -17.174 -6.777 609 HB2 ASN 85 HB2 ASN 85 -6.483 -19.782 -5.669 610 HB3 ASN 85 HB1 ASN 85 -8.182 -19.333 -5.595 611 HD21 ASN 85 HD21 ASN 85 -5.560 -20.310 -7.638 612 HD22 ASN 85 HD22 ASN 85 -6.510 -20.618 -9.051 613 H GLN 86 H GLN 86 -5.399 -16.103 -4.721 614 HA GLN 86 HA GLN 86 -7.344 -15.851 -2.557 615 HB2 GLN 86 HB2 GLN 86 -4.526 -16.810 -2.099 616 HB3 GLN 86 HB1 GLN 86 -5.655 -16.353 -0.836 617 HG2 GLN 86 HG2 GLN 86 -7.123 -18.196 -1.494 618 HG3 GLN 86 HG1 GLN 86 -5.971 -18.660 -2.742 619 HE21 GLN 86 HE21 GLN 86 -3.631 -18.074 -1.046 620 HE22 GLN 86 HE22 GLN 86 -3.567 -19.356 0.112 621 H GLU 87 H GLU 87 -6.566 -14.318 -0.871 622 HA GLU 87 HA GLU 87 -4.669 -12.309 -1.892 623 HB2 GLU 87 HB2 GLU 87 -7.218 -11.785 -0.344 624 HB3 GLU 87 HB1 GLU 87 -6.025 -10.569 -0.768 625 HG2 GLU 87 HG2 GLU 87 -6.481 -10.981 -3.147 626 HG3 GLU 87 HG1 GLU 87 -7.719 -12.151 -2.687 627 H SER 88 H SER 88 -3.014 -11.990 -0.530 628 HA SER 88 HA SER 88 -2.929 -13.417 1.952 629 HB2 SER 88 HB2 SER 88 -0.916 -11.453 0.838 630 HB3 SER 88 HB1 SER 88 -0.630 -12.673 2.079 631 HG SER 88 HG SER 88 -1.673 -13.655 -0.283 632 H THR 89 H THR 89 -1.678 -12.011 3.787 633 HA THR 89 HA THR 89 -3.709 -10.365 4.865 634 HB THR 89 HB THR 89 -1.841 -9.874 6.604 635 HG1 THR 89 HG1 THR 89 0.030 -10.793 6.248 636 HG21 THR 89 HG21 THR 89 -2.802 -12.695 6.114 637 HG22 THR 89 HG22 THR 89 -3.692 -11.433 6.964 638 HG23 THR 89 HG23 THR 89 -2.192 -12.064 7.644 639 HA PRO 90 HA PRO 90 -2.337 -6.415 3.436 640 HB2 PRO 90 HB2 PRO 90 -3.691 -4.812 5.082 641 HB3 PRO 90 HB1 PRO 90 -4.518 -5.867 3.931 642 HG2 PRO 90 HG2 PRO 90 -4.137 -6.202 6.871 643 HG3 PRO 90 HG1 PRO 90 -5.537 -6.608 5.865 644 HD2 PRO 90 HD2 PRO 90 -3.585 -8.390 6.740 645 HD3 PRO 90 HD1 PRO 90 -4.736 -8.669 5.424 646 H VAL 91 H VAL 91 -0.652 -5.131 3.649 647 HA VAL 91 HA VAL 91 0.765 -4.555 6.119 648 HB VAL 91 HB VAL 91 0.892 -3.508 3.299 649 HG11 VAL 91 HG11 VAL 91 2.548 -2.536 5.619 650 HG12 VAL 91 HG12 VAL 91 1.197 -1.655 4.910 651 HG13 VAL 91 HG13 VAL 91 2.632 -1.983 3.949 652 HG21 VAL 91 HG21 VAL 91 3.133 -4.398 3.308 653 HG22 VAL 91 HG22 VAL 91 1.980 -5.662 3.748 654 HG23 VAL 91 HG23 VAL 91 2.963 -4.887 4.994 655 H VAL 92 H VAL 92 0.104 -2.862 7.493 656 HA VAL 92 HA VAL 92 -1.283 -0.641 6.141 657 HB VAL 92 HB VAL 92 -1.725 -1.335 9.045 658 HG11 VAL 92 HG11 VAL 92 -2.136 0.979 8.469 659 HG12 VAL 92 HG12 VAL 92 -3.671 0.161 8.766 660 HG13 VAL 92 HG13 VAL 92 -3.148 0.488 7.111 661 HG21 VAL 92 HG21 VAL 92 -3.490 -2.012 6.690 662 HG22 VAL 92 HG22 VAL 92 -3.892 -2.256 8.390 663 HG23 VAL 92 HG23 VAL 92 -2.574 -3.169 7.656 664 H ILE 93 H ILE 93 0.222 0.861 5.900 665 HA ILE 93 HA ILE 93 1.825 1.614 8.254 666 HB ILE 93 HB ILE 93 3.474 2.567 6.508 667 HG12 ILE 93 HG12 ILE 93 2.238 0.481 4.735 668 HG13 ILE 93 HG11 ILE 93 1.835 2.173 4.613 669 HG21 ILE 93 HG21 ILE 93 3.171 -0.416 6.795 670 HG22 ILE 93 HG22 ILE 93 3.960 0.660 7.947 671 HG23 ILE 93 HG23 ILE 93 4.645 0.437 6.336 672 HD11 ILE 93 HD11 ILE 93 3.504 1.658 2.989 673 HD12 ILE 93 HD12 ILE 93 4.534 0.945 4.235 674 HD13 ILE 93 HD13 ILE 93 4.215 2.683 4.252 675 H GLN 94 H GLN 94 1.070 3.460 9.063 676 HA GLN 94 HA GLN 94 -0.287 5.308 7.257 677 HB2 GLN 94 HB2 GLN 94 -1.111 6.382 9.378 678 HB3 GLN 94 HB1 GLN 94 -1.665 4.741 9.090 679 HG2 GLN 94 HG2 GLN 94 0.075 3.927 10.648 680 HG3 GLN 94 HG1 GLN 94 0.499 5.603 10.991 681 HE21 GLN 94 HE21 GLN 94 -1.907 3.125 11.350 682 HE22 GLN 94 HE22 GLN 94 -2.838 3.921 12.574 683 H GLN 95 H GLN 95 0.832 6.846 6.428 684 HA GLN 95 HA GLN 95 2.852 8.241 8.062 685 HB2 GLN 95 HB2 GLN 95 3.204 6.796 5.650 686 HB3 GLN 95 HB1 GLN 95 3.346 8.492 5.233 687 HG2 GLN 95 HG2 GLN 95 4.937 7.040 7.337 688 HG3 GLN 95 HG1 GLN 95 5.508 7.496 5.737 689 HE21 GLN 95 HE21 GLN 95 4.081 10.104 5.900 690 HE22 GLN 95 HE22 GLN 95 5.067 11.077 6.931 691 H GLU 96 H GLU 96 2.572 10.428 8.181 692 HA GLU 96 HA GLU 96 0.270 11.536 6.803 693 HB2 GLU 96 HB2 GLU 96 0.509 12.109 9.133 694 HB3 GLU 96 HB1 GLU 96 2.127 12.743 8.860 695 HG2 GLU 96 HG2 GLU 96 1.102 14.452 7.350 696 HG3 GLU 96 HG1 GLU 96 -0.480 13.870 7.865 697 H THR 97 H THR 97 0.309 12.787 5.120 698 HA THR 97 HA THR 97 2.569 13.107 3.508 699 HB THR 97 HB THR 97 1.087 14.782 2.303 700 HG1 THR 97 HG1 THR 97 -1.225 14.289 3.271 701 HG21 THR 97 HG21 THR 97 1.148 12.398 1.694 702 HG22 THR 97 HG22 THR 97 -0.479 13.059 1.520 703 HG23 THR 97 HG23 THR 97 -0.077 12.058 2.915 704 H THR 98 H THR 98 4.250 14.399 3.818 705 HA THR 98 HA THR 98 4.277 16.533 5.694 706 HB THR 98 HB THR 98 6.284 15.889 3.523 707 HG1 THR 98 HG1 THR 98 5.899 14.887 6.153 708 HG21 THR 98 HG21 THR 98 6.581 17.429 6.108 709 HG22 THR 98 HG22 THR 98 6.616 18.111 4.483 710 HG23 THR 98 HG23 THR 98 7.895 17.017 5.007 711 H GLY 99 H GLY 99 3.880 16.248 2.248 712 HA2 GLY 99 HA2 GLY 99 3.012 17.703 0.711 713 HA3 GLY 99 HA1 GLY 99 2.526 18.722 2.044 714 H THR 100 H THR 100 3.402 20.649 2.098 715 HA THR 100 HA THR 100 5.771 21.188 0.486 716 HB THR 100 HB THR 100 4.044 23.157 1.989 717 HG1 THR 100 HG1 THR 100 3.456 21.684 -0.184 718 HG21 THR 100 HG21 THR 100 5.950 23.505 -0.308 719 HG22 THR 100 HG22 THR 100 6.216 24.008 1.361 720 HG23 THR 100 HG23 THR 100 4.946 24.765 0.406 721 HA PRO 101 HA PRO 101 8.365 20.949 4.172 722 HB2 PRO 101 HB2 PRO 101 10.183 22.458 2.364 723 HB3 PRO 101 HB1 PRO 101 10.491 20.986 3.291 724 HG2 PRO 101 HG2 PRO 101 10.148 20.889 0.649 725 HG3 PRO 101 HG1 PRO 101 9.501 19.620 1.704 726 HD2 PRO 101 HD2 PRO 101 8.076 21.874 0.354 727 HD3 PRO 101 HD1 PRO 101 7.541 20.204 0.637 728 H ARG 102 H ARG 102 8.435 22.359 5.818 729 HA ARG 102 HA ARG 102 7.464 25.046 5.352 730 HB2 ARG 102 HB2 ARG 102 8.221 23.704 7.956 731 HB3 ARG 102 HB1 ARG 102 7.343 25.217 7.785 732 HG2 ARG 102 HG2 ARG 102 6.383 22.493 6.936 733 HG3 ARG 102 HG1 ARG 102 5.837 23.409 8.340 734 HD2 ARG 102 HD2 ARG 102 4.991 25.167 6.847 735 HD3 ARG 102 HD1 ARG 102 5.516 24.223 5.452 736 HE ARG 102 HE ARG 102 3.761 22.776 7.197 737 HH11 ARG 102 HH11 ARG 102 3.876 25.058 4.539 738 HH12 ARG 102 HH12 ARG 102 2.292 24.652 3.960 739 HH21 ARG 102 HH21 ARG 102 1.682 22.239 6.428 740 HH22 ARG 102 HH22 ARG 102 1.052 23.040 5.027 741 H SER 103 H SER 103 9.851 24.885 4.142 742 HA SER 103 HA SER 103 12.071 25.601 5.745 743 HB2 SER 103 HB2 SER 103 11.600 26.212 2.818 744 HB3 SER 103 HB1 SER 103 13.157 26.153 3.645 745 HG SER 103 HG SER 103 12.893 23.950 3.944 746 H ASP 104 H ASP 104 9.605 27.445 4.040 747 HA ASP 104 HA ASP 104 10.743 29.948 5.026 748 HB2 ASP 104 HB2 ASP 104 8.435 29.422 3.138 749 HB3 ASP 104 HB1 ASP 104 8.974 31.024 3.633 750 H GLY 105 H GLY 105 9.115 31.550 5.904 751 HA2 GLY 105 HA2 GLY 105 7.406 32.121 7.351 752 HA3 GLY 105 HA1 GLY 105 6.781 30.486 7.202 753 H THR 106 H THR 106 10.052 31.318 8.175 754 HA THR 106 HA THR 106 9.519 29.999 10.740 755 HB THR 106 HB THR 106 12.206 30.527 9.454 756 HG1 THR 106 HG1 THR 106 10.298 28.559 9.048 757 HG21 THR 106 HG21 THR 106 12.293 30.203 11.882 758 HG22 THR 106 HG22 THR 106 13.005 28.828 11.036 759 HG23 THR 106 HG23 THR 106 11.383 28.701 11.718 Start of MODEL 23 1 H1 GLY 1 HT1 GLY 1 9.770 -29.053 -8.027 2 H2 GLY 1 HT2 GLY 1 9.160 -30.001 -9.285 3 H3 GLY 1 HT3 GLY 1 8.691 -30.310 -7.693 4 HA2 GLY 1 HA1 GLY 1 8.062 -27.860 -9.233 5 HA3 GLY 1 HA2 GLY 1 6.940 -29.173 -8.900 6 H SER 2 H SER 2 5.558 -28.682 -7.341 7 HA SER 2 HA SER 2 6.548 -27.355 -4.934 8 HB2 SER 2 HB2 SER 2 4.134 -26.395 -6.489 9 HB3 SER 2 HB1 SER 2 4.691 -25.750 -4.948 10 HG SER 2 HG SER 2 6.709 -25.267 -6.081 11 H HIS 3 H HIS 3 5.854 -30.072 -5.339 12 HA HIS 3 HA HIS 3 3.209 -30.570 -4.387 13 HB2 HIS 3 HB2 HIS 3 4.549 -32.257 -5.640 14 HB3 HIS 3 HB1 HIS 3 5.626 -32.393 -4.256 15 HD1 HIS 3 HD1 HIS 3 2.332 -33.512 -5.545 16 HD2 HIS 3 HD2 HIS 3 4.498 -33.727 -2.006 17 HE1 HIS 3 HE1 HIS 3 1.176 -35.253 -4.152 18 HE2 HIS 3 HE2 HIS 3 2.600 -35.485 -2.091 19 H MET 4 H MET 4 6.398 -30.388 -2.858 20 HA MET 4 HA MET 4 5.161 -30.646 -0.223 21 HB2 MET 4 HB2 MET 4 7.206 -31.924 -0.592 22 HB3 MET 4 HB1 MET 4 8.069 -30.459 -1.036 23 HG2 MET 4 HG2 MET 4 8.613 -31.147 1.225 24 HG3 MET 4 HG1 MET 4 7.788 -29.589 1.217 25 HE1 MET 4 HE1 MET 4 7.546 -33.395 1.994 26 HE2 MET 4 HE2 MET 4 6.248 -33.224 0.813 27 HE3 MET 4 HE3 MET 4 5.868 -33.584 2.495 28 H GLY 5 H GLY 5 7.419 -28.441 -1.877 29 HA2 GLY 5 HA2 GLY 5 6.842 -26.358 0.067 30 HA3 GLY 5 HA1 GLY 5 8.021 -26.277 -1.235 31 H THR 6 H THR 6 4.532 -26.310 -0.616 32 HA THR 6 HA THR 6 4.120 -24.845 -3.122 33 HB THR 6 HB THR 6 2.698 -26.832 -2.725 34 HG1 THR 6 HG1 THR 6 1.688 -24.266 -3.098 35 HG21 THR 6 HG21 THR 6 0.931 -26.748 -1.017 36 HG22 THR 6 HG22 THR 6 1.614 -25.246 -0.396 37 HG23 THR 6 HG23 THR 6 2.541 -26.743 -0.299 38 H THR 7 H THR 7 4.613 -24.330 0.093 39 HA THR 7 HA THR 7 4.571 -22.529 1.449 40 HB THR 7 HB THR 7 3.635 -20.789 -0.818 41 HG1 THR 7 HG1 THR 7 6.189 -21.979 -0.418 42 HG21 THR 7 HG21 THR 7 3.875 -19.752 1.377 43 HG22 THR 7 HG22 THR 7 5.129 -19.162 0.289 44 HG23 THR 7 HG23 THR 7 5.520 -20.371 1.508 45 H THR 8 H THR 8 2.582 -23.922 2.067 46 HA THR 8 HA THR 8 -0.025 -22.970 1.595 47 HB THR 8 HB THR 8 0.933 -24.366 4.102 48 HG1 THR 8 HG1 THR 8 0.087 -25.536 1.631 49 HG21 THR 8 HG21 THR 8 -1.734 -24.363 2.677 50 HG22 THR 8 HG22 THR 8 -1.367 -23.534 4.190 51 HG23 THR 8 HG23 THR 8 -1.340 -25.296 4.123 52 H ALA 9 H ALA 9 -1.105 -21.289 2.391 53 HA ALA 9 HA ALA 9 -1.612 -19.374 3.478 54 HB1 ALA 9 HB1 ALA 9 -1.593 -20.727 5.516 55 HB2 ALA 9 HB2 ALA 9 -1.003 -19.092 5.819 56 HB3 ALA 9 HB3 ALA 9 0.136 -20.433 5.696 57 HA PRO 10 HA PRO 10 2.146 -17.508 1.744 58 HB2 PRO 10 HB2 PRO 10 0.882 -15.373 0.654 59 HB3 PRO 10 HB1 PRO 10 0.924 -16.962 -0.123 60 HG2 PRO 10 HG2 PRO 10 -1.245 -15.707 1.525 61 HG3 PRO 10 HG1 PRO 10 -1.379 -16.620 0.010 62 HD2 PRO 10 HD2 PRO 10 -1.882 -17.739 2.402 63 HD3 PRO 10 HD1 PRO 10 -1.194 -18.646 1.089 64 H ASP 11 H ASP 11 3.385 -15.756 2.320 65 HA ASP 11 HA ASP 11 2.695 -14.474 4.808 66 HB2 ASP 11 HB2 ASP 11 5.063 -13.659 3.156 67 HB3 ASP 11 HB1 ASP 11 4.902 -13.722 4.902 68 H ALA 12 H ALA 12 2.380 -12.253 5.094 69 HA ALA 12 HA ALA 12 2.011 -10.613 2.680 70 HB1 ALA 12 HB1 ALA 12 0.310 -10.386 4.416 71 HB2 ALA 12 HB2 ALA 12 1.239 -8.891 4.295 72 HB3 ALA 12 HB3 ALA 12 1.547 -10.018 5.616 73 HA PRO 13 HA PRO 13 6.061 -8.830 3.238 74 HB2 PRO 13 HB2 PRO 13 4.941 -6.137 2.790 75 HB3 PRO 13 HB1 PRO 13 6.144 -7.022 1.846 76 HG2 PRO 13 HG2 PRO 13 3.677 -6.645 0.906 77 HG3 PRO 13 HG1 PRO 13 4.536 -8.175 0.631 78 HD2 PRO 13 HD2 PRO 13 2.439 -7.519 2.666 79 HD3 PRO 13 HD1 PRO 13 2.569 -8.953 1.620 80 HA PRO 14 HA PRO 14 6.018 -7.510 7.585 81 HB2 PRO 14 HB2 PRO 14 8.813 -6.917 6.697 82 HB3 PRO 14 HB1 PRO 14 8.251 -7.713 8.173 83 HG2 PRO 14 HG2 PRO 14 9.279 -9.131 6.167 84 HG3 PRO 14 HG1 PRO 14 7.905 -9.741 7.107 85 HD2 PRO 14 HD2 PRO 14 7.968 -8.625 4.350 86 HD3 PRO 14 HD1 PRO 14 6.902 -9.858 5.049 87 H ASP 15 H ASP 15 6.045 -5.500 8.548 88 HA ASP 15 HA ASP 15 4.783 -3.524 7.280 89 HB2 ASP 15 HB2 ASP 15 6.755 -3.213 9.540 90 HB3 ASP 15 HB1 ASP 15 5.668 -1.931 9.013 91 HA PRO 16 HA PRO 16 7.826 -2.134 4.265 92 HB2 PRO 16 HB2 PRO 16 5.432 -0.604 3.401 93 HB3 PRO 16 HB1 PRO 16 6.484 -1.670 2.437 94 HG2 PRO 16 HG2 PRO 16 4.076 -2.492 3.127 95 HG3 PRO 16 HG1 PRO 16 5.449 -3.602 3.263 96 HD2 PRO 16 HD2 PRO 16 4.124 -1.988 5.429 97 HD3 PRO 16 HD1 PRO 16 4.529 -3.725 5.428 98 H THR 17 H THR 17 8.774 -0.187 3.761 99 HA THR 17 HA THR 17 8.224 1.960 5.712 100 HB THR 17 HB THR 17 10.877 1.278 4.419 101 HG1 THR 17 HG1 THR 17 9.847 0.710 7.024 102 HG21 THR 17 HG21 THR 17 10.197 3.137 6.706 103 HG22 THR 17 HG22 THR 17 10.646 3.638 5.076 104 HG23 THR 17 HG23 THR 17 11.816 2.798 6.093 105 H VAL 18 H VAL 18 7.734 3.809 5.045 106 HA VAL 18 HA VAL 18 7.507 4.467 2.268 107 HB VAL 18 HB VAL 18 7.146 6.143 4.757 108 HG11 VAL 18 HG11 VAL 18 6.054 7.795 3.269 109 HG12 VAL 18 HG12 VAL 18 6.620 6.879 1.864 110 HG13 VAL 18 HG13 VAL 18 7.782 7.631 2.966 111 HG21 VAL 18 HG21 VAL 18 5.516 4.294 4.355 112 HG22 VAL 18 HG22 VAL 18 5.094 5.075 2.830 113 HG23 VAL 18 HG23 VAL 18 4.800 5.907 4.355 114 H ASP 19 H ASP 19 8.970 5.316 0.994 115 HA ASP 19 HA ASP 19 11.632 5.785 2.033 116 HB2 ASP 19 HB2 ASP 19 11.071 4.422 -0.047 117 HB3 ASP 19 HB1 ASP 19 10.733 5.956 -0.842 118 H GLN 20 H GLN 20 9.136 7.580 0.293 119 HA GLN 20 HA GLN 20 10.396 10.083 1.164 120 HB2 GLN 20 HB2 GLN 20 9.384 9.499 -1.623 121 HB3 GLN 20 HB1 GLN 20 9.731 11.113 -1.029 122 HG2 GLN 20 HG2 GLN 20 12.083 10.349 -0.618 123 HG3 GLN 20 HG1 GLN 20 11.669 8.864 -1.476 124 HE21 GLN 20 HE21 GLN 20 13.112 9.272 -3.152 125 HE22 GLN 20 HE22 GLN 20 12.855 10.494 -4.314 126 H VAL 21 H VAL 21 9.011 11.636 1.796 127 HA VAL 21 HA VAL 21 6.136 11.064 1.501 128 HB VAL 21 HB VAL 21 7.413 12.401 3.889 129 HG11 VAL 21 HG11 VAL 21 5.205 12.145 4.917 130 HG12 VAL 21 HG12 VAL 21 4.589 11.473 3.407 131 HG13 VAL 21 HG13 VAL 21 5.144 13.146 3.467 132 HG21 VAL 21 HG21 VAL 21 6.877 10.367 5.136 133 HG22 VAL 21 HG22 VAL 21 8.025 10.047 3.834 134 HG23 VAL 21 HG23 VAL 21 6.329 9.601 3.645 135 H ASP 22 H ASP 22 5.170 12.572 0.296 136 HA ASP 22 HA ASP 22 6.081 15.360 0.566 137 HB2 ASP 22 HB2 ASP 22 5.092 13.968 -1.933 138 HB3 ASP 22 HB1 ASP 22 5.345 15.704 -1.805 139 H ASP 23 H ASP 23 3.991 16.412 -1.063 140 HA ASP 23 HA ASP 23 1.830 16.395 0.857 141 HB2 ASP 23 HB2 ASP 23 0.881 18.166 -0.611 142 HB3 ASP 23 HB1 ASP 23 2.511 18.513 -0.076 143 H THR 24 H THR 24 2.192 15.780 -2.592 144 HA THR 24 HA THR 24 -0.410 14.385 -2.581 145 HB THR 24 HB THR 24 -0.555 15.175 -4.979 146 HG1 THR 24 HG1 THR 24 1.300 17.194 -4.350 147 HG21 THR 24 HG21 THR 24 -1.257 17.442 -4.365 148 HG22 THR 24 HG22 THR 24 -0.361 17.316 -2.846 149 HG23 THR 24 HG23 THR 24 -1.766 16.280 -3.134 150 H SER 25 H SER 25 2.178 13.263 -2.087 151 HA SER 25 HA SER 25 2.251 11.073 -3.836 152 HB2 SER 25 HB2 SER 25 4.583 11.508 -4.753 153 HB3 SER 25 HB1 SER 25 3.293 12.479 -5.462 154 HG SER 25 HG SER 25 5.230 13.264 -3.553 155 H ILE 26 H ILE 26 3.115 9.420 -2.752 156 HA ILE 26 HA ILE 26 5.250 9.835 -0.798 157 HB ILE 26 HB ILE 26 2.518 8.770 -0.050 158 HG12 ILE 26 HG12 ILE 26 4.308 10.821 1.262 159 HG13 ILE 26 HG11 ILE 26 2.890 11.174 0.286 160 HG21 ILE 26 HG21 ILE 26 3.467 8.036 2.092 161 HG22 ILE 26 HG22 ILE 26 5.083 8.398 1.484 162 HG23 ILE 26 HG23 ILE 26 4.117 7.129 0.724 163 HD11 ILE 26 HD11 ILE 26 2.308 11.388 2.589 164 HD12 ILE 26 HD12 ILE 26 2.962 9.788 2.952 165 HD13 ILE 26 HD13 ILE 26 1.519 9.945 1.951 166 H VAL 27 H VAL 27 6.498 7.879 -0.516 167 HA VAL 27 HA VAL 27 5.666 5.789 -2.439 168 HB VAL 27 HB VAL 27 8.496 6.523 -1.696 169 HG11 VAL 27 HG11 VAL 27 7.773 4.126 -2.435 170 HG12 VAL 27 HG12 VAL 27 9.211 4.869 -3.148 171 HG13 VAL 27 HG13 VAL 27 7.690 4.854 -4.044 172 HG21 VAL 27 HG21 VAL 27 7.472 8.302 -3.006 173 HG22 VAL 27 HG22 VAL 27 6.966 7.131 -4.223 174 HG23 VAL 27 HG23 VAL 27 8.682 7.441 -3.957 175 H VAL 28 H VAL 28 5.663 3.687 -1.705 176 HA VAL 28 HA VAL 28 6.833 3.281 0.955 177 HB VAL 28 HB VAL 28 4.996 2.389 1.856 178 HG11 VAL 28 HG11 VAL 28 2.946 3.401 1.224 179 HG12 VAL 28 HG12 VAL 28 3.602 3.809 -0.361 180 HG13 VAL 28 HG13 VAL 28 4.266 4.556 1.092 181 HG21 VAL 28 HG21 VAL 28 3.335 1.014 0.757 182 HG22 VAL 28 HG22 VAL 28 4.984 0.445 0.439 183 HG23 VAL 28 HG23 VAL 28 4.105 1.351 -0.795 184 H ARG 29 H ARG 29 7.707 1.250 1.366 185 HA ARG 29 HA ARG 29 8.126 -0.458 -1.010 186 HB2 ARG 29 HB2 ARG 29 10.275 0.361 0.961 187 HB3 ARG 29 HB1 ARG 29 10.492 -0.619 -0.482 188 HG2 ARG 29 HG2 ARG 29 10.047 1.257 -1.898 189 HG3 ARG 29 HG1 ARG 29 9.592 2.253 -0.517 190 HD2 ARG 29 HD2 ARG 29 11.853 2.770 -1.300 191 HD3 ARG 29 HD1 ARG 29 11.860 2.134 0.342 192 HE ARG 29 HE ARG 29 12.263 -0.046 -1.273 193 HH11 ARG 29 HH11 ARG 29 13.878 3.028 -0.755 194 HH12 ARG 29 HH12 ARG 29 15.450 2.396 -1.142 195 HH21 ARG 29 HH21 ARG 29 14.325 -0.870 -1.760 196 HH22 ARG 29 HH22 ARG 29 15.706 0.179 -1.706 197 H TRP 30 H TRP 30 7.681 -2.476 -0.630 198 HA TRP 30 HA TRP 30 7.496 -3.386 2.169 199 HB2 TRP 30 HB2 TRP 30 5.693 -4.942 1.366 200 HB3 TRP 30 HB1 TRP 30 5.287 -3.236 1.220 201 HD1 TRP 30 HD1 TRP 30 6.269 -6.226 -0.944 202 HE1 TRP 30 HE1 TRP 30 5.464 -5.802 -3.349 203 HE3 TRP 30 HE3 TRP 30 4.547 -1.483 -0.354 204 HZ2 TRP 30 HZ2 TRP 30 4.191 -3.733 -4.780 205 HZ3 TRP 30 HZ3 TRP 30 3.514 -0.364 -2.281 206 HH2 TRP 30 HH2 TRP 30 3.333 -1.452 -4.432 207 H SER 31 H SER 31 8.127 -5.463 2.714 208 HA SER 31 HA SER 31 9.984 -6.741 0.866 209 HB2 SER 31 HB2 SER 31 9.379 -7.342 3.774 210 HB3 SER 31 HB1 SER 31 10.667 -8.075 2.820 211 HG SER 31 HG SER 31 10.447 -5.274 3.170 212 H ARG 32 H ARG 32 8.639 -7.651 -0.592 213 HA ARG 32 HA ARG 32 6.226 -8.908 -0.280 214 HB2 ARG 32 HB2 ARG 32 6.941 -10.124 -2.449 215 HB3 ARG 32 HB1 ARG 32 6.828 -8.368 -2.455 216 HG2 ARG 32 HG2 ARG 32 9.441 -9.413 -1.692 217 HG3 ARG 32 HG1 ARG 32 8.959 -9.790 -3.345 218 HD2 ARG 32 HD2 ARG 32 8.667 -7.469 -3.847 219 HD3 ARG 32 HD1 ARG 32 8.880 -7.012 -2.153 220 HE ARG 32 HE ARG 32 11.212 -7.696 -2.364 221 HH11 ARG 32 HH11 ARG 32 9.435 -7.288 -5.350 222 HH12 ARG 32 HH12 ARG 32 10.853 -6.995 -6.299 223 HH21 ARG 32 HH21 ARG 32 13.073 -7.292 -3.604 224 HH22 ARG 32 HH22 ARG 32 12.924 -6.999 -5.310 225 HA PRO 33 HA PRO 33 6.667 -12.818 1.569 226 HB2 PRO 33 HB2 PRO 33 4.882 -14.130 -0.318 227 HB3 PRO 33 HB1 PRO 33 4.563 -13.629 1.343 228 HG2 PRO 33 HG2 PRO 33 3.411 -12.453 -0.811 229 HG3 PRO 33 HG1 PRO 33 3.741 -11.592 0.706 230 HD2 PRO 33 HD2 PRO 33 5.270 -11.580 -1.856 231 HD3 PRO 33 HD1 PRO 33 4.886 -10.236 -0.768 232 H GLN 34 H GLN 34 7.104 -15.110 1.347 233 HA GLN 34 HA GLN 34 8.912 -15.707 -0.864 234 HB2 GLN 34 HB2 GLN 34 8.235 -17.376 1.560 235 HB3 GLN 34 HB1 GLN 34 9.561 -17.635 0.435 236 HG2 GLN 34 HG2 GLN 34 10.610 -15.574 1.147 237 HG3 GLN 34 HG1 GLN 34 9.259 -15.242 2.231 238 HE21 GLN 34 HE21 GLN 34 9.047 -16.441 4.124 239 HE22 GLN 34 HE22 GLN 34 10.350 -17.382 4.761 240 H ALA 35 H ALA 35 5.763 -15.747 -0.446 241 HA ALA 35 HA ALA 35 5.065 -18.360 -1.479 242 HB1 ALA 35 HB1 ALA 35 3.257 -15.962 -1.204 243 HB2 ALA 35 HB2 ALA 35 3.674 -16.996 0.166 244 HB3 ALA 35 HB3 ALA 35 2.808 -17.670 -1.215 245 HA PRO 36 HA PRO 36 4.912 -16.950 -5.722 246 HB2 PRO 36 HB2 PRO 36 3.217 -18.803 -6.741 247 HB3 PRO 36 HB1 PRO 36 4.900 -19.175 -6.351 248 HG2 PRO 36 HG2 PRO 36 2.414 -19.805 -4.829 249 HG3 PRO 36 HG1 PRO 36 3.881 -20.776 -5.034 250 HD2 PRO 36 HD2 PRO 36 3.288 -19.283 -2.792 251 HD3 PRO 36 HD1 PRO 36 4.926 -19.765 -3.270 252 H ILE 37 H ILE 37 3.828 -15.147 -6.115 253 HA ILE 37 HA ILE 37 0.948 -15.044 -5.520 254 HB ILE 37 HB ILE 37 1.278 -12.652 -4.925 255 HG12 ILE 37 HG12 ILE 37 4.140 -13.359 -5.468 256 HG13 ILE 37 HG11 ILE 37 3.218 -11.967 -6.003 257 HG21 ILE 37 HG21 ILE 37 2.816 -14.685 -3.299 258 HG22 ILE 37 HG22 ILE 37 1.131 -14.192 -3.107 259 HG23 ILE 37 HG23 ILE 37 2.431 -13.055 -2.725 260 HD11 ILE 37 HD11 ILE 37 4.676 -11.102 -4.422 261 HD12 ILE 37 HD12 ILE 37 4.460 -12.479 -3.344 262 HD13 ILE 37 HD13 ILE 37 3.162 -11.301 -3.530 263 H THR 38 H THR 38 -0.256 -13.483 -6.844 264 HA THR 38 HA THR 38 0.757 -13.508 -9.572 265 HB THR 38 HB THR 38 -1.612 -12.648 -10.070 266 HG1 THR 38 HG1 THR 38 -2.822 -12.333 -8.377 267 HG21 THR 38 HG21 THR 38 -1.240 -15.385 -8.899 268 HG22 THR 38 HG22 THR 38 -0.826 -14.895 -10.541 269 HG23 THR 38 HG23 THR 38 -2.507 -14.882 -10.018 270 H GLY 39 H GLY 39 -0.320 -11.159 -7.134 271 HA2 GLY 39 HA2 GLY 39 1.229 -9.133 -8.374 272 HA3 GLY 39 HA1 GLY 39 -0.478 -8.908 -8.715 273 H TYR 40 H TYR 40 -0.112 -6.889 -7.592 274 HA TYR 40 HA TYR 40 -0.614 -7.222 -4.723 275 HB2 TYR 40 HB2 TYR 40 1.513 -5.586 -6.014 276 HB3 TYR 40 HB1 TYR 40 0.668 -4.896 -4.632 277 HD1 TYR 40 HD2 TYR 40 1.966 -8.302 -5.457 278 HD2 TYR 40 HD1 TYR 40 1.855 -5.076 -2.695 279 HE1 TYR 40 HE2 TYR 40 3.433 -9.543 -3.946 280 HE2 TYR 40 HE1 TYR 40 3.290 -6.336 -1.164 281 HH TYR 40 HH TYR 40 4.888 -9.214 -2.143 282 H ARG 41 H ARG 41 -2.288 -6.100 -4.025 283 HA ARG 41 HA ARG 41 -3.256 -3.854 -5.659 284 HB2 ARG 41 HB2 ARG 41 -4.778 -4.849 -3.327 285 HB3 ARG 41 HB1 ARG 41 -5.341 -4.284 -4.894 286 HG2 ARG 41 HG2 ARG 41 -4.542 -6.391 -5.906 287 HG3 ARG 41 HG1 ARG 41 -4.036 -6.938 -4.306 288 HD2 ARG 41 HD2 ARG 41 -6.779 -6.538 -5.395 289 HD3 ARG 41 HD1 ARG 41 -6.104 -7.956 -4.620 290 HE ARG 41 HE ARG 41 -6.271 -6.792 -2.515 291 HH11 ARG 41 HH11 ARG 41 -7.967 -5.307 -5.193 292 HH12 ARG 41 HH12 ARG 41 -9.118 -4.497 -4.181 293 HH21 ARG 41 HH21 ARG 41 -7.805 -5.730 -1.176 294 HH22 ARG 41 HH22 ARG 41 -9.030 -4.740 -1.906 295 H ILE 42 H ILE 42 -3.632 -1.868 -4.647 296 HA ILE 42 HA ILE 42 -2.438 -1.594 -1.969 297 HB ILE 42 HB ILE 42 -1.646 0.177 -4.258 298 HG12 ILE 42 HG12 ILE 42 -0.029 -2.024 -3.001 299 HG13 ILE 42 HG11 ILE 42 -0.903 -2.198 -4.514 300 HG21 ILE 42 HG21 ILE 42 -1.538 1.067 -1.907 301 HG22 ILE 42 HG22 ILE 42 -0.006 1.065 -2.774 302 HG23 ILE 42 HG23 ILE 42 -0.337 -0.179 -1.566 303 HD11 ILE 42 HD11 ILE 42 1.348 -0.307 -3.960 304 HD12 ILE 42 HD12 ILE 42 0.454 -0.409 -5.476 305 HD13 ILE 42 HD13 ILE 42 1.420 -1.778 -4.922 306 H VAL 43 H VAL 43 -3.985 -0.706 -0.747 307 HA VAL 43 HA VAL 43 -5.495 1.506 -1.991 308 HB VAL 43 HB VAL 43 -6.371 -0.317 0.251 309 HG11 VAL 43 HG11 VAL 43 -7.742 2.115 -0.865 310 HG12 VAL 43 HG12 VAL 43 -7.058 1.937 0.752 311 HG13 VAL 43 HG13 VAL 43 -8.444 0.963 0.272 312 HG21 VAL 43 HG21 VAL 43 -6.590 -1.239 -2.014 313 HG22 VAL 43 HG22 VAL 43 -7.518 0.186 -2.487 314 HG23 VAL 43 HG23 VAL 43 -8.161 -0.922 -1.278 315 H TYR 44 H TYR 44 -4.667 3.338 -1.434 316 HA TYR 44 HA TYR 44 -3.899 3.750 1.352 317 HB2 TYR 44 HB2 TYR 44 -2.673 5.814 0.282 318 HB3 TYR 44 HB1 TYR 44 -1.926 4.224 0.265 319 HD1 TYR 44 HD2 TYR 44 -2.290 2.805 -1.859 320 HD2 TYR 44 HD1 TYR 44 -2.902 7.005 -1.720 321 HE1 TYR 44 HE2 TYR 44 -2.027 2.897 -4.287 322 HE2 TYR 44 HE1 TYR 44 -2.631 7.127 -4.154 323 HH TYR 44 HH TYR 44 -1.813 5.968 -5.971 324 H SER 45 H SER 45 -4.967 5.031 2.494 325 HA SER 45 HA SER 45 -6.885 6.867 1.245 326 HB2 SER 45 HB2 SER 45 -8.568 5.964 2.968 327 HB3 SER 45 HB1 SER 45 -8.219 4.947 1.569 328 HG SER 45 HG SER 45 -6.839 4.695 4.037 329 HA PRO 46 HA PRO 46 -5.555 9.589 4.566 330 HB2 PRO 46 HB2 PRO 46 -8.042 10.991 4.076 331 HB3 PRO 46 HB1 PRO 46 -6.394 11.556 3.880 332 HG2 PRO 46 HG2 PRO 46 -8.017 11.082 1.780 333 HG3 PRO 46 HG1 PRO 46 -6.260 10.859 1.707 334 HD2 PRO 46 HD2 PRO 46 -8.425 8.826 1.976 335 HD3 PRO 46 HD1 PRO 46 -6.892 8.744 1.082 336 H SER 47 H SER 47 -5.863 9.366 6.660 337 HA SER 47 HA SER 47 -7.711 7.540 7.667 338 HB2 SER 47 HB2 SER 47 -6.218 9.640 9.243 339 HB3 SER 47 HB1 SER 47 -6.821 8.091 9.834 340 HG SER 47 HG SER 47 -5.351 7.050 8.467 341 H VAL 48 H VAL 48 -8.010 11.003 7.272 342 HA VAL 48 HA VAL 48 -10.483 10.921 8.850 343 HB VAL 48 HB VAL 48 -10.391 13.424 8.766 344 HG11 VAL 48 HG11 VAL 48 -8.029 11.999 9.987 345 HG12 VAL 48 HG12 VAL 48 -9.619 12.209 10.721 346 HG13 VAL 48 HG13 VAL 48 -8.589 13.611 10.433 347 HG21 VAL 48 HG21 VAL 48 -7.670 12.897 7.579 348 HG22 VAL 48 HG22 VAL 48 -8.216 14.453 8.199 349 HG23 VAL 48 HG23 VAL 48 -9.014 13.730 6.803 350 H GLU 49 H GLU 49 -9.217 11.964 5.704 351 HA GLU 49 HA GLU 49 -11.189 11.044 4.086 352 HB2 GLU 49 HB2 GLU 49 -12.694 12.868 3.608 353 HB3 GLU 49 HB1 GLU 49 -12.780 12.514 5.326 354 HG2 GLU 49 HG2 GLU 49 -11.385 14.430 5.820 355 HG3 GLU 49 HG1 GLU 49 -11.207 14.766 4.098 356 H GLY 50 H GLY 50 -11.038 11.865 1.892 357 HA2 GLY 50 HA2 GLY 50 -9.876 13.947 0.771 358 HA3 GLY 50 HA1 GLY 50 -8.452 13.154 1.429 359 H SER 51 H SER 51 -7.495 12.600 -0.495 360 HA SER 51 HA SER 51 -9.043 11.126 -2.467 361 HB2 SER 51 HB2 SER 51 -6.143 12.020 -2.511 362 HB3 SER 51 HB1 SER 51 -7.032 11.314 -3.866 363 HG SER 51 HG SER 51 -8.185 13.526 -2.641 364 H SER 52 H SER 52 -9.166 8.975 -2.429 365 HA SER 52 HA SER 52 -6.914 7.468 -1.253 366 HB2 SER 52 HB2 SER 52 -9.732 6.412 -1.530 367 HB3 SER 52 HB1 SER 52 -8.427 5.779 -0.529 368 HG SER 52 HG SER 52 -9.718 8.291 -0.172 369 H THR 53 H THR 53 -6.190 5.636 -2.396 370 HA THR 53 HA THR 53 -7.314 5.245 -5.065 371 HB THR 53 HB THR 53 -4.407 5.984 -4.680 372 HG1 THR 53 HG1 THR 53 -6.669 7.511 -5.093 373 HG21 THR 53 HG21 THR 53 -4.762 4.506 -6.572 374 HG22 THR 53 HG22 THR 53 -4.381 6.134 -7.133 375 HG23 THR 53 HG23 THR 53 -6.046 5.554 -7.178 376 H GLU 54 H GLU 54 -6.528 3.357 -6.137 377 HA GLU 54 HA GLU 54 -5.247 1.373 -4.423 378 HB2 GLU 54 HB2 GLU 54 -7.685 1.003 -4.513 379 HB3 GLU 54 HB1 GLU 54 -7.612 0.974 -6.268 380 HG2 GLU 54 HG2 GLU 54 -6.144 -1.018 -6.119 381 HG3 GLU 54 HG1 GLU 54 -6.398 -1.021 -4.374 382 H LEU 55 H LEU 55 -3.340 0.903 -5.371 383 HA LEU 55 HA LEU 55 -3.226 0.932 -8.302 384 HB2 LEU 55 HB2 LEU 55 -0.951 1.040 -6.287 385 HB3 LEU 55 HB1 LEU 55 -0.738 0.870 -8.029 386 HG LEU 55 HG LEU 55 -1.809 3.205 -6.503 387 HD11 LEU 55 HD11 LEU 55 0.482 2.756 -8.372 388 HD12 LEU 55 HD12 LEU 55 0.498 3.375 -6.718 389 HD13 LEU 55 HD13 LEU 55 -0.135 4.370 -8.025 390 HD21 LEU 55 HD21 LEU 55 -3.379 2.908 -8.300 391 HD22 LEU 55 HD22 LEU 55 -2.067 2.708 -9.461 392 HD23 LEU 55 HD23 LEU 55 -2.323 4.268 -8.680 393 H ASN 56 H ASN 56 -1.950 -0.738 -9.359 394 HA ASN 56 HA ASN 56 -1.983 -3.293 -7.911 395 HB2 ASN 56 HB2 ASN 56 -3.281 -2.597 -10.483 396 HB3 ASN 56 HB1 ASN 56 -2.401 -4.122 -10.456 397 HD21 ASN 56 HD21 ASN 56 -3.144 -5.802 -9.196 398 HD22 ASN 56 HD22 ASN 56 -4.713 -5.804 -8.472 399 H LEU 57 H LEU 57 -0.017 -4.086 -7.798 400 HA LEU 57 HA LEU 57 1.944 -3.204 -9.803 401 HB2 LEU 57 HB2 LEU 57 2.303 -3.844 -6.858 402 HB3 LEU 57 HB1 LEU 57 3.640 -3.699 -7.979 403 HG LEU 57 HG LEU 57 1.919 -1.611 -6.780 404 HD11 LEU 57 HD11 LEU 57 4.182 -2.091 -5.984 405 HD12 LEU 57 HD12 LEU 57 4.021 -0.450 -6.607 406 HD13 LEU 57 HD13 LEU 57 4.814 -1.692 -7.579 407 HD21 LEU 57 HD21 LEU 57 2.537 -0.003 -8.501 408 HD22 LEU 57 HD22 LEU 57 1.478 -1.266 -9.127 409 HD23 LEU 57 HD23 LEU 57 3.206 -1.311 -9.476 410 HA PRO 58 HA PRO 58 2.586 -7.421 -10.861 411 HB2 PRO 58 HB2 PRO 58 5.348 -7.471 -11.039 412 HB3 PRO 58 HB1 PRO 58 4.264 -6.939 -12.324 413 HG2 PRO 58 HG2 PRO 58 5.868 -5.332 -10.409 414 HG3 PRO 58 HG1 PRO 58 5.431 -4.978 -12.088 415 HD2 PRO 58 HD2 PRO 58 4.228 -3.810 -9.940 416 HD3 PRO 58 HD1 PRO 58 3.410 -4.054 -11.491 417 H GLU 59 H GLU 59 3.096 -9.338 -9.925 418 HA GLU 59 HA GLU 59 3.230 -9.763 -7.247 419 HB2 GLU 59 HB2 GLU 59 4.099 -12.006 -7.738 420 HB3 GLU 59 HB1 GLU 59 2.840 -11.545 -8.874 421 HG2 GLU 59 HG2 GLU 59 4.445 -11.116 -10.586 422 HG3 GLU 59 HG1 GLU 59 5.780 -11.298 -9.452 423 H THR 60 H THR 60 5.856 -8.895 -9.296 424 HA THR 60 HA THR 60 7.843 -9.546 -7.254 425 HB THR 60 HB THR 60 8.301 -10.488 -9.441 426 HG1 THR 60 HG1 THR 60 10.000 -8.343 -8.665 427 HG21 THR 60 HG21 THR 60 7.085 -8.956 -10.852 428 HG22 THR 60 HG22 THR 60 8.766 -9.021 -11.381 429 HG23 THR 60 HG23 THR 60 8.190 -7.645 -10.440 430 H ALA 61 H ALA 61 5.965 -7.130 -7.403 431 HA ALA 61 HA ALA 61 7.877 -4.940 -7.645 432 HB1 ALA 61 HB1 ALA 61 5.942 -3.494 -7.178 433 HB2 ALA 61 HB2 ALA 61 4.943 -4.930 -6.955 434 HB3 ALA 61 HB3 ALA 61 5.649 -4.583 -8.533 435 H ASN 62 H ASN 62 8.037 -3.354 -5.850 436 HA ASN 62 HA ASN 62 7.559 -4.481 -3.207 437 HB2 ASN 62 HB2 ASN 62 9.852 -4.284 -2.493 438 HB3 ASN 62 HB1 ASN 62 9.770 -5.352 -3.889 439 HD21 ASN 62 HD21 ASN 62 12.001 -3.798 -2.815 440 HD22 ASN 62 HD22 ASN 62 12.551 -2.797 -4.112 441 H SER 63 H SER 63 6.946 -1.970 -4.957 442 HA SER 63 HA SER 63 6.901 -0.163 -2.768 443 HB2 SER 63 HB2 SER 63 8.468 1.541 -3.805 444 HB3 SER 63 HB1 SER 63 9.249 0.103 -3.150 445 HG SER 63 HG SER 63 8.781 -0.551 -5.588 446 H VAL 64 H VAL 64 5.365 1.346 -3.111 447 HA VAL 64 HA VAL 64 4.492 1.807 -5.897 448 HB VAL 64 HB VAL 64 2.649 0.695 -4.809 449 HG11 VAL 64 HG11 VAL 64 1.956 1.001 -2.717 450 HG12 VAL 64 HG12 VAL 64 2.297 2.730 -2.726 451 HG13 VAL 64 HG13 VAL 64 3.604 1.569 -2.498 452 HG21 VAL 64 HG21 VAL 64 2.122 3.626 -4.889 453 HG22 VAL 64 HG22 VAL 64 0.921 2.332 -4.927 454 HG23 VAL 64 HG23 VAL 64 2.073 2.503 -6.247 455 H THR 65 H THR 65 4.479 3.868 -6.614 456 HA THR 65 HA THR 65 4.909 6.043 -4.746 457 HB THR 65 HB THR 65 4.822 5.831 -7.742 458 HG1 THR 65 HG1 THR 65 6.761 5.121 -7.054 459 HG21 THR 65 HG21 THR 65 5.340 8.303 -6.063 460 HG22 THR 65 HG22 THR 65 3.941 8.029 -7.100 461 HG23 THR 65 HG23 THR 65 5.545 8.195 -7.812 462 H LEU 66 H LEU 66 3.053 6.462 -3.721 463 HA LEU 66 HA LEU 66 0.476 6.485 -4.998 464 HB2 LEU 66 HB2 LEU 66 0.763 7.921 -2.474 465 HB3 LEU 66 HB1 LEU 66 -0.364 6.658 -2.918 466 HG LEU 66 HG LEU 66 2.487 6.024 -2.242 467 HD11 LEU 66 HD11 LEU 66 1.312 7.333 -0.446 468 HD12 LEU 66 HD12 LEU 66 1.973 5.765 -0.015 469 HD13 LEU 66 HD13 LEU 66 0.239 5.942 -0.290 470 HD21 LEU 66 HD21 LEU 66 1.261 4.285 -3.375 471 HD22 LEU 66 HD22 LEU 66 -0.089 4.482 -2.259 472 HD23 LEU 66 HD23 LEU 66 1.453 3.846 -1.673 473 H SER 67 H SER 67 -0.684 8.319 -5.607 474 HA SER 67 HA SER 67 0.707 10.884 -5.396 475 HB2 SER 67 HB2 SER 67 1.260 9.774 -7.602 476 HB3 SER 67 HB1 SER 67 -0.453 9.885 -8.008 477 HG SER 67 HG SER 67 1.469 11.917 -7.751 478 H ASP 68 H ASP 68 -0.794 12.652 -6.310 479 HA ASP 68 HA ASP 68 -2.680 13.875 -6.058 480 HB2 ASP 68 HB2 ASP 68 -3.893 11.183 -6.634 481 HB3 ASP 68 HB1 ASP 68 -4.899 12.593 -6.313 482 H LEU 69 H LEU 69 -1.380 12.760 -3.707 483 HA LEU 69 HA LEU 69 -3.428 12.134 -1.810 484 HB2 LEU 69 HB2 LEU 69 -0.786 13.290 -0.992 485 HB3 LEU 69 HB1 LEU 69 -1.795 12.120 -0.167 486 HG LEU 69 HG LEU 69 -0.155 11.524 -2.620 487 HD11 LEU 69 HD11 LEU 69 1.237 10.273 -1.064 488 HD12 LEU 69 HD12 LEU 69 0.259 10.855 0.284 489 HD13 LEU 69 HD13 LEU 69 1.212 11.991 -0.671 490 HD21 LEU 69 HD21 LEU 69 -0.708 9.152 -1.717 491 HD22 LEU 69 HD22 LEU 69 -1.958 10.020 -2.617 492 HD23 LEU 69 HD23 LEU 69 -2.011 9.975 -0.851 493 H GLN 70 H GLN 70 -3.250 13.669 0.312 494 HA GLN 70 HA GLN 70 -3.598 16.441 -0.605 495 HB2 GLN 70 HB2 GLN 70 -5.752 15.293 -0.145 496 HB3 GLN 70 HB1 GLN 70 -5.228 15.022 1.511 497 HG2 GLN 70 HG2 GLN 70 -6.626 16.884 1.628 498 HG3 GLN 70 HG1 GLN 70 -4.997 17.552 1.673 499 HE21 GLN 70 HE21 GLN 70 -7.529 18.766 0.875 500 HE22 GLN 70 HE22 GLN 70 -7.294 19.340 -0.739 501 HA PRO 71 HA PRO 71 -0.287 17.041 2.318 502 HB2 PRO 71 HB2 PRO 71 -0.553 19.791 2.429 503 HB3 PRO 71 HB1 PRO 71 0.421 18.889 1.269 504 HG2 PRO 71 HG2 PRO 71 -2.273 20.107 0.950 505 HG3 PRO 71 HG1 PRO 71 -0.974 19.923 -0.239 506 HD2 PRO 71 HD2 PRO 71 -3.186 18.357 -0.214 507 HD3 PRO 71 HD1 PRO 71 -1.606 17.783 -0.783 508 H GLY 72 H GLY 72 -0.226 16.989 4.465 509 HA2 GLY 72 HA2 GLY 72 -0.647 17.729 6.643 510 HA3 GLY 72 HA1 GLY 72 -2.001 18.674 6.041 511 H VAL 73 H VAL 73 -1.838 15.419 4.992 512 HA VAL 73 HA VAL 73 -3.906 14.678 6.961 513 HB VAL 73 HB VAL 73 -3.909 13.802 4.075 514 HG11 VAL 73 HG11 VAL 73 -5.795 13.518 6.374 515 HG12 VAL 73 HG12 VAL 73 -5.163 12.271 5.291 516 HG13 VAL 73 HG13 VAL 73 -6.356 13.447 4.705 517 HG21 VAL 73 HG21 VAL 73 -4.406 16.034 3.802 518 HG22 VAL 73 HG22 VAL 73 -5.193 16.146 5.378 519 HG23 VAL 73 HG23 VAL 73 -6.001 15.304 4.052 520 H GLN 74 H GLN 74 -3.942 12.553 7.629 521 HA GLN 74 HA GLN 74 -1.466 11.119 7.430 522 HB2 GLN 74 HB2 GLN 74 -3.098 11.409 9.435 523 HB3 GLN 74 HB1 GLN 74 -3.968 10.075 8.694 524 HG2 GLN 74 HG2 GLN 74 -2.550 9.081 10.282 525 HG3 GLN 74 HG1 GLN 74 -1.800 8.786 8.714 526 HE21 GLN 74 HE21 GLN 74 0.292 8.591 9.415 527 HE22 GLN 74 HE22 GLN 74 1.183 9.880 10.139 528 H TYR 75 H TYR 75 -1.061 9.635 5.930 529 HA TYR 75 HA TYR 75 -3.338 8.524 4.474 530 HB2 TYR 75 HB2 TYR 75 -0.635 9.369 3.663 531 HB3 TYR 75 HB1 TYR 75 -1.224 7.874 2.918 532 HD1 TYR 75 HD2 TYR 75 -2.059 11.445 3.465 533 HD2 TYR 75 HD1 TYR 75 -2.879 7.905 1.258 534 HE1 TYR 75 HE2 TYR 75 -3.501 12.733 1.946 535 HE2 TYR 75 HE1 TYR 75 -4.331 9.178 -0.258 536 HH TYR 75 HH TYR 75 -5.520 11.157 -0.417 537 H ASN 76 H ASN 76 -3.933 6.642 4.991 538 HA ASN 76 HA ASN 76 -2.136 4.717 6.222 539 HB2 ASN 76 HB2 ASN 76 -4.526 5.169 6.988 540 HB3 ASN 76 HB1 ASN 76 -5.059 4.377 5.510 541 HD21 ASN 76 HD21 ASN 76 -3.881 3.985 8.679 542 HD22 ASN 76 HD22 ASN 76 -3.880 2.261 8.709 543 H ILE 77 H ILE 77 -0.836 3.793 4.707 544 HA ILE 77 HA ILE 77 -1.957 2.959 2.143 545 HB ILE 77 HB ILE 77 0.887 2.744 3.149 546 HG12 ILE 77 HG12 ILE 77 1.140 4.389 1.136 547 HG13 ILE 77 HG11 ILE 77 -0.520 4.793 1.493 548 HG21 ILE 77 HG21 ILE 77 0.919 1.105 1.565 549 HG22 ILE 77 HG22 ILE 77 1.180 2.529 0.537 550 HG23 ILE 77 HG23 ILE 77 -0.428 1.816 0.666 551 HD11 ILE 77 HD11 ILE 77 1.004 6.328 2.580 552 HD12 ILE 77 HD12 ILE 77 1.788 4.985 3.412 553 HD13 ILE 77 HD13 ILE 77 0.110 5.388 3.775 554 H THR 78 H THR 78 -2.883 1.104 2.006 555 HA THR 78 HA THR 78 -2.049 -1.071 3.777 556 HB THR 78 HB THR 78 -4.601 -0.677 2.217 557 HG1 THR 78 HG1 THR 78 -3.788 0.354 4.553 558 HG21 THR 78 HG21 THR 78 -3.862 -2.746 4.299 559 HG22 THR 78 HG22 THR 78 -4.084 -3.048 2.576 560 HG23 THR 78 HG23 THR 78 -5.456 -2.554 3.568 561 H ILE 79 H ILE 79 -0.760 -2.559 2.814 562 HA ILE 79 HA ILE 79 -0.863 -2.802 -0.133 563 HB ILE 79 HB ILE 79 1.155 -4.250 1.598 564 HG12 ILE 79 HG12 ILE 79 1.724 -1.977 2.039 565 HG13 ILE 79 HG11 ILE 79 2.820 -2.569 0.788 566 HG21 ILE 79 HG21 ILE 79 2.471 -4.115 -0.528 567 HG22 ILE 79 HG22 ILE 79 0.975 -3.594 -1.309 568 HG23 ILE 79 HG23 ILE 79 1.063 -5.183 -0.540 569 HD11 ILE 79 HD11 ILE 79 0.370 -1.098 -0.016 570 HD12 ILE 79 HD12 ILE 79 1.948 -1.223 -0.813 571 HD13 ILE 79 HD13 ILE 79 1.750 -0.217 0.635 572 H TYR 80 H TYR 80 -1.378 -4.681 -1.150 573 HA TYR 80 HA TYR 80 -2.317 -6.932 0.512 574 HB2 TYR 80 HB2 TYR 80 -3.537 -5.945 -2.081 575 HB3 TYR 80 HB1 TYR 80 -4.118 -7.283 -1.104 576 HD1 TYR 80 HD2 TYR 80 -5.313 -6.862 0.987 577 HD2 TYR 80 HD1 TYR 80 -4.047 -3.643 -1.512 578 HE1 TYR 80 HE2 TYR 80 -6.877 -5.356 2.138 579 HE2 TYR 80 HE1 TYR 80 -5.617 -2.145 -0.368 580 HH TYR 80 HH TYR 80 -7.241 -3.008 2.523 581 H ALA 81 H ALA 81 -0.889 -8.574 0.097 582 HA ALA 81 HA ALA 81 0.218 -8.856 -2.586 583 HB1 ALA 81 HB1 ALA 81 1.461 -10.810 -1.583 584 HB2 ALA 81 HB2 ALA 81 0.701 -10.428 -0.026 585 HB3 ALA 81 HB3 ALA 81 1.784 -9.265 -0.791 586 H VAL 82 H VAL 82 -0.647 -10.137 -4.098 587 HA VAL 82 HA VAL 82 -2.798 -11.943 -3.145 588 HB VAL 82 HB VAL 82 -3.813 -10.006 -4.175 589 HG11 VAL 82 HG11 VAL 82 -2.042 -9.276 -5.632 590 HG12 VAL 82 HG12 VAL 82 -3.543 -9.484 -6.536 591 HG13 VAL 82 HG13 VAL 82 -2.269 -10.700 -6.649 592 HG21 VAL 82 HG21 VAL 82 -4.020 -12.423 -5.958 593 HG22 VAL 82 HG22 VAL 82 -5.196 -11.110 -5.861 594 HG23 VAL 82 HG23 VAL 82 -4.927 -12.155 -4.467 595 H GLU 83 H GLU 83 -2.849 -13.949 -3.840 596 HA GLU 83 HA GLU 83 -1.012 -14.805 -5.968 597 HB2 GLU 83 HB2 GLU 83 -2.540 -16.756 -4.313 598 HB3 GLU 83 HB1 GLU 83 -0.962 -16.903 -5.063 599 HG2 GLU 83 HG2 GLU 83 0.071 -15.673 -3.372 600 HG3 GLU 83 HG1 GLU 83 -1.476 -15.199 -2.661 601 H GLU 84 H GLU 84 -1.974 -16.739 -7.236 602 HA GLU 84 HA GLU 84 -4.061 -15.973 -8.829 603 HB2 GLU 84 HB2 GLU 84 -3.489 -18.849 -8.117 604 HB3 GLU 84 HB1 GLU 84 -4.192 -18.242 -9.608 605 HG2 GLU 84 HG2 GLU 84 -2.081 -17.151 -10.159 606 HG3 GLU 84 HG1 GLU 84 -1.378 -17.760 -8.663 607 H ASN 85 H ASN 85 -4.277 -17.746 -5.770 608 HA ASN 85 HA ASN 85 -7.183 -17.952 -6.168 609 HB2 ASN 85 HB2 ASN 85 -5.313 -19.739 -4.621 610 HB3 ASN 85 HB1 ASN 85 -7.066 -19.873 -4.557 611 HD21 ASN 85 HD21 ASN 85 -8.177 -20.666 -6.320 612 HD22 ASN 85 HD22 ASN 85 -7.384 -21.480 -7.625 613 H GLN 86 H GLN 86 -4.743 -16.759 -3.966 614 HA GLN 86 HA GLN 86 -6.872 -16.130 -2.046 615 HB2 GLN 86 HB2 GLN 86 -4.234 -17.437 -1.383 616 HB3 GLN 86 HB1 GLN 86 -5.313 -16.739 -0.184 617 HG2 GLN 86 HG2 GLN 86 -7.047 -18.319 -0.788 618 HG3 GLN 86 HG1 GLN 86 -6.015 -18.992 -2.049 619 HE21 GLN 86 HE21 GLN 86 -6.602 -18.762 1.355 620 HE22 GLN 86 HE22 GLN 86 -5.532 -20.023 1.831 621 H GLU 87 H GLU 87 -5.888 -14.712 -0.221 622 HA GLU 87 HA GLU 87 -3.910 -12.834 -1.304 623 HB2 GLU 87 HB2 GLU 87 -6.620 -12.175 -0.148 624 HB3 GLU 87 HB1 GLU 87 -5.321 -10.993 -0.234 625 HG2 GLU 87 HG2 GLU 87 -5.290 -11.075 -2.605 626 HG3 GLU 87 HG1 GLU 87 -6.364 -12.471 -2.632 627 H SER 88 H SER 88 -2.475 -12.093 0.172 628 HA SER 88 HA SER 88 -2.359 -13.443 2.701 629 HB2 SER 88 HB2 SER 88 -0.593 -11.227 1.637 630 HB3 SER 88 HB1 SER 88 -0.214 -12.334 2.956 631 HG SER 88 HG SER 88 0.769 -13.159 1.174 632 H THR 89 H THR 89 -1.717 -12.052 4.686 633 HA THR 89 HA THR 89 -3.852 -10.382 5.402 634 HB THR 89 HB THR 89 -2.289 -9.719 7.325 635 HG1 THR 89 HG1 THR 89 -0.270 -10.134 6.682 636 HG21 THR 89 HG21 THR 89 -3.964 -11.476 7.535 637 HG22 THR 89 HG22 THR 89 -2.487 -11.928 8.386 638 HG23 THR 89 HG23 THR 89 -2.853 -12.641 6.816 639 HA PRO 90 HA PRO 90 -2.651 -6.553 3.702 640 HB2 PRO 90 HB2 PRO 90 -3.948 -4.799 5.262 641 HB3 PRO 90 HB1 PRO 90 -4.812 -5.947 4.231 642 HG2 PRO 90 HG2 PRO 90 -4.303 -6.053 7.173 643 HG3 PRO 90 HG1 PRO 90 -5.754 -6.514 6.267 644 HD2 PRO 90 HD2 PRO 90 -3.834 -8.262 7.195 645 HD3 PRO 90 HD1 PRO 90 -4.969 -8.606 5.879 646 H VAL 91 H VAL 91 -1.037 -5.163 3.724 647 HA VAL 91 HA VAL 91 0.583 -4.583 6.053 648 HB VAL 91 HB VAL 91 0.549 -3.619 3.208 649 HG11 VAL 91 HG11 VAL 91 2.456 -2.181 3.745 650 HG12 VAL 91 HG12 VAL 91 2.280 -2.589 5.446 651 HG13 VAL 91 HG13 VAL 91 1.010 -1.693 4.617 652 HG21 VAL 91 HG21 VAL 91 2.679 -5.013 4.816 653 HG22 VAL 91 HG22 VAL 91 2.772 -4.565 3.110 654 HG23 VAL 91 HG23 VAL 91 1.610 -5.785 3.643 655 H VAL 92 H VAL 92 0.152 -2.886 7.414 656 HA VAL 92 HA VAL 92 -1.418 -0.669 6.291 657 HB VAL 92 HB VAL 92 -1.562 -1.464 9.193 658 HG11 VAL 92 HG11 VAL 92 -3.234 0.296 7.417 659 HG12 VAL 92 HG12 VAL 92 -2.165 0.810 8.726 660 HG13 VAL 92 HG13 VAL 92 -3.629 -0.104 9.091 661 HG21 VAL 92 HG21 VAL 92 -2.418 -3.337 7.870 662 HG22 VAL 92 HG22 VAL 92 -3.483 -2.236 6.995 663 HG23 VAL 92 HG23 VAL 92 -3.723 -2.510 8.720 664 H ILE 93 H ILE 93 0.039 0.889 5.988 665 HA ILE 93 HA ILE 93 1.754 1.628 8.266 666 HB ILE 93 HB ILE 93 3.406 2.495 6.497 667 HG12 ILE 93 HG12 ILE 93 2.151 0.411 4.744 668 HG13 ILE 93 HG11 ILE 93 1.693 2.092 4.633 669 HG21 ILE 93 HG21 ILE 93 4.497 0.306 6.309 670 HG22 ILE 93 HG22 ILE 93 3.011 -0.472 6.854 671 HG23 ILE 93 HG23 ILE 93 3.891 0.607 7.936 672 HD11 ILE 93 HD11 ILE 93 4.066 2.663 4.250 673 HD12 ILE 93 HD12 ILE 93 3.339 1.653 2.984 674 HD13 ILE 93 HD13 ILE 93 4.412 0.932 4.188 675 H GLN 94 H GLN 94 1.287 3.611 8.981 676 HA GLN 94 HA GLN 94 -0.164 5.386 7.147 677 HB2 GLN 94 HB2 GLN 94 -0.995 6.539 9.146 678 HB3 GLN 94 HB1 GLN 94 -1.393 4.827 9.165 679 HG2 GLN 94 HG2 GLN 94 0.310 4.379 10.778 680 HG3 GLN 94 HG1 GLN 94 0.956 6.010 10.629 681 HE21 GLN 94 HE21 GLN 94 -2.460 5.256 10.750 682 HE22 GLN 94 HE22 GLN 94 -2.751 5.976 12.294 683 H GLN 95 H GLN 95 0.691 7.199 6.458 684 HA GLN 95 HA GLN 95 2.778 8.530 8.020 685 HB2 GLN 95 HB2 GLN 95 3.210 7.135 5.559 686 HB3 GLN 95 HB1 GLN 95 3.419 8.854 5.267 687 HG2 GLN 95 HG2 GLN 95 4.866 7.178 7.300 688 HG3 GLN 95 HG1 GLN 95 5.530 7.852 5.816 689 HE21 GLN 95 HE21 GLN 95 4.008 10.389 6.270 690 HE22 GLN 95 HE22 GLN 95 4.924 11.231 7.473 691 H GLU 96 H GLU 96 2.418 10.682 8.147 692 HA GLU 96 HA GLU 96 0.174 11.776 6.675 693 HB2 GLU 96 HB2 GLU 96 0.330 12.317 9.035 694 HB3 GLU 96 HB1 GLU 96 1.939 12.992 8.810 695 HG2 GLU 96 HG2 GLU 96 0.950 14.720 7.338 696 HG3 GLU 96 HG1 GLU 96 -0.646 14.070 7.708 697 H THR 97 H THR 97 0.255 13.211 5.111 698 HA THR 97 HA THR 97 2.605 13.497 3.581 699 HB THR 97 HB THR 97 1.184 15.150 2.295 700 HG1 THR 97 HG1 THR 97 -1.176 14.655 3.205 701 HG21 THR 97 HG21 THR 97 -0.152 12.507 2.886 702 HG22 THR 97 HG22 THR 97 1.259 12.687 1.844 703 HG23 THR 97 HG23 THR 97 -0.271 13.450 1.400 704 H THR 98 H THR 98 4.191 14.928 3.727 705 HA THR 98 HA THR 98 4.377 16.631 5.979 706 HB THR 98 HB THR 98 6.172 16.730 3.560 707 HG1 THR 98 HG1 THR 98 7.246 14.938 4.413 708 HG21 THR 98 HG21 THR 98 6.581 18.386 5.338 709 HG22 THR 98 HG22 THR 98 7.905 17.230 5.209 710 HG23 THR 98 HG23 THR 98 6.727 17.080 6.512 711 H GLY 99 H GLY 99 3.632 17.162 2.604 712 HA2 GLY 99 HA2 GLY 99 2.067 19.040 2.228 713 HA3 GLY 99 HA1 GLY 99 3.128 20.001 3.223 714 H THR 100 H THR 100 2.494 20.936 0.787 715 HA THR 100 HA THR 100 4.157 20.033 -1.319 716 HB THR 100 HB THR 100 2.854 22.742 -1.044 717 HG1 THR 100 HG1 THR 100 1.802 20.315 -2.144 718 HG21 THR 100 HG21 THR 100 3.686 21.151 -3.452 719 HG22 THR 100 HG22 THR 100 4.441 22.625 -2.847 720 HG23 THR 100 HG23 THR 100 2.800 22.673 -3.479 721 HA PRO 101 HA PRO 101 8.023 21.815 0.087 722 HB2 PRO 101 HB2 PRO 101 8.720 21.434 -2.775 723 HB3 PRO 101 HB1 PRO 101 9.559 20.866 -1.328 724 HG2 PRO 101 HG2 PRO 101 8.166 19.179 -2.847 725 HG3 PRO 101 HG1 PRO 101 8.162 19.031 -1.079 726 HD2 PRO 101 HD2 PRO 101 6.069 20.160 -2.894 727 HD3 PRO 101 HD1 PRO 101 5.884 19.166 -1.433 728 H ARG 102 H ARG 102 7.565 23.945 0.437 729 HA ARG 102 HA ARG 102 8.086 25.757 -1.784 730 HB2 ARG 102 HB2 ARG 102 6.173 27.187 -1.215 731 HB3 ARG 102 HB1 ARG 102 5.638 25.588 -1.717 732 HG2 ARG 102 HG2 ARG 102 5.253 24.953 0.577 733 HG3 ARG 102 HG1 ARG 102 5.901 26.492 1.142 734 HD2 ARG 102 HD2 ARG 102 3.477 26.521 1.189 735 HD3 ARG 102 HD1 ARG 102 4.083 27.669 -0.001 736 HE ARG 102 HE ARG 102 3.516 25.990 -1.716 737 HH11 ARG 102 HH11 ARG 102 1.955 25.820 1.419 738 HH12 ARG 102 HH12 ARG 102 0.580 24.946 0.825 739 HH21 ARG 102 HH21 ARG 102 1.692 24.866 -2.507 740 HH22 ARG 102 HH22 ARG 102 0.430 24.402 -1.406 741 H SER 103 H SER 103 8.274 28.057 -0.898 742 HA SER 103 HA SER 103 9.045 28.172 1.911 743 HB2 SER 103 HB2 SER 103 11.125 27.606 0.692 744 HB3 SER 103 HB1 SER 103 10.897 29.018 -0.338 745 HG SER 103 HG SER 103 11.251 30.354 1.403 746 H ASP 104 H ASP 104 8.507 30.061 2.816 747 HA ASP 104 HA ASP 104 7.928 32.226 3.118 748 HB2 ASP 104 HB2 ASP 104 8.835 32.578 0.259 749 HB3 ASP 104 HB1 ASP 104 8.393 33.897 1.336 750 H GLY 105 H GLY 105 6.949 31.524 -0.246 751 HA2 GLY 105 HA2 GLY 105 4.202 32.265 0.559 752 HA3 GLY 105 HA1 GLY 105 4.890 32.707 -0.995 753 H THR 106 H THR 106 2.629 31.510 -1.265 754 HA THR 106 HA THR 106 3.224 28.679 -1.782 755 HB THR 106 HB THR 106 1.480 28.696 -0.200 756 HG1 THR 106 HG1 THR 106 0.035 28.563 -2.643 757 HG21 THR 106 HG21 THR 106 0.888 31.066 -0.332 758 HG22 THR 106 HG22 THR 106 -0.546 30.042 -0.368 759 HG23 THR 106 HG23 THR 106 0.051 30.774 -1.856 Start of MODEL 24 1 H1 GLY 1 HT1 GLY 1 14.132 -30.113 -0.754 2 H2 GLY 1 HT2 GLY 1 12.671 -29.264 -0.728 3 H3 GLY 1 HT3 GLY 1 13.719 -29.180 0.593 4 HA2 GLY 1 HA1 GLY 1 15.381 -28.066 -0.766 5 HA3 GLY 1 HA2 GLY 1 14.262 -28.124 -2.120 6 H SER 2 H SER 2 14.602 -25.764 -2.067 7 HA SER 2 HA SER 2 13.418 -24.271 0.091 8 HB2 SER 2 HB2 SER 2 14.281 -23.352 -2.665 9 HB3 SER 2 HB1 SER 2 13.922 -22.311 -1.286 10 HG SER 2 HG SER 2 15.689 -24.000 -0.397 11 H HIS 3 H HIS 3 11.860 -22.376 -0.899 12 HA HIS 3 HA HIS 3 9.713 -21.890 -1.445 13 HB2 HIS 3 HB2 HIS 3 10.038 -24.118 -3.475 14 HB3 HIS 3 HB1 HIS 3 8.721 -22.954 -3.446 15 HD1 HIS 3 HD1 HIS 3 9.242 -20.555 -4.278 16 HD2 HIS 3 HD2 HIS 3 12.467 -23.167 -4.480 17 HE1 HIS 3 HE1 HIS 3 10.961 -19.395 -5.696 18 HE2 HIS 3 HE2 HIS 3 12.932 -20.962 -5.748 19 H MET 4 H MET 4 10.122 -23.466 0.736 20 HA MET 4 HA MET 4 8.095 -25.594 0.593 21 HB2 MET 4 HB2 MET 4 9.180 -26.482 2.645 22 HB3 MET 4 HB1 MET 4 10.263 -26.420 1.261 23 HG2 MET 4 HG2 MET 4 11.275 -24.385 2.125 24 HG3 MET 4 HG1 MET 4 10.170 -24.407 3.497 25 HE1 MET 4 HE1 MET 4 12.351 -24.156 5.050 26 HE2 MET 4 HE2 MET 4 13.396 -24.234 3.631 27 HE3 MET 4 HE3 MET 4 13.705 -25.286 5.012 28 H GLY 5 H GLY 5 6.953 -25.965 2.741 29 HA2 GLY 5 HA2 GLY 5 6.056 -25.010 4.753 30 HA3 GLY 5 HA1 GLY 5 6.371 -23.414 4.087 31 H THR 6 H THR 6 4.049 -23.223 4.845 32 HA THR 6 HA THR 6 2.050 -24.476 3.204 33 HB THR 6 HB THR 6 1.642 -22.089 5.012 34 HG1 THR 6 HG1 THR 6 1.090 -23.808 6.587 35 HG21 THR 6 HG21 THR 6 -0.620 -22.984 5.224 36 HG22 THR 6 HG22 THR 6 -0.193 -24.346 4.191 37 HG23 THR 6 HG23 THR 6 -0.225 -22.714 3.525 38 H THR 7 H THR 7 3.125 -23.740 1.184 39 HA THR 7 HA THR 7 3.164 -20.967 0.525 40 HB THR 7 HB THR 7 3.518 -21.946 -1.854 41 HG1 THR 7 HG1 THR 7 2.698 -24.087 -1.058 42 HG21 THR 7 HG21 THR 7 5.866 -22.471 -1.318 43 HG22 THR 7 HG22 THR 7 5.452 -22.522 0.395 44 HG23 THR 7 HG23 THR 7 5.314 -21.009 -0.499 45 H THR 8 H THR 8 0.689 -23.295 0.549 46 HA THR 8 HA THR 8 -0.918 -22.069 -1.491 47 HB THR 8 HB THR 8 -1.171 -24.470 -0.921 48 HG1 THR 8 HG1 THR 8 -3.223 -22.631 -1.045 49 HG21 THR 8 HG21 THR 8 -0.832 -24.279 1.495 50 HG22 THR 8 HG22 THR 8 -2.351 -25.099 1.133 51 HG23 THR 8 HG23 THR 8 -2.357 -23.410 1.646 52 H ALA 9 H ALA 9 -0.025 -21.194 1.489 53 HA ALA 9 HA ALA 9 -2.263 -19.301 1.718 54 HB1 ALA 9 HB1 ALA 9 -2.459 -20.984 3.500 55 HB2 ALA 9 HB2 ALA 9 -2.100 -19.385 4.151 56 HB3 ALA 9 HB3 ALA 9 -0.824 -20.597 4.037 57 HA PRO 10 HA PRO 10 1.693 -17.160 0.951 58 HB2 PRO 10 HB2 PRO 10 0.542 -14.875 -0.020 59 HB3 PRO 10 HB1 PRO 10 0.887 -16.305 -0.998 60 HG2 PRO 10 HG2 PRO 10 -1.690 -15.430 0.243 61 HG3 PRO 10 HG1 PRO 10 -1.399 -16.139 -1.355 62 HD2 PRO 10 HD2 PRO 10 -2.349 -17.589 0.696 63 HD3 PRO 10 HD1 PRO 10 -1.303 -18.279 -0.508 64 H ASP 11 H ASP 11 2.831 -15.782 2.163 65 HA ASP 11 HA ASP 11 1.505 -14.475 4.397 66 HB2 ASP 11 HB2 ASP 11 4.398 -14.921 3.685 67 HB3 ASP 11 HB1 ASP 11 3.919 -13.842 4.990 68 H ALA 12 H ALA 12 2.084 -12.230 4.905 69 HA ALA 12 HA ALA 12 2.080 -10.580 2.482 70 HB1 ALA 12 HB1 ALA 12 0.309 -10.171 4.087 71 HB2 ALA 12 HB2 ALA 12 1.391 -8.779 4.023 72 HB3 ALA 12 HB3 ALA 12 1.491 -9.914 5.367 73 HA PRO 13 HA PRO 13 6.205 -9.022 3.241 74 HB2 PRO 13 HB2 PRO 13 5.227 -6.308 2.644 75 HB3 PRO 13 HB1 PRO 13 6.427 -7.278 1.784 76 HG2 PRO 13 HG2 PRO 13 4.021 -6.811 0.730 77 HG3 PRO 13 HG1 PRO 13 4.823 -8.381 0.528 78 HD2 PRO 13 HD2 PRO 13 2.666 -7.591 2.451 79 HD3 PRO 13 HD1 PRO 13 2.785 -9.051 1.441 80 HA PRO 14 HA PRO 14 6.018 -7.436 7.471 81 HB2 PRO 14 HB2 PRO 14 8.849 -6.814 6.792 82 HB3 PRO 14 HB1 PRO 14 8.194 -7.656 8.200 83 HG2 PRO 14 HG2 PRO 14 9.420 -9.003 6.255 84 HG3 PRO 14 HG1 PRO 14 7.993 -9.667 7.071 85 HD2 PRO 14 HD2 PRO 14 8.224 -8.433 4.364 86 HD3 PRO 14 HD1 PRO 14 7.204 -9.779 4.911 87 H ASP 15 H ASP 15 6.240 -5.390 8.440 88 HA ASP 15 HA ASP 15 4.995 -3.380 7.211 89 HB2 ASP 15 HB2 ASP 15 5.883 -1.833 8.898 90 HB3 ASP 15 HB1 ASP 15 5.446 -3.383 9.605 91 HA PRO 16 HA PRO 16 7.947 -2.062 4.064 92 HB2 PRO 16 HB2 PRO 16 5.568 -0.483 3.264 93 HB3 PRO 16 HB1 PRO 16 6.557 -1.594 2.288 94 HG2 PRO 16 HG2 PRO 16 4.138 -2.321 3.059 95 HG3 PRO 16 HG1 PRO 16 5.473 -3.481 3.143 96 HD2 PRO 16 HD2 PRO 16 4.287 -1.830 5.357 97 HD3 PRO 16 HD1 PRO 16 4.628 -3.580 5.342 98 H THR 17 H THR 17 9.009 -0.174 3.666 99 HA THR 17 HA THR 17 8.528 1.979 5.624 100 HB THR 17 HB THR 17 11.084 1.309 4.143 101 HG1 THR 17 HG1 THR 17 10.254 0.757 6.819 102 HG21 THR 17 HG21 THR 17 10.553 3.204 6.436 103 HG22 THR 17 HG22 THR 17 10.926 3.666 4.777 104 HG23 THR 17 HG23 THR 17 12.136 2.837 5.753 105 H VAL 18 H VAL 18 7.916 3.818 4.995 106 HA VAL 18 HA VAL 18 7.706 4.541 2.215 107 HB VAL 18 HB VAL 18 7.174 6.132 4.728 108 HG11 VAL 18 HG11 VAL 18 6.065 7.769 3.254 109 HG12 VAL 18 HG12 VAL 18 6.663 6.894 1.837 110 HG13 VAL 18 HG13 VAL 18 7.798 7.666 2.953 111 HG21 VAL 18 HG21 VAL 18 5.648 4.236 4.287 112 HG22 VAL 18 HG22 VAL 18 5.272 4.945 2.718 113 HG23 VAL 18 HG23 VAL 18 4.846 5.803 4.196 114 H ASP 19 H ASP 19 9.162 5.506 1.026 115 HA ASP 19 HA ASP 19 11.711 6.228 2.244 116 HB2 ASP 19 HB2 ASP 19 11.784 4.688 0.376 117 HB3 ASP 19 HB1 ASP 19 10.879 5.810 -0.633 118 H GLN 20 H GLN 20 9.125 7.673 0.343 119 HA GLN 20 HA GLN 20 10.263 10.313 0.909 120 HB2 GLN 20 HB2 GLN 20 9.439 9.259 -1.786 121 HB3 GLN 20 HB1 GLN 20 9.420 10.981 -1.437 122 HG2 GLN 20 HG2 GLN 20 11.848 9.233 -1.134 123 HG3 GLN 20 HG1 GLN 20 11.474 10.168 -2.581 124 HE21 GLN 20 HE21 GLN 20 13.342 11.399 -2.370 125 HE22 GLN 20 HE22 GLN 20 13.519 12.606 -1.173 126 H VAL 21 H VAL 21 8.843 11.755 1.587 127 HA VAL 21 HA VAL 21 5.981 11.137 1.281 128 HB VAL 21 HB VAL 21 7.263 12.443 3.686 129 HG11 VAL 21 HG11 VAL 21 4.433 11.492 3.292 130 HG12 VAL 21 HG12 VAL 21 4.960 13.170 3.177 131 HG13 VAL 21 HG13 VAL 21 5.089 12.310 4.712 132 HG21 VAL 21 HG21 VAL 21 7.849 10.087 3.594 133 HG22 VAL 21 HG22 VAL 21 6.150 9.658 3.393 134 HG23 VAL 21 HG23 VAL 21 6.702 10.392 4.898 135 H ASP 22 H ASP 22 4.967 12.650 0.131 136 HA ASP 22 HA ASP 22 5.868 15.444 0.380 137 HB2 ASP 22 HB2 ASP 22 4.963 14.027 -2.142 138 HB3 ASP 22 HB1 ASP 22 5.256 15.758 -2.019 139 H ASP 23 H ASP 23 3.819 16.495 -1.288 140 HA ASP 23 HA ASP 23 1.650 16.553 0.558 141 HB2 ASP 23 HB2 ASP 23 0.604 18.012 -1.274 142 HB3 ASP 23 HB1 ASP 23 2.087 18.583 -0.533 143 H THR 24 H THR 24 1.512 15.890 -2.918 144 HA THR 24 HA THR 24 -0.893 14.248 -2.449 145 HB THR 24 HB THR 24 -1.379 14.750 -4.830 146 HG1 THR 24 HG1 THR 24 0.821 16.569 -4.686 147 HG21 THR 24 HG21 THR 24 -0.776 17.191 -3.150 148 HG22 THR 24 HG22 THR 24 -2.232 16.199 -3.034 149 HG23 THR 24 HG23 THR 24 -1.904 17.119 -4.506 150 H SER 25 H SER 25 1.711 13.155 -2.026 151 HA SER 25 HA SER 25 1.790 10.899 -3.692 152 HB2 SER 25 HB2 SER 25 3.973 11.324 -4.814 153 HB3 SER 25 HB1 SER 25 2.699 12.405 -5.374 154 HG SER 25 HG SER 25 4.913 12.953 -3.727 155 H ILE 26 H ILE 26 2.929 9.296 -2.746 156 HA ILE 26 HA ILE 26 5.057 9.864 -0.820 157 HB ILE 26 HB ILE 26 2.434 8.604 -0.003 158 HG12 ILE 26 HG12 ILE 26 4.159 10.711 1.304 159 HG13 ILE 26 HG11 ILE 26 2.679 11.010 0.402 160 HG21 ILE 26 HG21 ILE 26 4.154 7.030 0.659 161 HG22 ILE 26 HG22 ILE 26 3.480 7.842 2.074 162 HG23 ILE 26 HG23 ILE 26 5.057 8.325 1.447 163 HD11 ILE 26 HD11 ILE 26 2.226 11.118 2.756 164 HD12 ILE 26 HD12 ILE 26 2.935 9.521 3.005 165 HD13 ILE 26 HD13 ILE 26 1.442 9.689 2.083 166 H VAL 27 H VAL 27 6.432 7.941 -0.506 167 HA VAL 27 HA VAL 27 5.727 5.832 -2.459 168 HB VAL 27 HB VAL 27 8.512 6.738 -1.753 169 HG11 VAL 27 HG11 VAL 27 9.300 5.126 -3.201 170 HG12 VAL 27 HG12 VAL 27 7.811 5.102 -4.146 171 HG13 VAL 27 HG13 VAL 27 7.859 4.312 -2.566 172 HG21 VAL 27 HG21 VAL 27 8.596 7.719 -3.995 173 HG22 VAL 27 HG22 VAL 27 7.346 8.474 -3.007 174 HG23 VAL 27 HG23 VAL 27 6.902 7.297 -4.242 175 H VAL 28 H VAL 28 5.790 3.755 -1.727 176 HA VAL 28 HA VAL 28 7.008 3.344 0.912 177 HB VAL 28 HB VAL 28 5.175 2.471 1.841 178 HG11 VAL 28 HG11 VAL 28 4.420 4.621 0.991 179 HG12 VAL 28 HG12 VAL 28 3.123 3.460 1.231 180 HG13 VAL 28 HG13 VAL 28 3.715 3.792 -0.396 181 HG21 VAL 28 HG21 VAL 28 4.301 1.369 -0.792 182 HG22 VAL 28 HG22 VAL 28 3.526 1.052 0.763 183 HG23 VAL 28 HG23 VAL 28 5.183 0.497 0.464 184 H ARG 29 H ARG 29 7.886 1.289 1.300 185 HA ARG 29 HA ARG 29 8.210 -0.418 -1.091 186 HB2 ARG 29 HB2 ARG 29 10.474 0.179 0.805 187 HB3 ARG 29 HB1 ARG 29 10.558 -0.577 -0.777 188 HG2 ARG 29 HG2 ARG 29 10.010 1.549 -1.832 189 HG3 ARG 29 HG1 ARG 29 9.891 2.312 -0.246 190 HD2 ARG 29 HD2 ARG 29 12.345 1.120 -1.528 191 HD3 ARG 29 HD1 ARG 29 12.045 2.820 -1.164 192 HE ARG 29 HE ARG 29 12.074 0.948 1.076 193 HH11 ARG 29 HH11 ARG 29 13.759 3.419 -0.749 194 HH12 ARG 29 HH12 ARG 29 14.913 3.732 0.507 195 HH21 ARG 29 HH21 ARG 29 13.608 1.340 2.714 196 HH22 ARG 29 HH22 ARG 29 14.827 2.551 2.474 197 H TRP 30 H TRP 30 7.747 -2.421 -0.704 198 HA TRP 30 HA TRP 30 7.664 -3.358 2.094 199 HB2 TRP 30 HB2 TRP 30 5.865 -4.934 1.316 200 HB3 TRP 30 HB1 TRP 30 5.426 -3.234 1.202 201 HD1 TRP 30 HD1 TRP 30 6.329 -6.200 -0.991 202 HE1 TRP 30 HE1 TRP 30 5.514 -5.756 -3.383 203 HE3 TRP 30 HE3 TRP 30 4.749 -1.426 -0.369 204 HZ2 TRP 30 HZ2 TRP 30 4.288 -3.658 -4.794 205 HZ3 TRP 30 HZ3 TRP 30 3.733 -0.279 -2.285 206 HH2 TRP 30 HH2 TRP 30 3.502 -1.358 -4.434 207 H SER 31 H SER 31 8.411 -5.401 2.598 208 HA SER 31 HA SER 31 10.239 -6.577 0.661 209 HB2 SER 31 HB2 SER 31 10.987 -6.134 2.998 210 HB3 SER 31 HB1 SER 31 9.791 -7.295 3.571 211 HG SER 31 HG SER 31 12.057 -7.779 1.931 212 H ARG 32 H ARG 32 9.160 -7.773 -0.735 213 HA ARG 32 HA ARG 32 6.726 -8.999 -0.462 214 HB2 ARG 32 HB2 ARG 32 8.891 -9.991 -2.298 215 HB3 ARG 32 HB1 ARG 32 7.156 -10.029 -2.557 216 HG2 ARG 32 HG2 ARG 32 7.718 -8.260 -3.882 217 HG3 ARG 32 HG1 ARG 32 7.388 -7.431 -2.359 218 HD2 ARG 32 HD2 ARG 32 9.428 -6.585 -2.362 219 HD3 ARG 32 HD1 ARG 32 10.099 -8.218 -2.315 220 HE ARG 32 HE ARG 32 9.318 -7.322 -4.945 221 HH11 ARG 32 HH11 ARG 32 11.900 -7.471 -2.583 222 HH12 ARG 32 HH12 ARG 32 13.156 -7.279 -3.760 223 HH21 ARG 32 HH21 ARG 32 10.971 -7.059 -6.499 224 HH22 ARG 32 HH22 ARG 32 12.631 -7.036 -5.984 225 HA PRO 33 HA PRO 33 7.325 -12.868 1.555 226 HB2 PRO 33 HB2 PRO 33 5.214 -14.137 0.071 227 HB3 PRO 33 HB1 PRO 33 5.109 -13.362 1.657 228 HG2 PRO 33 HG2 PRO 33 3.877 -12.429 -0.622 229 HG3 PRO 33 HG1 PRO 33 4.306 -11.414 0.773 230 HD2 PRO 33 HD2 PRO 33 5.772 -11.817 -1.804 231 HD3 PRO 33 HD1 PRO 33 5.471 -10.316 -0.914 232 H GLN 34 H GLN 34 7.839 -15.103 1.325 233 HA GLN 34 HA GLN 34 9.120 -15.857 -1.153 234 HB2 GLN 34 HB2 GLN 34 8.659 -17.484 1.351 235 HB3 GLN 34 HB1 GLN 34 9.725 -17.898 0.016 236 HG2 GLN 34 HG2 GLN 34 11.143 -16.012 0.501 237 HG3 GLN 34 HG1 GLN 34 10.042 -15.480 1.770 238 HE21 GLN 34 HE21 GLN 34 11.632 -15.583 3.336 239 HE22 GLN 34 HE22 GLN 34 12.231 -17.085 3.951 240 H ALA 35 H ALA 35 6.038 -15.885 0.057 241 HA ALA 35 HA ALA 35 4.927 -18.239 -1.018 242 HB1 ALA 35 HB1 ALA 35 3.557 -15.565 -0.782 243 HB2 ALA 35 HB2 ALA 35 3.841 -16.635 0.597 244 HB3 ALA 35 HB3 ALA 35 2.819 -17.170 -0.738 245 HA PRO 36 HA PRO 36 4.735 -17.013 -5.344 246 HB2 PRO 36 HB2 PRO 36 2.527 -18.861 -5.718 247 HB3 PRO 36 HB1 PRO 36 4.175 -18.979 -6.333 248 HG2 PRO 36 HG2 PRO 36 3.144 -20.637 -4.421 249 HG3 PRO 36 HG1 PRO 36 4.869 -20.271 -4.585 250 HD2 PRO 36 HD2 PRO 36 2.872 -19.179 -2.652 251 HD3 PRO 36 HD1 PRO 36 4.587 -19.573 -2.406 252 H ILE 37 H ILE 37 3.813 -15.104 -5.654 253 HA ILE 37 HA ILE 37 0.949 -14.768 -5.045 254 HB ILE 37 HB ILE 37 1.459 -12.367 -4.635 255 HG12 ILE 37 HG12 ILE 37 4.181 -13.298 -5.376 256 HG13 ILE 37 HG11 ILE 37 3.362 -11.797 -5.761 257 HG21 ILE 37 HG21 ILE 37 1.426 -14.072 -2.757 258 HG22 ILE 37 HG22 ILE 37 2.306 -12.574 -2.413 259 HG23 ILE 37 HG23 ILE 37 3.196 -14.060 -2.815 260 HD11 ILE 37 HD11 ILE 37 3.670 -11.205 -3.307 261 HD12 ILE 37 HD12 ILE 37 5.094 -11.181 -4.348 262 HD13 ILE 37 HD13 ILE 37 4.814 -12.546 -3.266 263 H THR 38 H THR 38 -0.268 -13.542 -6.581 264 HA THR 38 HA THR 38 0.854 -13.673 -9.255 265 HB THR 38 HB THR 38 -1.474 -13.053 -9.973 266 HG1 THR 38 HG1 THR 38 -3.083 -13.350 -8.300 267 HG21 THR 38 HG21 THR 38 -0.686 -15.329 -9.976 268 HG22 THR 38 HG22 THR 38 -2.382 -15.253 -9.509 269 HG23 THR 38 HG23 THR 38 -1.140 -15.507 -8.282 270 H GLY 39 H GLY 39 -0.105 -11.207 -6.957 271 HA2 GLY 39 HA2 GLY 39 1.274 -9.219 -8.440 272 HA3 GLY 39 HA1 GLY 39 -0.465 -9.040 -8.627 273 H TYR 40 H TYR 40 0.015 -6.935 -7.573 274 HA TYR 40 HA TYR 40 -0.508 -7.287 -4.707 275 HB2 TYR 40 HB2 TYR 40 1.596 -5.545 -5.939 276 HB3 TYR 40 HB1 TYR 40 0.753 -4.996 -4.495 277 HD1 TYR 40 HD2 TYR 40 2.165 -8.279 -5.580 278 HD2 TYR 40 HD1 TYR 40 2.001 -5.265 -2.601 279 HE1 TYR 40 HE2 TYR 40 3.725 -9.565 -4.205 280 HE2 TYR 40 HE1 TYR 40 3.530 -6.566 -1.197 281 HH TYR 40 HH TYR 40 5.265 -9.251 -2.408 282 H ARG 41 H ARG 41 -2.272 -6.234 -4.081 283 HA ARG 41 HA ARG 41 -3.196 -3.936 -5.678 284 HB2 ARG 41 HB2 ARG 41 -4.639 -4.956 -3.272 285 HB3 ARG 41 HB1 ARG 41 -5.265 -4.160 -4.715 286 HG2 ARG 41 HG2 ARG 41 -4.044 -6.900 -4.772 287 HG3 ARG 41 HG1 ARG 41 -5.762 -6.644 -4.434 288 HD2 ARG 41 HD2 ARG 41 -4.301 -5.769 -6.925 289 HD3 ARG 41 HD1 ARG 41 -5.363 -7.170 -6.796 290 HE ARG 41 HE ARG 41 -6.371 -4.445 -6.290 291 HH11 ARG 41 HH11 ARG 41 -6.538 -7.478 -8.051 292 HH12 ARG 41 HH12 ARG 41 -8.050 -7.092 -8.804 293 HH21 ARG 41 HH21 ARG 41 -8.319 -3.930 -7.283 294 HH22 ARG 41 HH22 ARG 41 -9.071 -5.067 -8.370 295 H ILE 42 H ILE 42 -3.442 -1.902 -4.692 296 HA ILE 42 HA ILE 42 -2.307 -1.689 -1.979 297 HB ILE 42 HB ILE 42 -1.469 0.101 -4.235 298 HG12 ILE 42 HG12 ILE 42 0.149 -2.076 -2.952 299 HG13 ILE 42 HG11 ILE 42 -0.733 -2.291 -4.454 300 HG21 ILE 42 HG21 ILE 42 -1.390 1.037 -1.928 301 HG22 ILE 42 HG22 ILE 42 0.185 0.940 -2.709 302 HG23 ILE 42 HG23 ILE 42 -0.270 -0.253 -1.491 303 HD11 ILE 42 HD11 ILE 42 1.464 -0.319 -3.975 304 HD12 ILE 42 HD12 ILE 42 0.598 -0.555 -5.492 305 HD13 ILE 42 HD13 ILE 42 1.610 -1.845 -4.840 306 H VAL 43 H VAL 43 -3.869 -0.833 -0.779 307 HA VAL 43 HA VAL 43 -5.448 1.338 -2.002 308 HB VAL 43 HB VAL 43 -6.254 -0.513 0.244 309 HG11 VAL 43 HG11 VAL 43 -8.390 0.619 0.188 310 HG12 VAL 43 HG12 VAL 43 -7.767 1.756 -1.006 311 HG13 VAL 43 HG13 VAL 43 -7.087 1.718 0.621 312 HG21 VAL 43 HG21 VAL 43 -7.390 -0.193 -2.525 313 HG22 VAL 43 HG22 VAL 43 -7.937 -1.326 -1.289 314 HG23 VAL 43 HG23 VAL 43 -6.338 -1.513 -2.011 315 H TYR 44 H TYR 44 -4.739 3.227 -1.373 316 HA TYR 44 HA TYR 44 -4.041 3.578 1.442 317 HB2 TYR 44 HB2 TYR 44 -2.816 5.693 0.457 318 HB3 TYR 44 HB1 TYR 44 -2.035 4.119 0.466 319 HD1 TYR 44 HD1 TYR 44 -2.264 2.707 -1.677 320 HD2 TYR 44 HD2 TYR 44 -2.987 6.890 -1.540 321 HE1 TYR 44 HE1 TYR 44 -1.901 2.821 -4.091 322 HE2 TYR 44 HE2 TYR 44 -2.628 7.032 -3.964 323 HH TYR 44 HH TYR 44 -1.435 5.751 -5.717 324 H SER 45 H SER 45 -5.135 4.825 2.591 325 HA SER 45 HA SER 45 -7.029 6.702 1.347 326 HB2 SER 45 HB2 SER 45 -8.748 5.892 3.009 327 HB3 SER 45 HB1 SER 45 -8.330 4.731 1.749 328 HG SER 45 HG SER 45 -7.994 4.577 4.459 329 HA PRO 46 HA PRO 46 -5.610 9.363 4.645 330 HB2 PRO 46 HB2 PRO 46 -7.201 11.439 4.116 331 HB3 PRO 46 HB1 PRO 46 -5.901 10.976 3.012 332 HG2 PRO 46 HG2 PRO 46 -8.831 10.443 2.816 333 HG3 PRO 46 HG1 PRO 46 -7.690 10.923 1.547 334 HD2 PRO 46 HD2 PRO 46 -8.542 8.343 1.985 335 HD3 PRO 46 HD1 PRO 46 -7.024 8.780 1.179 336 H SER 47 H SER 47 -6.139 9.392 6.725 337 HA SER 47 HA SER 47 -8.648 8.368 7.609 338 HB2 SER 47 HB2 SER 47 -6.493 7.996 8.804 339 HB3 SER 47 HB1 SER 47 -6.479 9.702 9.247 340 HG SER 47 HG SER 47 -7.401 8.077 10.791 341 H VAL 48 H VAL 48 -7.381 11.566 7.085 342 HA VAL 48 HA VAL 48 -9.757 12.709 8.403 343 HB VAL 48 HB VAL 48 -8.469 14.767 8.718 344 HG11 VAL 48 HG11 VAL 48 -7.080 13.972 10.562 345 HG12 VAL 48 HG12 VAL 48 -7.158 12.333 9.919 346 HG13 VAL 48 HG13 VAL 48 -8.621 13.114 10.521 347 HG21 VAL 48 HG21 VAL 48 -6.033 14.744 8.454 348 HG22 VAL 48 HG22 VAL 48 -6.871 14.528 6.917 349 HG23 VAL 48 HG23 VAL 48 -6.141 13.142 7.725 350 H GLU 49 H GLU 49 -9.088 11.880 5.539 351 HA GLU 49 HA GLU 49 -10.395 14.131 4.291 352 HB2 GLU 49 HB2 GLU 49 -7.613 13.873 4.080 353 HB3 GLU 49 HB1 GLU 49 -8.241 13.255 2.560 354 HG2 GLU 49 HG2 GLU 49 -8.781 15.968 3.747 355 HG3 GLU 49 HG1 GLU 49 -7.736 15.607 2.372 356 H GLY 50 H GLY 50 -10.129 13.229 1.601 357 HA2 GLY 50 HA2 GLY 50 -11.290 10.533 1.830 358 HA3 GLY 50 HA1 GLY 50 -12.216 11.817 1.084 359 H SER 51 H SER 51 -8.805 11.908 0.344 360 HA SER 51 HA SER 51 -9.478 10.829 -2.294 361 HB2 SER 51 HB2 SER 51 -8.126 12.992 -1.981 362 HB3 SER 51 HB1 SER 51 -6.774 11.971 -1.471 363 HG SER 51 HG SER 51 -6.409 11.986 -3.551 364 H SER 52 H SER 52 -9.340 8.695 -2.490 365 HA SER 52 HA SER 52 -7.079 7.305 -1.221 366 HB2 SER 52 HB2 SER 52 -8.716 5.283 -1.198 367 HB3 SER 52 HB1 SER 52 -8.893 6.526 0.040 368 HG SER 52 HG SER 52 -10.742 7.128 -0.793 369 H THR 53 H THR 53 -6.140 5.575 -2.378 370 HA THR 53 HA THR 53 -7.217 5.115 -5.058 371 HB THR 53 HB THR 53 -4.352 5.999 -4.671 372 HG1 THR 53 HG1 THR 53 -6.683 7.369 -5.141 373 HG21 THR 53 HG21 THR 53 -5.911 5.380 -7.183 374 HG22 THR 53 HG22 THR 53 -4.616 4.396 -6.498 375 HG23 THR 53 HG23 THR 53 -4.265 6.009 -7.119 376 H GLU 54 H GLU 54 -6.650 3.165 -5.982 377 HA GLU 54 HA GLU 54 -5.051 1.323 -4.370 378 HB2 GLU 54 HB2 GLU 54 -7.463 0.746 -4.466 379 HB3 GLU 54 HB1 GLU 54 -7.359 0.678 -6.219 380 HG2 GLU 54 HG2 GLU 54 -5.666 -1.136 -5.973 381 HG3 GLU 54 HG1 GLU 54 -5.998 -1.131 -4.242 382 H LEU 55 H LEU 55 -3.127 0.993 -5.331 383 HA LEU 55 HA LEU 55 -3.033 1.055 -8.258 384 HB2 LEU 55 HB2 LEU 55 -0.744 1.175 -6.259 385 HB3 LEU 55 HB1 LEU 55 -0.539 1.034 -8.003 386 HG LEU 55 HG LEU 55 -1.649 3.327 -6.439 387 HD11 LEU 55 HD11 LEU 55 0.614 2.991 -8.378 388 HD12 LEU 55 HD12 LEU 55 0.678 3.479 -6.682 389 HD13 LEU 55 HD13 LEU 55 -0.004 4.567 -7.887 390 HD21 LEU 55 HD21 LEU 55 -3.224 3.026 -8.230 391 HD22 LEU 55 HD22 LEU 55 -1.919 2.851 -9.403 392 HD23 LEU 55 HD23 LEU 55 -2.192 4.403 -8.612 393 H ASN 56 H ASN 56 -1.778 -0.557 -9.377 394 HA ASN 56 HA ASN 56 -1.882 -3.175 -8.039 395 HB2 ASN 56 HB2 ASN 56 -2.754 -2.395 -10.815 396 HB3 ASN 56 HB1 ASN 56 -2.309 -4.054 -10.431 397 HD21 ASN 56 HD21 ASN 56 -3.650 -5.297 -9.214 398 HD22 ASN 56 HD22 ASN 56 -5.247 -4.807 -8.767 399 H LEU 57 H LEU 57 0.079 -3.959 -7.810 400 HA LEU 57 HA LEU 57 2.136 -3.135 -9.747 401 HB2 LEU 57 HB2 LEU 57 2.392 -3.765 -6.789 402 HB3 LEU 57 HB1 LEU 57 3.759 -3.635 -7.870 403 HG LEU 57 HG LEU 57 2.094 -1.538 -6.655 404 HD11 LEU 57 HD11 LEU 57 4.940 -1.650 -7.613 405 HD12 LEU 57 HD12 LEU 57 4.385 -1.985 -5.975 406 HD13 LEU 57 HD13 LEU 57 4.215 -0.364 -6.649 407 HD21 LEU 57 HD21 LEU 57 1.510 -1.204 -8.979 408 HD22 LEU 57 HD22 LEU 57 3.217 -1.215 -9.422 409 HD23 LEU 57 HD23 LEU 57 2.578 0.076 -8.404 410 HA PRO 58 HA PRO 58 2.673 -7.387 -10.697 411 HB2 PRO 58 HB2 PRO 58 5.413 -7.488 -10.985 412 HB3 PRO 58 HB1 PRO 58 4.296 -6.936 -12.234 413 HG2 PRO 58 HG2 PRO 58 6.004 -5.359 -10.385 414 HG3 PRO 58 HG1 PRO 58 5.524 -5.008 -12.052 415 HD2 PRO 58 HD2 PRO 58 4.414 -3.802 -9.867 416 HD3 PRO 58 HD1 PRO 58 3.560 -4.016 -11.403 417 H GLU 59 H GLU 59 3.194 -9.261 -9.752 418 HA GLU 59 HA GLU 59 3.290 -9.665 -7.081 419 HB2 GLU 59 HB2 GLU 59 4.127 -11.927 -7.579 420 HB3 GLU 59 HB1 GLU 59 2.868 -11.428 -8.700 421 HG2 GLU 59 HG2 GLU 59 4.494 -10.961 -10.403 422 HG3 GLU 59 HG1 GLU 59 5.815 -11.267 -9.280 423 H THR 60 H THR 60 5.973 -8.773 -9.037 424 HA THR 60 HA THR 60 7.876 -9.563 -6.961 425 HB THR 60 HB THR 60 8.399 -10.518 -9.099 426 HG1 THR 60 HG1 THR 60 10.090 -9.188 -7.741 427 HG21 THR 60 HG21 THR 60 8.312 -7.704 -10.179 428 HG22 THR 60 HG22 THR 60 7.193 -9.018 -10.553 429 HG23 THR 60 HG23 THR 60 8.876 -9.115 -11.074 430 H ALA 61 H ALA 61 6.112 -6.953 -7.578 431 HA ALA 61 HA ALA 61 8.113 -4.883 -7.658 432 HB1 ALA 61 HB1 ALA 61 5.901 -4.469 -8.578 433 HB2 ALA 61 HB2 ALA 61 6.227 -3.354 -7.252 434 HB3 ALA 61 HB3 ALA 61 5.173 -4.744 -6.997 435 H ASN 62 H ASN 62 8.464 -3.342 -5.922 436 HA ASN 62 HA ASN 62 7.911 -4.437 -3.259 437 HB2 ASN 62 HB2 ASN 62 10.183 -4.154 -2.534 438 HB3 ASN 62 HB1 ASN 62 10.186 -5.165 -3.975 439 HD21 ASN 62 HD21 ASN 62 12.239 -3.404 -2.729 440 HD22 ASN 62 HD22 ASN 62 12.757 -2.352 -4.001 441 H SER 63 H SER 63 7.227 -1.924 -5.045 442 HA SER 63 HA SER 63 7.098 -0.128 -2.840 443 HB2 SER 63 HB2 SER 63 8.601 1.635 -3.884 444 HB3 SER 63 HB1 SER 63 9.434 0.236 -3.207 445 HG SER 63 HG SER 63 8.921 -0.393 -5.688 446 H VAL 64 H VAL 64 5.516 1.314 -3.165 447 HA VAL 64 HA VAL 64 4.616 1.779 -5.937 448 HB VAL 64 HB VAL 64 2.820 0.624 -4.806 449 HG11 VAL 64 HG11 VAL 64 2.394 2.665 -2.759 450 HG12 VAL 64 HG12 VAL 64 3.779 1.604 -2.521 451 HG13 VAL 64 HG13 VAL 64 2.171 0.917 -2.705 452 HG21 VAL 64 HG21 VAL 64 2.202 2.416 -6.268 453 HG22 VAL 64 HG22 VAL 64 2.193 3.532 -4.900 454 HG23 VAL 64 HG23 VAL 64 1.050 2.190 -4.960 455 H THR 65 H THR 65 4.551 3.843 -6.635 456 HA THR 65 HA THR 65 4.935 6.001 -4.729 457 HB THR 65 HB THR 65 4.894 5.825 -7.729 458 HG1 THR 65 HG1 THR 65 6.764 5.117 -6.389 459 HG21 THR 65 HG21 THR 65 5.348 8.284 -6.015 460 HG22 THR 65 HG22 THR 65 3.960 8.000 -7.067 461 HG23 THR 65 HG23 THR 65 5.567 8.202 -7.763 462 H LEU 66 H LEU 66 3.058 6.346 -3.719 463 HA LEU 66 HA LEU 66 0.483 6.244 -4.974 464 HB2 LEU 66 HB2 LEU 66 0.730 7.750 -2.487 465 HB3 LEU 66 HB1 LEU 66 -0.353 6.440 -2.899 466 HG LEU 66 HG LEU 66 2.520 5.924 -2.224 467 HD11 LEU 66 HD11 LEU 66 2.042 5.748 0.003 468 HD12 LEU 66 HD12 LEU 66 0.299 5.748 -0.260 469 HD13 LEU 66 HD13 LEU 66 1.224 7.231 -0.469 470 HD21 LEU 66 HD21 LEU 66 -0.007 4.302 -2.225 471 HD22 LEU 66 HD22 LEU 66 1.543 3.727 -1.600 472 HD23 LEU 66 HD23 LEU 66 1.368 4.119 -3.315 473 H SER 67 H SER 67 -0.778 7.954 -5.588 474 HA SER 67 HA SER 67 0.401 10.623 -5.474 475 HB2 SER 67 HB2 SER 67 0.995 9.532 -7.664 476 HB3 SER 67 HB1 SER 67 -0.729 9.398 -8.008 477 HG SER 67 HG SER 67 0.921 11.658 -7.951 478 H ASP 68 H ASP 68 -1.304 12.229 -6.317 479 HA ASP 68 HA ASP 68 -3.302 13.239 -6.024 480 HB2 ASP 68 HB2 ASP 68 -4.274 10.408 -6.346 481 HB3 ASP 68 HB1 ASP 68 -5.385 11.739 -6.041 482 H LEU 69 H LEU 69 -1.710 12.305 -3.709 483 HA LEU 69 HA LEU 69 -3.674 11.820 -1.652 484 HB2 LEU 69 HB2 LEU 69 -0.969 12.942 -1.017 485 HB3 LEU 69 HB1 LEU 69 -1.979 11.853 -0.086 486 HG LEU 69 HG LEU 69 -0.388 11.094 -2.522 487 HD11 LEU 69 HD11 LEU 69 0.943 9.839 -0.927 488 HD12 LEU 69 HD12 LEU 69 -0.054 10.442 0.399 489 HD13 LEU 69 HD13 LEU 69 0.949 11.557 -0.527 490 HD21 LEU 69 HD21 LEU 69 -2.260 9.677 -2.512 491 HD22 LEU 69 HD22 LEU 69 -2.352 9.698 -0.750 492 HD23 LEU 69 HD23 LEU 69 -1.074 8.775 -1.553 493 H GLN 70 H GLN 70 -3.240 13.524 0.339 494 HA GLN 70 HA GLN 70 -3.638 16.217 -0.774 495 HB2 GLN 70 HB2 GLN 70 -5.130 14.985 1.552 496 HB3 GLN 70 HB1 GLN 70 -5.292 16.642 0.993 497 HG2 GLN 70 HG2 GLN 70 -5.945 14.242 -0.688 498 HG3 GLN 70 HG1 GLN 70 -7.116 15.102 0.308 499 HE21 GLN 70 HE21 GLN 70 -7.733 17.193 -0.283 500 HE22 GLN 70 HE22 GLN 70 -7.460 17.814 -1.871 501 HA PRO 71 HA PRO 71 -0.238 17.107 1.937 502 HB2 PRO 71 HB2 PRO 71 -0.539 19.817 2.046 503 HB3 PRO 71 HB1 PRO 71 0.215 18.943 0.711 504 HG2 PRO 71 HG2 PRO 71 -2.560 20.030 0.937 505 HG3 PRO 71 HG1 PRO 71 -1.463 20.043 -0.455 506 HD2 PRO 71 HD2 PRO 71 -3.497 18.280 -0.232 507 HD3 PRO 71 HD1 PRO 71 -1.966 17.866 -1.032 508 H GLY 72 H GLY 72 -0.030 17.062 4.092 509 HA2 GLY 72 HA2 GLY 72 -0.418 17.513 6.323 510 HA3 GLY 72 HA1 GLY 72 -1.626 18.695 5.833 511 H VAL 73 H VAL 73 -1.565 15.326 4.884 512 HA VAL 73 HA VAL 73 -3.912 14.810 6.566 513 HB VAL 73 HB VAL 73 -3.766 14.334 3.570 514 HG11 VAL 73 HG11 VAL 73 -4.757 12.450 5.055 515 HG12 VAL 73 HG12 VAL 73 -5.689 13.052 3.681 516 HG13 VAL 73 HG13 VAL 73 -6.068 13.610 5.311 517 HG21 VAL 73 HG21 VAL 73 -5.535 15.817 3.396 518 HG22 VAL 73 HG22 VAL 73 -4.533 16.571 4.642 519 HG23 VAL 73 HG23 VAL 73 -5.964 15.634 5.095 520 H GLN 74 H GLN 74 -4.117 12.761 7.304 521 HA GLN 74 HA GLN 74 -1.716 11.187 7.358 522 HB2 GLN 74 HB2 GLN 74 -3.662 11.792 9.146 523 HB3 GLN 74 HB1 GLN 74 -4.202 10.207 8.617 524 HG2 GLN 74 HG2 GLN 74 -1.442 10.772 9.656 525 HG3 GLN 74 HG1 GLN 74 -2.773 10.193 10.654 526 HE21 GLN 74 HE21 GLN 74 -0.455 9.403 8.219 527 HE22 GLN 74 HE22 GLN 74 -0.733 7.699 8.220 528 H TYR 75 H TYR 75 -1.320 9.509 6.020 529 HA TYR 75 HA TYR 75 -3.621 8.379 4.574 530 HB2 TYR 75 HB2 TYR 75 -0.955 9.276 3.628 531 HB3 TYR 75 HB1 TYR 75 -1.637 7.834 2.869 532 HD1 TYR 75 HD2 TYR 75 -2.144 11.441 3.445 533 HD2 TYR 75 HD1 TYR 75 -3.545 7.961 1.445 534 HE1 TYR 75 HE2 TYR 75 -3.608 12.835 2.047 535 HE2 TYR 75 HE1 TYR 75 -5.015 9.344 0.049 536 HH TYR 75 HH TYR 75 -4.755 12.697 -0.161 537 H ASN 76 H ASN 76 -4.072 6.423 5.191 538 HA ASN 76 HA ASN 76 -2.054 4.596 6.174 539 HB2 ASN 76 HB2 ASN 76 -5.018 4.219 5.666 540 HB3 ASN 76 HB1 ASN 76 -3.967 3.014 6.397 541 HD21 ASN 76 HD21 ASN 76 -5.178 2.970 8.280 542 HD22 ASN 76 HD22 ASN 76 -5.147 4.263 9.427 543 H ILE 77 H ILE 77 -0.766 3.666 4.705 544 HA ILE 77 HA ILE 77 -1.835 2.899 2.095 545 HB ILE 77 HB ILE 77 0.988 2.682 3.152 546 HG12 ILE 77 HG12 ILE 77 1.273 4.353 1.176 547 HG13 ILE 77 HG11 ILE 77 -0.404 4.723 1.482 548 HG21 ILE 77 HG21 ILE 77 1.369 2.487 0.569 549 HG22 ILE 77 HG22 ILE 77 -0.260 1.804 0.606 550 HG23 ILE 77 HG23 ILE 77 1.036 1.050 1.546 551 HD11 ILE 77 HD11 ILE 77 0.148 5.302 3.794 552 HD12 ILE 77 HD12 ILE 77 1.039 6.281 2.630 553 HD13 ILE 77 HD13 ILE 77 1.845 4.953 3.463 554 H THR 78 H THR 78 -2.711 1.022 1.857 555 HA THR 78 HA THR 78 -1.925 -1.149 3.643 556 HB THR 78 HB THR 78 -4.412 -0.855 1.981 557 HG1 THR 78 HG1 THR 78 -4.772 0.633 3.486 558 HG21 THR 78 HG21 THR 78 -3.858 -3.169 2.565 559 HG22 THR 78 HG22 THR 78 -5.281 -2.629 3.456 560 HG23 THR 78 HG23 THR 78 -3.714 -2.711 4.262 561 H ILE 79 H ILE 79 -0.575 -2.594 2.721 562 HA ILE 79 HA ILE 79 -0.610 -2.886 -0.220 563 HB ILE 79 HB ILE 79 1.376 -4.275 1.587 564 HG12 ILE 79 HG12 ILE 79 1.891 -2.001 2.040 565 HG13 ILE 79 HG11 ILE 79 3.022 -2.552 0.807 566 HG21 ILE 79 HG21 ILE 79 1.374 -5.223 -0.547 567 HG22 ILE 79 HG22 ILE 79 2.756 -4.114 -0.505 568 HG23 ILE 79 HG23 ILE 79 1.268 -3.642 -1.328 569 HD11 ILE 79 HD11 ILE 79 1.940 -0.232 0.623 570 HD12 ILE 79 HD12 ILE 79 0.545 -1.119 0.005 571 HD13 ILE 79 HD13 ILE 79 2.109 -1.246 -0.818 572 H TYR 80 H TYR 80 -1.143 -4.773 -1.231 573 HA TYR 80 HA TYR 80 -1.964 -7.050 0.460 574 HB2 TYR 80 HB2 TYR 80 -3.330 -6.106 -2.076 575 HB3 TYR 80 HB1 TYR 80 -3.818 -7.467 -1.079 576 HD1 TYR 80 HD1 TYR 80 -4.959 -7.107 1.036 577 HD2 TYR 80 HD2 TYR 80 -3.871 -3.812 -1.449 578 HE1 TYR 80 HE1 TYR 80 -6.527 -5.668 2.262 579 HE2 TYR 80 HE2 TYR 80 -5.435 -2.376 -0.220 580 HH TYR 80 HH TYR 80 -7.532 -2.675 1.152 581 H ALA 81 H ALA 81 -0.451 -8.616 -0.009 582 HA ALA 81 HA ALA 81 0.554 -9.000 -2.697 583 HB1 ALA 81 HB1 ALA 81 1.550 -11.123 -1.744 584 HB2 ALA 81 HB2 ALA 81 0.815 -10.687 -0.186 585 HB3 ALA 81 HB3 ALA 81 2.035 -9.639 -0.904 586 H VAL 82 H VAL 82 -0.756 -9.781 -4.220 587 HA VAL 82 HA VAL 82 -3.045 -11.410 -3.304 588 HB VAL 82 HB VAL 82 -3.708 -9.423 -4.579 589 HG11 VAL 82 HG11 VAL 82 -2.221 -10.652 -6.873 590 HG12 VAL 82 HG12 VAL 82 -1.793 -9.165 -6.026 591 HG13 VAL 82 HG13 VAL 82 -3.284 -9.249 -6.966 592 HG21 VAL 82 HG21 VAL 82 -4.211 -11.967 -6.107 593 HG22 VAL 82 HG22 VAL 82 -5.201 -10.504 -6.157 594 HG23 VAL 82 HG23 VAL 82 -5.096 -11.445 -4.669 595 H GLU 83 H GLU 83 -3.527 -13.358 -4.116 596 HA GLU 83 HA GLU 83 -1.517 -14.642 -5.836 597 HB2 GLU 83 HB2 GLU 83 -1.450 -15.153 -3.392 598 HB3 GLU 83 HB1 GLU 83 -3.032 -15.888 -3.529 599 HG2 GLU 83 HG2 GLU 83 -0.552 -16.784 -4.954 600 HG3 GLU 83 HG1 GLU 83 -1.115 -17.452 -3.433 601 H GLU 84 H GLU 84 -2.581 -16.669 -6.928 602 HA GLU 84 HA GLU 84 -4.629 -15.908 -8.584 603 HB2 GLU 84 HB2 GLU 84 -3.954 -18.711 -7.688 604 HB3 GLU 84 HB1 GLU 84 -4.970 -18.322 -9.067 605 HG2 GLU 84 HG2 GLU 84 -3.063 -17.154 -10.099 606 HG3 GLU 84 HG1 GLU 84 -2.062 -17.650 -8.737 607 H ASN 85 H ASN 85 -4.955 -17.800 -5.580 608 HA ASN 85 HA ASN 85 -7.831 -17.158 -5.655 609 HB2 ASN 85 HB2 ASN 85 -8.363 -19.398 -4.794 610 HB3 ASN 85 HB1 ASN 85 -7.572 -19.485 -6.363 611 HD21 ASN 85 HD21 ASN 85 -5.488 -20.303 -6.502 612 HD22 ASN 85 HD22 ASN 85 -4.759 -21.198 -5.216 613 H GLN 86 H GLN 86 -5.339 -16.194 -4.143 614 HA GLN 86 HA GLN 86 -6.633 -16.216 -1.527 615 HB2 GLN 86 HB2 GLN 86 -3.839 -17.170 -2.073 616 HB3 GLN 86 HB1 GLN 86 -4.268 -16.474 -0.515 617 HG2 GLN 86 HG2 GLN 86 -5.590 -18.866 -1.781 618 HG3 GLN 86 HG1 GLN 86 -4.372 -18.918 -0.505 619 HE21 GLN 86 HE21 GLN 86 -7.129 -19.883 -0.494 620 HE22 GLN 86 HE22 GLN 86 -7.906 -19.078 0.816 621 H GLU 87 H GLU 87 -5.517 -14.678 -0.021 622 HA GLU 87 HA GLU 87 -4.098 -12.482 -1.301 623 HB2 GLU 87 HB2 GLU 87 -6.751 -12.161 0.119 624 HB3 GLU 87 HB1 GLU 87 -5.661 -10.826 -0.217 625 HG2 GLU 87 HG2 GLU 87 -5.981 -11.002 -2.530 626 HG3 GLU 87 HG1 GLU 87 -6.713 -12.599 -2.391 627 H SER 88 H SER 88 -2.430 -12.061 -0.024 628 HA SER 88 HA SER 88 -2.147 -13.135 2.567 629 HB2 SER 88 HB2 SER 88 -0.600 -10.872 1.287 630 HB3 SER 88 HB1 SER 88 -0.071 -11.861 2.647 631 HG SER 88 HG SER 88 0.844 -12.890 1.009 632 H THR 89 H THR 89 -1.885 -11.979 4.575 633 HA THR 89 HA THR 89 -3.918 -10.222 5.248 634 HB THR 89 HB THR 89 -2.475 -9.675 7.263 635 HG1 THR 89 HG1 THR 89 -0.528 -10.407 5.797 636 HG21 THR 89 HG21 THR 89 -2.897 -12.590 6.610 637 HG22 THR 89 HG22 THR 89 -4.111 -11.496 7.270 638 HG23 THR 89 HG23 THR 89 -2.687 -11.913 8.224 639 HA PRO 90 HA PRO 90 -2.617 -6.429 3.614 640 HB2 PRO 90 HB2 PRO 90 -3.913 -4.659 5.183 641 HB3 PRO 90 HB1 PRO 90 -4.760 -5.739 4.071 642 HG2 PRO 90 HG2 PRO 90 -4.408 -5.958 7.028 643 HG3 PRO 90 HG1 PRO 90 -5.822 -6.342 6.034 644 HD2 PRO 90 HD2 PRO 90 -4.037 -8.187 7.006 645 HD3 PRO 90 HD1 PRO 90 -5.077 -8.439 5.592 646 H VAL 91 H VAL 91 -0.913 -5.147 3.687 647 HA VAL 91 HA VAL 91 0.624 -4.565 6.073 648 HB VAL 91 HB VAL 91 0.709 -3.621 3.218 649 HG11 VAL 91 HG11 VAL 91 1.103 -1.690 4.668 650 HG12 VAL 91 HG12 VAL 91 2.559 -2.154 3.803 651 HG13 VAL 91 HG13 VAL 91 2.379 -2.578 5.500 652 HG21 VAL 91 HG21 VAL 91 1.771 -5.776 3.724 653 HG22 VAL 91 HG22 VAL 91 2.788 -4.974 4.925 654 HG23 VAL 91 HG23 VAL 91 2.934 -4.549 3.218 655 H VAL 92 H VAL 92 -0.081 -2.949 7.471 656 HA VAL 92 HA VAL 92 -1.388 -0.662 6.155 657 HB VAL 92 HB VAL 92 -1.762 -1.309 9.072 658 HG11 VAL 92 HG11 VAL 92 -3.762 0.115 8.768 659 HG12 VAL 92 HG12 VAL 92 -3.268 0.396 7.095 660 HG13 VAL 92 HG13 VAL 92 -2.253 0.963 8.424 661 HG21 VAL 92 HG21 VAL 92 -3.550 -2.151 6.789 662 HG22 VAL 92 HG22 VAL 92 -3.917 -2.317 8.506 663 HG23 VAL 92 HG23 VAL 92 -2.583 -3.228 7.797 664 H ILE 93 H ILE 93 0.200 0.740 5.862 665 HA ILE 93 HA ILE 93 1.762 1.523 8.235 666 HB ILE 93 HB ILE 93 3.437 2.459 6.510 667 HG12 ILE 93 HG12 ILE 93 2.303 0.332 4.726 668 HG13 ILE 93 HG11 ILE 93 1.781 1.993 4.609 669 HG21 ILE 93 HG21 ILE 93 3.931 0.585 7.973 670 HG22 ILE 93 HG22 ILE 93 4.612 0.316 6.369 671 HG23 ILE 93 HG23 ILE 93 3.137 -0.521 6.852 672 HD11 ILE 93 HD11 ILE 93 4.137 2.662 4.280 673 HD12 ILE 93 HD12 ILE 93 3.477 1.631 2.994 674 HD13 ILE 93 HD13 ILE 93 4.553 0.946 4.217 675 H GLN 94 H GLN 94 0.999 3.364 8.989 676 HA GLN 94 HA GLN 94 -0.372 5.140 7.130 677 HB2 GLN 94 HB2 GLN 94 -1.425 6.167 9.074 678 HB3 GLN 94 HB1 GLN 94 -1.683 4.434 9.058 679 HG2 GLN 94 HG2 GLN 94 0.433 5.787 10.713 680 HG3 GLN 94 HG1 GLN 94 -1.187 5.431 11.297 681 HE21 GLN 94 HE21 GLN 94 -1.417 2.859 9.996 682 HE22 GLN 94 HE22 GLN 94 -0.357 1.785 10.834 683 H GLN 95 H GLN 95 0.682 6.718 6.316 684 HA GLN 95 HA GLN 95 2.696 8.144 7.926 685 HB2 GLN 95 HB2 GLN 95 3.029 6.721 5.488 686 HB3 GLN 95 HB1 GLN 95 3.171 8.428 5.108 687 HG2 GLN 95 HG2 GLN 95 4.769 6.920 7.167 688 HG3 GLN 95 HG1 GLN 95 5.337 7.440 5.583 689 HE21 GLN 95 HE21 GLN 95 3.950 10.026 5.759 690 HE22 GLN 95 HE22 GLN 95 4.867 10.972 6.877 691 H GLU 96 H GLU 96 2.310 10.299 8.110 692 HA GLU 96 HA GLU 96 0.063 11.397 6.624 693 HB2 GLU 96 HB2 GLU 96 0.120 11.817 9.005 694 HB3 GLU 96 HB1 GLU 96 1.712 12.547 8.879 695 HG2 GLU 96 HG2 GLU 96 0.779 14.372 7.576 696 HG3 GLU 96 HG1 GLU 96 -0.815 13.622 7.643 697 H THR 97 H THR 97 0.168 12.982 5.168 698 HA THR 97 HA THR 97 2.597 13.276 3.719 699 HB THR 97 HB THR 97 1.230 14.839 2.319 700 HG1 THR 97 HG1 THR 97 -1.174 14.396 3.201 701 HG21 THR 97 HG21 THR 97 -0.136 12.223 2.985 702 HG22 THR 97 HG22 THR 97 1.247 12.396 1.904 703 HG23 THR 97 HG23 THR 97 -0.301 13.136 1.483 704 H THR 98 H THR 98 4.166 14.676 4.113 705 HA THR 98 HA THR 98 4.010 16.692 6.097 706 HB THR 98 HB THR 98 6.100 16.556 3.934 707 HG1 THR 98 HG1 THR 98 5.780 14.877 6.219 708 HG21 THR 98 HG21 THR 98 6.266 18.418 5.508 709 HG22 THR 98 HG22 THR 98 7.590 17.279 5.754 710 HG23 THR 98 HG23 THR 98 6.219 17.291 6.863 711 H GLY 99 H GLY 99 3.671 16.605 2.634 712 HA2 GLY 99 HA2 GLY 99 2.528 18.114 1.297 713 HA3 GLY 99 HA1 GLY 99 2.425 19.210 2.654 714 H THR 100 H THR 100 3.549 20.980 2.499 715 HA THR 100 HA THR 100 5.760 21.161 0.585 716 HB THR 100 HB THR 100 4.513 23.427 2.142 717 HG1 THR 100 HG1 THR 100 3.414 21.885 0.131 718 HG21 THR 100 HG21 THR 100 5.150 24.749 0.201 719 HG22 THR 100 HG22 THR 100 5.853 23.314 -0.546 720 HG23 THR 100 HG23 THR 100 6.536 23.963 0.944 721 HA PRO 101 HA PRO 101 8.772 21.127 3.948 722 HB2 PRO 101 HB2 PRO 101 10.341 23.034 2.316 723 HB3 PRO 101 HB1 PRO 101 10.787 21.433 2.916 724 HG2 PRO 101 HG2 PRO 101 10.255 21.821 0.333 725 HG3 PRO 101 HG1 PRO 101 9.741 20.337 1.159 726 HD2 PRO 101 HD2 PRO 101 8.129 22.763 0.445 727 HD3 PRO 101 HD1 PRO 101 7.704 21.047 0.295 728 H ARG 102 H ARG 102 6.753 22.685 4.595 729 HA ARG 102 HA ARG 102 7.870 24.671 6.267 730 HB2 ARG 102 HB2 ARG 102 6.627 26.620 5.351 731 HB3 ARG 102 HB1 ARG 102 7.879 26.050 4.257 732 HG2 ARG 102 HG2 ARG 102 6.190 24.896 2.919 733 HG3 ARG 102 HG1 ARG 102 4.932 25.468 4.018 734 HD2 ARG 102 HD2 ARG 102 5.034 26.864 2.030 735 HD3 ARG 102 HD1 ARG 102 5.504 27.782 3.459 736 HE ARG 102 HE ARG 102 7.707 26.611 2.005 737 HH11 ARG 102 HH11 ARG 102 5.625 29.401 2.348 738 HH12 ARG 102 HH12 ARG 102 6.750 30.491 1.602 739 HH21 ARG 102 HH21 ARG 102 9.189 28.047 1.029 740 HH22 ARG 102 HH22 ARG 102 8.772 29.725 0.860 741 H SER 103 H SER 103 6.487 22.385 6.689 742 HA SER 103 HA SER 103 3.695 22.509 6.649 743 HB2 SER 103 HB2 SER 103 5.378 20.942 8.612 744 HB3 SER 103 HB1 SER 103 3.756 20.551 8.034 745 HG SER 103 HG SER 103 4.557 19.931 6.117 746 H ASP 104 H ASP 104 6.026 23.551 9.070 747 HA ASP 104 HA ASP 104 3.816 24.566 10.722 748 HB2 ASP 104 HB2 ASP 104 6.729 24.077 11.360 749 HB3 ASP 104 HB1 ASP 104 5.645 24.952 12.437 750 H GLY 105 H GLY 105 4.879 25.704 8.180 751 HA2 GLY 105 HA2 GLY 105 6.233 28.136 8.965 752 HA3 GLY 105 HA1 GLY 105 5.721 27.699 7.341 753 H THR 106 H THR 106 4.339 28.562 10.492 754 HA THR 106 HA THR 106 2.031 29.719 9.173 755 HB THR 106 HB THR 106 1.497 28.451 11.114 756 HG1 THR 106 HG1 THR 106 0.566 30.709 10.834 757 HG21 THR 106 HG21 THR 106 3.640 28.433 12.239 758 HG22 THR 106 HG22 THR 106 2.385 28.965 13.357 759 HG23 THR 106 HG23 THR 106 3.478 30.144 12.635 Start of MODEL 25 1 H1 GLY 1 HT1 GLY 1 -3.018 -18.718 7.854 2 H2 GLY 1 HT2 GLY 1 -2.330 -17.178 7.785 3 H3 GLY 1 HT3 GLY 1 -3.722 -17.438 8.704 4 HA2 GLY 1 HA1 GLY 1 -1.801 -17.272 10.138 5 HA3 GLY 1 HA2 GLY 1 -2.508 -18.881 10.199 6 H SER 2 H SER 2 0.145 -18.304 10.938 7 HA SER 2 HA SER 2 1.874 -18.961 8.721 8 HB2 SER 2 HB2 SER 2 2.517 -18.689 11.664 9 HB3 SER 2 HB1 SER 2 3.681 -18.745 10.345 10 HG SER 2 HG SER 2 2.134 -16.843 9.631 11 H HIS 3 H HIS 3 0.152 -20.675 11.147 12 HA HIS 3 HA HIS 3 1.841 -23.045 10.762 13 HB2 HIS 3 HB2 HIS 3 -0.241 -22.361 12.826 14 HB3 HIS 3 HB1 HIS 3 0.373 -23.996 12.626 15 HD1 HIS 3 HD1 HIS 3 1.127 -20.787 14.227 16 HD2 HIS 3 HD2 HIS 3 3.201 -24.236 13.182 17 HE1 HIS 3 HE1 HIS 3 3.262 -20.720 15.550 18 HE2 HIS 3 HE2 HIS 3 4.427 -22.888 15.016 19 H MET 4 H MET 4 -1.642 -22.290 10.945 20 HA MET 4 HA MET 4 -2.301 -24.751 9.612 21 HB2 MET 4 HB2 MET 4 -3.964 -22.431 10.575 22 HB3 MET 4 HB1 MET 4 -4.655 -23.791 9.703 23 HG2 MET 4 HG2 MET 4 -3.160 -23.960 12.308 24 HG3 MET 4 HG1 MET 4 -4.911 -24.018 12.120 25 HE1 MET 4 HE1 MET 4 -4.991 -26.296 13.491 26 HE2 MET 4 HE2 MET 4 -3.240 -26.225 13.687 27 HE3 MET 4 HE3 MET 4 -4.001 -27.703 13.101 28 H GLY 5 H GLY 5 -1.387 -24.643 7.595 29 HA2 GLY 5 HA2 GLY 5 -2.056 -22.485 5.794 30 HA3 GLY 5 HA1 GLY 5 -1.130 -23.924 5.402 31 H THR 6 H THR 6 -4.429 -23.123 6.447 32 HA THR 6 HA THR 6 -5.654 -25.348 5.263 33 HB THR 6 HB THR 6 -7.757 -23.888 5.409 34 HG1 THR 6 HG1 THR 6 -6.266 -21.921 5.428 35 HG21 THR 6 HG21 THR 6 -7.095 -25.504 7.139 36 HG22 THR 6 HG22 THR 6 -7.838 -24.068 7.844 37 HG23 THR 6 HG23 THR 6 -6.087 -24.272 7.898 38 H THR 7 H THR 7 -5.496 -25.805 3.186 39 HA THR 7 HA THR 7 -5.259 -25.623 0.945 40 HB THR 7 HB THR 7 -6.994 -24.292 -0.240 41 HG1 THR 7 HG1 THR 7 -7.089 -22.969 2.088 42 HG21 THR 7 HG21 THR 7 -8.915 -25.553 0.613 43 HG22 THR 7 HG22 THR 7 -8.006 -25.946 2.071 44 HG23 THR 7 HG23 THR 7 -7.473 -26.563 0.508 45 H THR 8 H THR 8 -3.236 -24.416 2.008 46 HA THR 8 HA THR 8 -1.513 -23.033 1.478 47 HB THR 8 HB THR 8 -3.315 -21.643 -0.509 48 HG1 THR 8 HG1 THR 8 -2.162 -24.136 -0.564 49 HG21 THR 8 HG21 THR 8 -0.305 -21.854 -0.321 50 HG22 THR 8 HG22 THR 8 -1.261 -20.434 0.096 51 HG23 THR 8 HG23 THR 8 -1.207 -21.002 -1.574 52 H ALA 9 H ALA 9 -0.902 -21.566 2.883 53 HA ALA 9 HA ALA 9 -2.634 -19.237 3.355 54 HB1 ALA 9 HB1 ALA 9 -2.833 -20.726 5.277 55 HB2 ALA 9 HB2 ALA 9 -1.992 -19.238 5.716 56 HB3 ALA 9 HB3 ALA 9 -1.079 -20.726 5.466 57 HA PRO 10 HA PRO 10 1.439 -17.673 2.047 58 HB2 PRO 10 HB2 PRO 10 0.512 -15.478 0.808 59 HB3 PRO 10 HB1 PRO 10 0.396 -17.078 0.063 60 HG2 PRO 10 HG2 PRO 10 -1.691 -15.535 1.559 61 HG3 PRO 10 HG1 PRO 10 -1.838 -16.407 0.022 62 HD2 PRO 10 HD2 PRO 10 -2.630 -17.460 2.380 63 HD3 PRO 10 HD1 PRO 10 -2.041 -18.438 1.070 64 H ASP 11 H ASP 11 2.245 -15.241 2.208 65 HA ASP 11 HA ASP 11 1.302 -14.130 4.768 66 HB2 ASP 11 HB2 ASP 11 4.192 -14.503 3.941 67 HB3 ASP 11 HB1 ASP 11 3.645 -13.698 5.405 68 H ALA 12 H ALA 12 1.689 -11.890 5.036 69 HA ALA 12 HA ALA 12 1.855 -10.402 2.531 70 HB1 ALA 12 HB1 ALA 12 1.170 -8.488 3.893 71 HB2 ALA 12 HB2 ALA 12 1.305 -9.468 5.353 72 HB3 ALA 12 HB3 ALA 12 0.084 -9.856 4.140 73 HA PRO 13 HA PRO 13 6.046 -9.023 3.081 74 HB2 PRO 13 HB2 PRO 13 5.119 -6.262 2.545 75 HB3 PRO 13 HB1 PRO 13 6.314 -7.232 1.678 76 HG2 PRO 13 HG2 PRO 13 3.930 -6.768 0.606 77 HG3 PRO 13 HG1 PRO 13 4.691 -8.364 0.453 78 HD2 PRO 13 HD2 PRO 13 2.542 -7.463 2.335 79 HD3 PRO 13 HD1 PRO 13 2.639 -8.961 1.381 80 HA PRO 14 HA PRO 14 6.229 -7.582 7.363 81 HB2 PRO 14 HB2 PRO 14 9.005 -7.057 6.380 82 HB3 PRO 14 HB1 PRO 14 8.476 -7.838 7.875 83 HG2 PRO 14 HG2 PRO 14 9.402 -9.287 5.847 84 HG3 PRO 14 HG1 PRO 14 8.034 -9.856 6.821 85 HD2 PRO 14 HD2 PRO 14 8.055 -8.721 4.069 86 HD3 PRO 14 HD1 PRO 14 6.989 -9.945 4.779 87 H ASP 15 H ASP 15 6.370 -5.595 8.337 88 HA ASP 15 HA ASP 15 5.078 -3.586 7.156 89 HB2 ASP 15 HB2 ASP 15 5.929 -2.054 8.888 90 HB3 ASP 15 HB1 ASP 15 5.469 -3.620 9.543 91 HA PRO 16 HA PRO 16 7.996 -2.123 4.061 92 HB2 PRO 16 HB2 PRO 16 5.576 -0.595 3.281 93 HB3 PRO 16 HB1 PRO 16 6.588 -1.670 2.287 94 HG2 PRO 16 HG2 PRO 16 4.191 -2.472 3.055 95 HG3 PRO 16 HG1 PRO 16 5.558 -3.594 3.134 96 HD2 PRO 16 HD2 PRO 16 4.341 -1.974 5.358 97 HD3 PRO 16 HD1 PRO 16 4.704 -3.721 5.330 98 H THR 17 H THR 17 8.999 -0.195 3.684 99 HA THR 17 HA THR 17 8.411 1.917 5.669 100 HB THR 17 HB THR 17 11.066 1.495 4.294 101 HG1 THR 17 HG1 THR 17 10.139 0.398 6.767 102 HG21 THR 17 HG21 THR 17 10.283 2.875 6.866 103 HG22 THR 17 HG22 THR 17 10.704 3.674 5.352 104 HG23 THR 17 HG23 THR 17 11.921 2.746 6.228 105 H VAL 18 H VAL 18 7.867 3.779 5.040 106 HA VAL 18 HA VAL 18 7.726 4.514 2.262 107 HB VAL 18 HB VAL 18 7.228 6.148 4.757 108 HG11 VAL 18 HG11 VAL 18 6.718 6.861 1.854 109 HG12 VAL 18 HG12 VAL 18 7.864 7.639 2.953 110 HG13 VAL 18 HG13 VAL 18 6.134 7.774 3.253 111 HG21 VAL 18 HG21 VAL 18 5.282 4.959 2.792 112 HG22 VAL 18 HG22 VAL 18 4.892 5.848 4.262 113 HG23 VAL 18 HG23 VAL 18 5.670 4.269 4.367 114 H ASP 19 H ASP 19 9.277 5.337 1.102 115 HA ASP 19 HA ASP 19 11.810 5.992 2.356 116 HB2 ASP 19 HB2 ASP 19 11.863 4.488 0.467 117 HB3 ASP 19 HB1 ASP 19 11.000 5.650 -0.534 118 H GLN 20 H GLN 20 9.363 7.560 0.348 119 HA GLN 20 HA GLN 20 10.519 10.148 1.097 120 HB2 GLN 20 HB2 GLN 20 9.726 9.315 -1.694 121 HB3 GLN 20 HB1 GLN 20 9.962 10.988 -1.215 122 HG2 GLN 20 HG2 GLN 20 12.294 10.415 -0.583 123 HG3 GLN 20 HG1 GLN 20 12.026 8.802 -1.244 124 HE21 GLN 20 HE21 GLN 20 11.824 8.553 -3.471 125 HE22 GLN 20 HE22 GLN 20 12.289 9.771 -4.575 126 H VAL 21 H VAL 21 9.101 11.697 1.563 127 HA VAL 21 HA VAL 21 6.241 11.107 1.165 128 HB VAL 21 HB VAL 21 7.366 12.528 3.581 129 HG11 VAL 21 HG11 VAL 21 4.656 11.304 3.117 130 HG12 VAL 21 HG12 VAL 21 5.032 13.018 2.966 131 HG13 VAL 21 HG13 VAL 21 5.177 12.219 4.531 132 HG21 VAL 21 HG21 VAL 21 6.551 9.633 3.352 133 HG22 VAL 21 HG22 VAL 21 6.928 10.472 4.856 134 HG23 VAL 21 HG23 VAL 21 8.180 10.247 3.635 135 H ASP 22 H ASP 22 5.194 12.685 0.076 136 HA ASP 22 HA ASP 22 6.305 15.415 0.164 137 HB2 ASP 22 HB2 ASP 22 6.557 13.833 -2.034 138 HB3 ASP 22 HB1 ASP 22 4.994 14.593 -2.349 139 H ASP 23 H ASP 23 4.340 16.478 -1.629 140 HA ASP 23 HA ASP 23 2.169 16.796 0.179 141 HB2 ASP 23 HB2 ASP 23 1.190 18.190 -1.725 142 HB3 ASP 23 HB1 ASP 23 2.704 18.707 -1.025 143 H THR 24 H THR 24 2.053 15.795 -3.203 144 HA THR 24 HA THR 24 -0.377 14.246 -2.584 145 HB THR 24 HB THR 24 -1.010 14.689 -4.942 146 HG1 THR 24 HG1 THR 24 1.360 16.307 -4.878 147 HG21 THR 24 HG21 THR 24 -1.781 16.151 -3.121 148 HG22 THR 24 HG22 THR 24 -1.560 17.051 -4.621 149 HG23 THR 24 HG23 THR 24 -0.353 17.168 -3.335 150 H SER 25 H SER 25 2.109 13.114 -2.195 151 HA SER 25 HA SER 25 2.292 10.910 -3.942 152 HB2 SER 25 HB2 SER 25 4.474 13.000 -4.228 153 HB3 SER 25 HB1 SER 25 4.522 11.378 -4.918 154 HG SER 25 HG SER 25 2.230 12.591 -5.619 155 H ILE 26 H ILE 26 3.239 9.290 -2.859 156 HA ILE 26 HA ILE 26 5.306 9.809 -0.849 157 HB ILE 26 HB ILE 26 2.601 8.659 -0.135 158 HG12 ILE 26 HG12 ILE 26 4.303 10.775 1.191 159 HG13 ILE 26 HG11 ILE 26 2.899 11.079 0.178 160 HG21 ILE 26 HG21 ILE 26 3.546 7.986 2.034 161 HG22 ILE 26 HG22 ILE 26 5.157 8.374 1.432 162 HG23 ILE 26 HG23 ILE 26 4.226 7.074 0.686 163 HD11 ILE 26 HD11 ILE 26 2.943 9.722 2.863 164 HD12 ILE 26 HD12 ILE 26 1.524 9.823 1.823 165 HD13 ILE 26 HD13 ILE 26 2.248 11.298 2.462 166 H VAL 27 H VAL 27 6.639 7.894 -0.523 167 HA VAL 27 HA VAL 27 5.913 5.782 -2.463 168 HB VAL 27 HB VAL 27 8.709 6.620 -1.724 169 HG11 VAL 27 HG11 VAL 27 7.989 4.224 -2.565 170 HG12 VAL 27 HG12 VAL 27 9.465 4.995 -3.164 171 HG13 VAL 27 HG13 VAL 27 7.994 5.026 -4.141 172 HG21 VAL 27 HG21 VAL 27 7.141 7.247 -4.225 173 HG22 VAL 27 HG22 VAL 27 8.842 7.623 -3.950 174 HG23 VAL 27 HG23 VAL 27 7.598 8.399 -2.971 175 H VAL 28 H VAL 28 5.923 3.712 -1.724 176 HA VAL 28 HA VAL 28 7.136 3.286 0.909 177 HB VAL 28 HB VAL 28 5.293 2.444 1.846 178 HG11 VAL 28 HG11 VAL 28 4.565 4.593 0.969 179 HG12 VAL 28 HG12 VAL 28 3.257 3.450 1.236 180 HG13 VAL 28 HG13 VAL 28 3.838 3.755 -0.400 181 HG21 VAL 28 HG21 VAL 28 5.286 0.461 0.478 182 HG22 VAL 28 HG22 VAL 28 4.402 1.332 -0.780 183 HG23 VAL 28 HG23 VAL 28 3.638 1.027 0.783 184 H ARG 29 H ARG 29 7.996 1.253 1.301 185 HA ARG 29 HA ARG 29 8.370 -0.459 -1.078 186 HB2 ARG 29 HB2 ARG 29 10.512 0.341 0.909 187 HB3 ARG 29 HB1 ARG 29 10.724 -0.739 -0.456 188 HG2 ARG 29 HG2 ARG 29 10.209 1.145 -1.972 189 HG3 ARG 29 HG1 ARG 29 10.133 2.207 -0.567 190 HD2 ARG 29 HD2 ARG 29 12.317 2.271 -1.736 191 HD3 ARG 29 HD1 ARG 29 12.439 1.780 -0.048 192 HE ARG 29 HE ARG 29 12.536 -0.565 -0.954 193 HH11 ARG 29 HH11 ARG 29 13.609 2.164 -2.875 194 HH12 ARG 29 HH12 ARG 29 14.739 1.223 -3.795 195 HH21 ARG 29 HH21 ARG 29 14.023 -1.794 -2.163 196 HH22 ARG 29 HH22 ARG 29 14.966 -1.025 -3.402 197 H TRP 30 H TRP 30 7.874 -2.469 -0.713 198 HA TRP 30 HA TRP 30 7.715 -3.414 2.077 199 HB2 TRP 30 HB2 TRP 30 5.873 -4.928 1.288 200 HB3 TRP 30 HB1 TRP 30 5.481 -3.219 1.176 201 HD1 TRP 30 HD1 TRP 30 6.328 -6.199 -1.017 202 HE1 TRP 30 HE1 TRP 30 5.513 -5.737 -3.407 203 HE3 TRP 30 HE3 TRP 30 4.822 -1.406 -0.380 204 HZ2 TRP 30 HZ2 TRP 30 4.310 -3.614 -4.810 205 HZ3 TRP 30 HZ3 TRP 30 3.813 -0.235 -2.285 206 HH2 TRP 30 HH2 TRP 30 3.557 -1.304 -4.440 207 H SER 31 H SER 31 8.318 -5.530 2.552 208 HA SER 31 HA SER 31 10.182 -6.711 0.643 209 HB2 SER 31 HB2 SER 31 10.922 -6.337 2.984 210 HB3 SER 31 HB1 SER 31 9.658 -7.429 3.543 211 HG SER 31 HG SER 31 11.803 -8.111 1.799 212 H ARG 32 H ARG 32 9.043 -7.817 -0.804 213 HA ARG 32 HA ARG 32 6.609 -9.030 -0.571 214 HB2 ARG 32 HB2 ARG 32 8.806 -9.978 -2.400 215 HB3 ARG 32 HB1 ARG 32 7.075 -10.091 -2.667 216 HG2 ARG 32 HG2 ARG 32 7.510 -8.267 -3.948 217 HG3 ARG 32 HG1 ARG 32 7.226 -7.475 -2.396 218 HD2 ARG 32 HD2 ARG 32 9.197 -6.494 -2.684 219 HD3 ARG 32 HD1 ARG 32 9.896 -8.064 -2.289 220 HE ARG 32 HE ARG 32 9.250 -7.503 -5.085 221 HH11 ARG 32 HH11 ARG 32 11.681 -7.976 -2.598 222 HH12 ARG 32 HH12 ARG 32 12.983 -8.135 -3.733 223 HH21 ARG 32 HH21 ARG 32 10.962 -7.696 -6.564 224 HH22 ARG 32 HH22 ARG 32 12.574 -7.983 -5.983 225 HA PRO 33 HA PRO 33 7.058 -12.777 1.596 226 HB2 PRO 33 HB2 PRO 33 4.876 -14.025 0.224 227 HB3 PRO 33 HB1 PRO 33 4.817 -13.101 1.730 228 HG2 PRO 33 HG2 PRO 33 3.655 -12.319 -0.653 229 HG3 PRO 33 HG1 PRO 33 4.100 -11.214 0.668 230 HD2 PRO 33 HD2 PRO 33 5.591 -11.869 -1.839 231 HD3 PRO 33 HD1 PRO 33 5.356 -10.300 -1.059 232 H GLN 34 H GLN 34 7.454 -15.013 1.537 233 HA GLN 34 HA GLN 34 8.783 -16.035 -0.773 234 HB2 GLN 34 HB2 GLN 34 9.492 -16.649 1.458 235 HB3 GLN 34 HB1 GLN 34 7.925 -17.362 1.801 236 HG2 GLN 34 HG2 GLN 34 8.331 -19.093 0.159 237 HG3 GLN 34 HG1 GLN 34 9.865 -18.343 -0.281 238 HE21 GLN 34 HE21 GLN 34 9.287 -21.014 0.772 239 HE22 GLN 34 HE22 GLN 34 10.226 -21.165 2.217 240 H ALA 35 H ALA 35 5.567 -15.972 0.379 241 HA ALA 35 HA ALA 35 4.412 -18.201 -0.838 242 HB1 ALA 35 HB1 ALA 35 2.347 -17.083 -0.604 243 HB2 ALA 35 HB2 ALA 35 3.109 -15.494 -0.684 244 HB3 ALA 35 HB3 ALA 35 3.339 -16.518 0.742 245 HA PRO 36 HA PRO 36 4.622 -17.005 -5.176 246 HB2 PRO 36 HB2 PRO 36 2.446 -18.921 -5.595 247 HB3 PRO 36 HB1 PRO 36 4.090 -18.952 -6.235 248 HG2 PRO 36 HG2 PRO 36 3.217 -20.704 -4.362 249 HG3 PRO 36 HG1 PRO 36 4.900 -20.157 -4.456 250 HD2 PRO 36 HD2 PRO 36 2.725 -19.289 -2.597 251 HD3 PRO 36 HD1 PRO 36 4.453 -19.546 -2.273 252 H ILE 37 H ILE 37 3.690 -15.112 -5.576 253 HA ILE 37 HA ILE 37 0.807 -14.796 -5.060 254 HB ILE 37 HB ILE 37 1.256 -12.398 -4.654 255 HG12 ILE 37 HG12 ILE 37 3.977 -13.231 -5.462 256 HG13 ILE 37 HG11 ILE 37 3.124 -11.729 -5.751 257 HG21 ILE 37 HG21 ILE 37 2.086 -12.549 -2.428 258 HG22 ILE 37 HG22 ILE 37 3.065 -13.979 -2.811 259 HG23 ILE 37 HG23 ILE 37 1.307 -14.108 -2.756 260 HD11 ILE 37 HD11 ILE 37 4.654 -12.561 -3.330 261 HD12 ILE 37 HD12 ILE 37 3.511 -11.221 -3.298 262 HD13 ILE 37 HD13 ILE 37 4.911 -11.163 -4.375 263 H THR 38 H THR 38 -0.306 -13.348 -6.591 264 HA THR 38 HA THR 38 0.879 -13.610 -9.257 265 HB THR 38 HB THR 38 -1.495 -13.141 -10.036 266 HG1 THR 38 HG1 THR 38 -3.012 -13.865 -8.254 267 HG21 THR 38 HG21 THR 38 -0.992 -15.629 -8.427 268 HG22 THR 38 HG22 THR 38 -0.469 -15.342 -10.086 269 HG23 THR 38 HG23 THR 38 -2.184 -15.431 -9.710 270 H GLY 39 H GLY 39 -0.233 -11.173 -7.014 271 HA2 GLY 39 HA2 GLY 39 0.990 -9.139 -8.579 272 HA3 GLY 39 HA1 GLY 39 -0.764 -9.044 -8.658 273 H TYR 40 H TYR 40 -0.084 -6.875 -7.651 274 HA TYR 40 HA TYR 40 -0.574 -7.220 -4.772 275 HB2 TYR 40 HB2 TYR 40 1.526 -5.527 -6.064 276 HB3 TYR 40 HB1 TYR 40 0.716 -4.927 -4.619 277 HD1 TYR 40 HD2 TYR 40 1.964 -8.294 -5.625 278 HD2 TYR 40 HD1 TYR 40 2.064 -5.159 -2.760 279 HE1 TYR 40 HE2 TYR 40 3.503 -9.604 -4.254 280 HE2 TYR 40 HE1 TYR 40 3.576 -6.487 -1.364 281 HH TYR 40 HH TYR 40 5.136 -9.283 -2.528 282 H ARG 41 H ARG 41 -2.297 -6.155 -4.086 283 HA ARG 41 HA ARG 41 -3.271 -3.864 -5.653 284 HB2 ARG 41 HB2 ARG 41 -4.580 -4.832 -3.153 285 HB3 ARG 41 HB1 ARG 41 -5.282 -4.051 -4.567 286 HG2 ARG 41 HG2 ARG 41 -4.112 -6.812 -4.641 287 HG3 ARG 41 HG1 ARG 41 -5.805 -6.514 -4.222 288 HD2 ARG 41 HD2 ARG 41 -4.415 -5.838 -6.808 289 HD3 ARG 41 HD1 ARG 41 -5.665 -7.061 -6.559 290 HE ARG 41 HE ARG 41 -6.537 -4.426 -5.813 291 HH11 ARG 41 HH11 ARG 41 -6.128 -6.624 -8.516 292 HH12 ARG 41 HH12 ARG 41 -7.307 -5.818 -9.503 293 HH21 ARG 41 HH21 ARG 41 -8.057 -3.354 -7.114 294 HH22 ARG 41 HH22 ARG 41 -8.386 -3.938 -8.718 295 H ILE 42 H ILE 42 -3.429 -1.811 -4.685 296 HA ILE 42 HA ILE 42 -2.274 -1.590 -1.988 297 HB ILE 42 HB ILE 42 -1.444 0.199 -4.246 298 HG12 ILE 42 HG12 ILE 42 0.165 -1.995 -2.976 299 HG13 ILE 42 HG11 ILE 42 -0.698 -2.179 -4.495 300 HG21 ILE 42 HG21 ILE 42 0.220 1.033 -2.724 301 HG22 ILE 42 HG22 ILE 42 -0.229 -0.167 -1.512 302 HG23 ILE 42 HG23 ILE 42 -1.352 1.125 -1.931 303 HD11 ILE 42 HD11 ILE 42 0.655 -0.440 -5.487 304 HD12 ILE 42 HD12 ILE 42 1.660 -1.733 -4.828 305 HD13 ILE 42 HD13 ILE 42 1.492 -0.213 -3.954 306 H VAL 43 H VAL 43 -3.843 -0.747 -0.795 307 HA VAL 43 HA VAL 43 -5.364 1.475 -2.000 308 HB VAL 43 HB VAL 43 -6.223 -0.394 0.213 309 HG11 VAL 43 HG11 VAL 43 -8.331 0.857 0.196 310 HG12 VAL 43 HG12 VAL 43 -7.589 2.051 -0.872 311 HG13 VAL 43 HG13 VAL 43 -6.963 1.812 0.758 312 HG21 VAL 43 HG21 VAL 43 -6.412 -1.274 -2.089 313 HG22 VAL 43 HG22 VAL 43 -7.415 0.117 -2.503 314 HG23 VAL 43 HG23 VAL 43 -7.978 -1.052 -1.309 315 H TYR 44 H TYR 44 -4.552 3.310 -1.390 316 HA TYR 44 HA TYR 44 -3.819 3.639 1.415 317 HB2 TYR 44 HB2 TYR 44 -2.612 5.760 0.427 318 HB3 TYR 44 HB1 TYR 44 -1.837 4.184 0.386 319 HD1 TYR 44 HD1 TYR 44 -2.265 2.798 -1.801 320 HD2 TYR 44 HD2 TYR 44 -2.675 7.017 -1.526 321 HE1 TYR 44 HE1 TYR 44 -1.935 2.962 -4.217 322 HE2 TYR 44 HE2 TYR 44 -2.352 7.208 -3.950 323 HH TYR 44 HH TYR 44 -1.250 5.860 -5.762 324 H SER 45 H SER 45 -4.916 4.848 2.588 325 HA SER 45 HA SER 45 -6.795 6.765 1.414 326 HB2 SER 45 HB2 SER 45 -7.946 4.560 1.672 327 HB3 SER 45 HB1 SER 45 -7.607 4.629 3.400 328 HG SER 45 HG SER 45 -9.251 6.350 1.861 329 HA PRO 46 HA PRO 46 -5.481 9.362 4.819 330 HB2 PRO 46 HB2 PRO 46 -8.199 10.405 4.436 331 HB3 PRO 46 HB1 PRO 46 -6.670 11.270 4.498 332 HG2 PRO 46 HG2 PRO 46 -7.903 10.910 2.178 333 HG3 PRO 46 HG1 PRO 46 -6.139 10.755 2.298 334 HD2 PRO 46 HD2 PRO 46 -8.225 8.627 2.108 335 HD3 PRO 46 HD1 PRO 46 -6.607 8.699 1.377 336 H SER 47 H SER 47 -5.867 9.550 6.958 337 HA SER 47 HA SER 47 -7.134 7.411 8.240 338 HB2 SER 47 HB2 SER 47 -5.210 8.659 9.169 339 HB3 SER 47 HB1 SER 47 -6.256 10.052 9.425 340 HG SER 47 HG SER 47 -6.491 9.133 11.315 341 H VAL 48 H VAL 48 -8.180 10.783 7.779 342 HA VAL 48 HA VAL 48 -10.766 9.974 8.923 343 HB VAL 48 HB VAL 48 -11.198 12.324 9.478 344 HG11 VAL 48 HG11 VAL 48 -9.578 12.504 11.324 345 HG12 VAL 48 HG12 VAL 48 -8.623 11.219 10.588 346 HG13 VAL 48 HG13 VAL 48 -10.252 10.882 11.171 347 HG21 VAL 48 HG21 VAL 48 -9.416 13.982 9.377 348 HG22 VAL 48 HG22 VAL 48 -9.805 13.381 7.765 349 HG23 VAL 48 HG23 VAL 48 -8.357 12.812 8.594 350 H GLU 49 H GLU 49 -9.258 11.771 6.255 351 HA GLU 49 HA GLU 49 -11.346 11.198 4.456 352 HB2 GLU 49 HB2 GLU 49 -12.569 12.807 5.914 353 HB3 GLU 49 HB1 GLU 49 -11.376 14.031 5.512 354 HG2 GLU 49 HG2 GLU 49 -12.025 13.851 3.146 355 HG3 GLU 49 HG1 GLU 49 -13.269 12.685 3.599 356 H GLY 50 H GLY 50 -10.822 11.775 2.363 357 HA2 GLY 50 HA2 GLY 50 -9.455 13.828 1.326 358 HA3 GLY 50 HA1 GLY 50 -8.148 12.837 1.957 359 H SER 51 H SER 51 -7.320 12.431 -0.109 360 HA SER 51 HA SER 51 -9.045 11.126 -2.063 361 HB2 SER 51 HB2 SER 51 -7.553 12.935 -2.812 362 HB3 SER 51 HB1 SER 51 -6.149 12.029 -2.246 363 HG SER 51 HG SER 51 -6.227 11.498 -4.323 364 H SER 52 H SER 52 -9.167 8.955 -2.180 365 HA SER 52 HA SER 52 -6.923 7.376 -1.086 366 HB2 SER 52 HB2 SER 52 -9.774 6.417 -1.468 367 HB3 SER 52 HB1 SER 52 -8.487 5.615 -0.567 368 HG SER 52 HG SER 52 -10.052 7.840 0.129 369 H THR 53 H THR 53 -6.145 5.626 -2.278 370 HA THR 53 HA THR 53 -7.177 5.300 -4.998 371 HB THR 53 HB THR 53 -4.281 6.000 -4.483 372 HG1 THR 53 HG1 THR 53 -4.799 8.033 -4.789 373 HG21 THR 53 HG21 THR 53 -4.150 6.233 -6.911 374 HG22 THR 53 HG22 THR 53 -5.837 5.742 -7.055 375 HG23 THR 53 HG23 THR 53 -4.635 4.601 -6.450 376 H GLU 54 H GLU 54 -6.636 3.327 -5.951 377 HA GLU 54 HA GLU 54 -4.988 1.486 -4.395 378 HB2 GLU 54 HB2 GLU 54 -7.296 0.715 -4.408 379 HB3 GLU 54 HB1 GLU 54 -7.366 0.859 -6.160 380 HG2 GLU 54 HG2 GLU 54 -5.647 -0.881 -6.361 381 HG3 GLU 54 HG1 GLU 54 -5.616 -1.040 -4.607 382 H LEU 55 H LEU 55 -3.097 1.116 -5.354 383 HA LEU 55 HA LEU 55 -2.996 1.189 -8.287 384 HB2 LEU 55 HB2 LEU 55 -0.703 1.261 -6.284 385 HB3 LEU 55 HB1 LEU 55 -0.507 1.123 -8.029 386 HG LEU 55 HG LEU 55 -1.588 3.433 -6.470 387 HD11 LEU 55 HD11 LEU 55 0.722 3.063 -8.346 388 HD12 LEU 55 HD12 LEU 55 0.755 3.523 -6.640 389 HD13 LEU 55 HD13 LEU 55 0.130 4.647 -7.846 390 HD21 LEU 55 HD21 LEU 55 -3.110 3.179 -8.310 391 HD22 LEU 55 HD22 LEU 55 -1.772 2.977 -9.440 392 HD23 LEU 55 HD23 LEU 55 -2.032 4.532 -8.651 393 H ASN 56 H ASN 56 -1.942 -0.507 -9.438 394 HA ASN 56 HA ASN 56 -1.970 -3.068 -7.982 395 HB2 ASN 56 HB2 ASN 56 -3.790 -2.876 -9.675 396 HB3 ASN 56 HB1 ASN 56 -2.568 -2.631 -10.920 397 HD21 ASN 56 HD21 ASN 56 -4.093 -4.899 -8.812 398 HD22 ASN 56 HD22 ASN 56 -3.399 -6.328 -9.495 399 H LEU 57 H LEU 57 0.021 -3.811 -7.719 400 HA LEU 57 HA LEU 57 2.038 -3.007 -9.699 401 HB2 LEU 57 HB2 LEU 57 2.328 -3.651 -6.758 402 HB3 LEU 57 HB1 LEU 57 3.689 -3.566 -7.853 403 HG LEU 57 HG LEU 57 2.103 -1.417 -6.629 404 HD11 LEU 57 HD11 LEU 57 4.920 -1.600 -7.660 405 HD12 LEU 57 HD12 LEU 57 4.402 -1.923 -6.009 406 HD13 LEU 57 HD13 LEU 57 4.252 -0.299 -6.675 407 HD21 LEU 57 HD21 LEU 57 3.171 -1.139 -9.423 408 HD22 LEU 57 HD22 LEU 57 2.578 0.172 -8.404 409 HD23 LEU 57 HD23 LEU 57 1.474 -1.093 -8.948 410 HA PRO 58 HA PRO 58 2.809 -7.251 -10.793 411 HB2 PRO 58 HB2 PRO 58 5.661 -6.768 -10.232 412 HB3 PRO 58 HB1 PRO 58 4.883 -7.304 -11.717 413 HG2 PRO 58 HG2 PRO 58 5.903 -4.809 -11.348 414 HG3 PRO 58 HG1 PRO 58 4.607 -5.196 -12.491 415 HD2 PRO 58 HD2 PRO 58 4.476 -3.747 -9.940 416 HD3 PRO 58 HD1 PRO 58 3.342 -3.756 -11.298 417 H GLU 59 H GLU 59 2.996 -9.115 -9.704 418 HA GLU 59 HA GLU 59 3.032 -9.480 -6.999 419 HB2 GLU 59 HB2 GLU 59 3.834 -11.797 -7.502 420 HB3 GLU 59 HB1 GLU 59 2.475 -11.274 -8.489 421 HG2 GLU 59 HG2 GLU 59 3.946 -10.831 -10.347 422 HG3 GLU 59 HG1 GLU 59 5.354 -11.219 -9.361 423 H THR 60 H THR 60 5.723 -8.847 -9.039 424 HA THR 60 HA THR 60 7.666 -9.670 -7.031 425 HB THR 60 HB THR 60 8.060 -10.464 -9.290 426 HG1 THR 60 HG1 THR 60 9.895 -9.784 -7.963 427 HG21 THR 60 HG21 THR 60 8.586 -8.869 -11.112 428 HG22 THR 60 HG22 THR 60 8.075 -7.547 -10.062 429 HG23 THR 60 HG23 THR 60 6.913 -8.776 -10.564 430 H ALA 61 H ALA 61 5.927 -6.960 -7.626 431 HA ALA 61 HA ALA 61 7.974 -4.956 -7.697 432 HB1 ALA 61 HB1 ALA 61 6.154 -3.367 -7.331 433 HB2 ALA 61 HB2 ALA 61 5.057 -4.704 -6.984 434 HB3 ALA 61 HB3 ALA 61 5.747 -4.525 -8.596 435 H ASN 62 H ASN 62 8.482 -3.461 -6.000 436 HA ASN 62 HA ASN 62 7.955 -4.533 -3.314 437 HB2 ASN 62 HB2 ASN 62 10.254 -4.286 -2.671 438 HB3 ASN 62 HB1 ASN 62 10.195 -5.274 -4.127 439 HD21 ASN 62 HD21 ASN 62 11.229 -2.294 -2.732 440 HD22 ASN 62 HD22 ASN 62 12.124 -1.719 -4.099 441 H SER 63 H SER 63 7.263 -1.991 -5.081 442 HA SER 63 HA SER 63 7.188 -0.209 -2.859 443 HB2 SER 63 HB2 SER 63 8.728 1.518 -3.843 444 HB3 SER 63 HB1 SER 63 9.546 0.050 -3.310 445 HG SER 63 HG SER 63 8.883 -0.370 -5.810 446 H VAL 64 H VAL 64 5.605 1.252 -3.161 447 HA VAL 64 HA VAL 64 4.712 1.751 -5.934 448 HB VAL 64 HB VAL 64 2.876 0.667 -4.793 449 HG11 VAL 64 HG11 VAL 64 2.476 2.716 -2.763 450 HG12 VAL 64 HG12 VAL 64 3.877 1.677 -2.511 451 HG13 VAL 64 HG13 VAL 64 2.278 0.966 -2.686 452 HG21 VAL 64 HG21 VAL 64 2.375 3.597 -4.924 453 HG22 VAL 64 HG22 VAL 64 1.168 2.310 -4.939 454 HG23 VAL 64 HG23 VAL 64 2.315 2.455 -6.266 455 H THR 65 H THR 65 4.734 3.814 -6.644 456 HA THR 65 HA THR 65 5.183 5.961 -4.745 457 HB THR 65 HB THR 65 5.101 5.818 -7.748 458 HG1 THR 65 HG1 THR 65 6.928 4.952 -6.325 459 HG21 THR 65 HG21 THR 65 5.802 8.169 -5.968 460 HG22 THR 65 HG22 THR 65 4.394 8.049 -7.025 461 HG23 THR 65 HG23 THR 65 6.014 8.123 -7.718 462 H LEU 66 H LEU 66 3.294 6.330 -3.744 463 HA LEU 66 HA LEU 66 0.733 6.300 -5.010 464 HB2 LEU 66 HB2 LEU 66 1.080 7.832 -2.535 465 HB3 LEU 66 HB1 LEU 66 -0.126 6.634 -2.947 466 HG LEU 66 HG LEU 66 2.686 5.858 -2.257 467 HD11 LEU 66 HD11 LEU 66 2.195 5.739 -0.046 468 HD12 LEU 66 HD12 LEU 66 0.452 5.785 -0.310 469 HD13 LEU 66 HD13 LEU 66 1.415 7.245 -0.510 470 HD21 LEU 66 HD21 LEU 66 1.507 3.742 -1.667 471 HD22 LEU 66 HD22 LEU 66 1.436 4.156 -3.382 472 HD23 LEU 66 HD23 LEU 66 0.036 4.449 -2.346 473 H SER 67 H SER 67 -0.552 8.084 -5.518 474 HA SER 67 HA SER 67 0.726 10.688 -5.579 475 HB2 SER 67 HB2 SER 67 1.391 9.395 -7.684 476 HB3 SER 67 HB1 SER 67 -0.311 9.442 -8.135 477 HG SER 67 HG SER 67 -0.023 11.403 -8.797 478 H ASP 68 H ASP 68 -0.863 12.313 -6.478 479 HA ASP 68 HA ASP 68 -2.855 13.373 -6.289 480 HB2 ASP 68 HB2 ASP 68 -3.854 10.577 -6.787 481 HB3 ASP 68 HB1 ASP 68 -4.962 11.917 -6.510 482 H LEU 69 H LEU 69 -1.446 12.423 -3.929 483 HA LEU 69 HA LEU 69 -3.485 11.797 -1.994 484 HB2 LEU 69 HB2 LEU 69 -0.871 13.015 -1.185 485 HB3 LEU 69 HB1 LEU 69 -1.856 11.827 -0.361 486 HG LEU 69 HG LEU 69 -0.154 11.254 -2.776 487 HD11 LEU 69 HD11 LEU 69 0.203 10.575 0.135 488 HD12 LEU 69 HD12 LEU 69 1.140 11.760 -0.772 489 HD13 LEU 69 HD13 LEU 69 1.238 10.050 -1.193 490 HD21 LEU 69 HD21 LEU 69 -0.683 8.874 -1.880 491 HD22 LEU 69 HD22 LEU 69 -1.931 9.717 -2.807 492 HD23 LEU 69 HD23 LEU 69 -2.020 9.674 -1.043 493 H GLN 70 H GLN 70 -3.321 13.446 0.057 494 HA GLN 70 HA GLN 70 -3.662 16.151 -1.040 495 HB2 GLN 70 HB2 GLN 70 -5.825 15.081 -0.477 496 HB3 GLN 70 HB1 GLN 70 -5.273 14.875 1.179 497 HG2 GLN 70 HG2 GLN 70 -5.242 17.229 1.538 498 HG3 GLN 70 HG1 GLN 70 -5.527 17.549 -0.173 499 HE21 GLN 70 HE21 GLN 70 -7.568 17.238 -1.030 500 HE22 GLN 70 HE22 GLN 70 -8.973 17.081 -0.033 501 HA PRO 71 HA PRO 71 -0.353 17.038 1.803 502 HB2 PRO 71 HB2 PRO 71 -0.683 19.775 1.737 503 HB3 PRO 71 HB1 PRO 71 0.279 18.826 0.599 504 HG2 PRO 71 HG2 PRO 71 -2.477 19.931 0.310 505 HG3 PRO 71 HG1 PRO 71 -1.200 19.764 -0.907 506 HD2 PRO 71 HD2 PRO 71 -3.315 18.092 -0.782 507 HD3 PRO 71 HD1 PRO 71 -1.713 17.559 -1.327 508 H GLY 72 H GLY 72 -0.262 17.190 3.952 509 HA2 GLY 72 HA2 GLY 72 -0.809 17.837 6.110 510 HA3 GLY 72 HA1 GLY 72 -2.110 18.822 5.455 511 H VAL 73 H VAL 73 -1.609 15.415 4.814 512 HA VAL 73 HA VAL 73 -3.968 14.734 6.420 513 HB VAL 73 HB VAL 73 -3.628 14.093 3.480 514 HG11 VAL 73 HG11 VAL 73 -4.569 12.147 4.279 515 HG12 VAL 73 HG12 VAL 73 -5.980 13.136 3.863 516 HG13 VAL 73 HG13 VAL 73 -5.466 12.989 5.544 517 HG21 VAL 73 HG21 VAL 73 -4.609 16.182 3.520 518 HG22 VAL 73 HG22 VAL 73 -5.495 15.844 5.010 519 HG23 VAL 73 HG23 VAL 73 -5.998 15.087 3.496 520 H GLN 74 H GLN 74 -3.922 12.731 7.297 521 HA GLN 74 HA GLN 74 -1.429 11.288 7.211 522 HB2 GLN 74 HB2 GLN 74 -3.432 11.711 9.084 523 HB3 GLN 74 HB1 GLN 74 -3.591 10.013 8.662 524 HG2 GLN 74 HG2 GLN 74 -1.012 11.293 9.495 525 HG3 GLN 74 HG1 GLN 74 -2.104 10.478 10.607 526 HE21 GLN 74 HE21 GLN 74 0.675 9.876 9.851 527 HE22 GLN 74 HE22 GLN 74 0.646 8.248 9.273 528 H TYR 75 H TYR 75 -1.041 9.481 6.074 529 HA TYR 75 HA TYR 75 -3.313 8.404 4.547 530 HB2 TYR 75 HB2 TYR 75 -0.628 9.282 3.703 531 HB3 TYR 75 HB1 TYR 75 -1.205 7.780 2.976 532 HD1 TYR 75 HD2 TYR 75 -2.011 11.362 3.444 533 HD2 TYR 75 HD1 TYR 75 -2.899 7.771 1.351 534 HE1 TYR 75 HE2 TYR 75 -3.440 12.625 1.891 535 HE2 TYR 75 HE1 TYR 75 -4.335 9.019 -0.198 536 HH TYR 75 HH TYR 75 -5.496 11.010 -0.405 537 H ASN 76 H ASN 76 -3.856 6.486 5.226 538 HA ASN 76 HA ASN 76 -1.891 4.601 6.215 539 HB2 ASN 76 HB2 ASN 76 -4.872 4.349 5.741 540 HB3 ASN 76 HB1 ASN 76 -3.866 3.078 6.429 541 HD21 ASN 76 HD21 ASN 76 -3.176 3.244 8.531 542 HD22 ASN 76 HD22 ASN 76 -3.779 4.439 9.625 543 H ILE 77 H ILE 77 -0.609 3.751 4.690 544 HA ILE 77 HA ILE 77 -1.710 2.988 2.101 545 HB ILE 77 HB ILE 77 1.118 2.758 3.148 546 HG12 ILE 77 HG12 ILE 77 1.405 4.411 1.157 547 HG13 ILE 77 HG11 ILE 77 -0.267 4.795 1.459 548 HG21 ILE 77 HG21 ILE 77 -0.134 1.877 0.603 549 HG22 ILE 77 HG22 ILE 77 1.148 1.110 1.555 550 HG23 ILE 77 HG23 ILE 77 1.496 2.541 0.570 551 HD11 ILE 77 HD11 ILE 77 1.192 6.352 2.589 552 HD12 ILE 77 HD12 ILE 77 1.982 5.024 3.440 553 HD13 ILE 77 HD13 ILE 77 0.289 5.395 3.764 554 H THR 78 H THR 78 -2.608 1.127 1.863 555 HA THR 78 HA THR 78 -1.835 -1.060 3.637 556 HB THR 78 HB THR 78 -4.347 -0.701 2.022 557 HG1 THR 78 HG1 THR 78 -4.037 0.858 3.749 558 HG21 THR 78 HG21 THR 78 -3.816 -3.038 2.578 559 HG22 THR 78 HG22 THR 78 -5.233 -2.479 3.464 560 HG23 THR 78 HG23 THR 78 -3.674 -2.598 4.279 561 H ILE 79 H ILE 79 -0.530 -2.519 2.700 562 HA ILE 79 HA ILE 79 -0.575 -2.782 -0.246 563 HB ILE 79 HB ILE 79 1.389 -4.219 1.550 564 HG12 ILE 79 HG12 ILE 79 1.931 -1.954 2.022 565 HG13 ILE 79 HG11 ILE 79 3.064 -2.516 0.794 566 HG21 ILE 79 HG21 ILE 79 1.298 -3.569 -1.363 567 HG22 ILE 79 HG22 ILE 79 1.387 -5.155 -0.587 568 HG23 ILE 79 HG23 ILE 79 2.778 -4.059 -0.540 569 HD11 ILE 79 HD11 ILE 79 2.183 -1.193 -0.831 570 HD12 ILE 79 HD12 ILE 79 2.009 -0.179 0.616 571 HD13 ILE 79 HD13 ILE 79 0.616 -1.048 -0.024 572 H TYR 80 H TYR 80 -1.093 -4.677 -1.262 573 HA TYR 80 HA TYR 80 -1.994 -6.917 0.429 574 HB2 TYR 80 HB2 TYR 80 -3.304 -5.942 -2.120 575 HB3 TYR 80 HB1 TYR 80 -3.838 -7.290 -1.131 576 HD1 TYR 80 HD1 TYR 80 -4.948 -6.886 1.014 577 HD2 TYR 80 HD2 TYR 80 -3.851 -3.650 -1.541 578 HE1 TYR 80 HE1 TYR 80 -6.500 -5.412 2.217 579 HE2 TYR 80 HE2 TYR 80 -5.402 -2.180 -0.335 580 HH TYR 80 HH TYR 80 -7.500 -2.445 1.045 581 H ALA 81 H ALA 81 -0.508 -8.500 -0.005 582 HA ALA 81 HA ALA 81 0.469 -8.960 -2.692 583 HB1 ALA 81 HB1 ALA 81 1.413 -11.087 -1.703 584 HB2 ALA 81 HB2 ALA 81 0.702 -10.601 -0.148 585 HB3 ALA 81 HB3 ALA 81 1.947 -9.602 -0.896 586 H VAL 82 H VAL 82 -0.823 -9.828 -4.195 587 HA VAL 82 HA VAL 82 -3.050 -11.515 -3.215 588 HB VAL 82 HB VAL 82 -3.867 -9.600 -4.493 589 HG11 VAL 82 HG11 VAL 82 -1.954 -9.176 -5.906 590 HG12 VAL 82 HG12 VAL 82 -3.434 -9.327 -6.854 591 HG13 VAL 82 HG13 VAL 82 -2.281 -10.660 -6.799 592 HG21 VAL 82 HG21 VAL 82 -5.297 -10.733 -6.033 593 HG22 VAL 82 HG22 VAL 82 -5.033 -11.793 -4.643 594 HG23 VAL 82 HG23 VAL 82 -4.168 -12.085 -6.155 595 H GLU 83 H GLU 83 -3.194 -13.604 -3.798 596 HA GLU 83 HA GLU 83 -1.078 -14.569 -5.598 597 HB2 GLU 83 HB2 GLU 83 -2.299 -16.542 -3.783 598 HB3 GLU 83 HB1 GLU 83 -0.635 -16.331 -4.285 599 HG2 GLU 83 HG2 GLU 83 -0.565 -15.935 -2.040 600 HG3 GLU 83 HG1 GLU 83 -0.597 -14.336 -2.764 601 H GLU 84 H GLU 84 -1.656 -16.822 -6.437 602 HA GLU 84 HA GLU 84 -3.467 -16.568 -8.442 603 HB2 GLU 84 HB2 GLU 84 -2.745 -19.166 -7.084 604 HB3 GLU 84 HB1 GLU 84 -3.280 -18.961 -8.749 605 HG2 GLU 84 HG2 GLU 84 -1.269 -17.791 -9.321 606 HG3 GLU 84 HG1 GLU 84 -0.760 -17.756 -7.636 607 H ASN 85 H ASN 85 -4.153 -17.850 -5.194 608 HA ASN 85 HA ASN 85 -6.919 -18.331 -6.084 609 HB2 ASN 85 HB2 ASN 85 -5.369 -19.681 -3.871 610 HB3 ASN 85 HB1 ASN 85 -7.073 -19.959 -4.208 611 HD21 ASN 85 HD21 ASN 85 -4.936 -21.864 -4.227 612 HD22 ASN 85 HD22 ASN 85 -4.864 -22.524 -5.824 613 H GLN 86 H GLN 86 -5.057 -16.397 -3.921 614 HA GLN 86 HA GLN 86 -7.481 -15.638 -2.467 615 HB2 GLN 86 HB2 GLN 86 -4.939 -16.518 -1.090 616 HB3 GLN 86 HB1 GLN 86 -6.348 -15.837 -0.293 617 HG2 GLN 86 HG2 GLN 86 -7.659 -17.749 -0.808 618 HG3 GLN 86 HG1 GLN 86 -6.407 -18.392 -1.870 619 HE21 GLN 86 HE21 GLN 86 -6.228 -20.301 -0.742 620 HE22 GLN 86 HE22 GLN 86 -5.500 -20.397 0.820 621 H GLU 87 H GLU 87 -6.880 -13.846 -0.832 622 HA GLU 87 HA GLU 87 -4.707 -12.147 -1.866 623 HB2 GLU 87 HB2 GLU 87 -7.344 -11.252 -0.674 624 HB3 GLU 87 HB1 GLU 87 -6.032 -10.185 -1.157 625 HG2 GLU 87 HG2 GLU 87 -6.290 -10.888 -3.466 626 HG3 GLU 87 HG1 GLU 87 -7.576 -11.998 -2.997 627 H SER 88 H SER 88 -3.145 -11.845 -0.428 628 HA SER 88 HA SER 88 -3.286 -13.114 2.100 629 HB2 SER 88 HB2 SER 88 -1.152 -11.294 0.974 630 HB3 SER 88 HB1 SER 88 -0.973 -12.330 2.389 631 HG SER 88 HG SER 88 -1.687 -13.317 -0.179 632 H THR 89 H THR 89 -2.174 -11.900 4.008 633 HA THR 89 HA THR 89 -4.013 -10.115 5.095 634 HB THR 89 HB THR 89 -1.872 -9.683 6.651 635 HG1 THR 89 HG1 THR 89 -0.303 -11.104 6.329 636 HG21 THR 89 HG21 THR 89 -3.442 -12.261 6.539 637 HG22 THR 89 HG22 THR 89 -3.942 -10.775 7.348 638 HG23 THR 89 HG23 THR 89 -2.538 -11.669 7.932 639 HA PRO 90 HA PRO 90 -2.641 -6.249 3.533 640 HB2 PRO 90 HB2 PRO 90 -3.882 -4.582 5.201 641 HB3 PRO 90 HB1 PRO 90 -4.794 -5.667 4.143 642 HG2 PRO 90 HG2 PRO 90 -4.202 -5.919 7.063 643 HG3 PRO 90 HG1 PRO 90 -5.689 -6.310 6.182 644 HD2 PRO 90 HD2 PRO 90 -3.746 -8.136 6.949 645 HD3 PRO 90 HD1 PRO 90 -4.971 -8.396 5.696 646 H VAL 91 H VAL 91 -0.884 -5.061 3.633 647 HA VAL 91 HA VAL 91 0.667 -4.531 6.024 648 HB VAL 91 HB VAL 91 0.746 -3.537 3.183 649 HG11 VAL 91 HG11 VAL 91 1.206 -1.664 4.697 650 HG12 VAL 91 HG12 VAL 91 2.630 -2.127 3.778 651 HG13 VAL 91 HG13 VAL 91 2.481 -2.607 5.463 652 HG21 VAL 91 HG21 VAL 91 1.737 -5.739 3.624 653 HG22 VAL 91 HG22 VAL 91 2.797 -5.006 4.829 654 HG23 VAL 91 HG23 VAL 91 2.939 -4.544 3.131 655 H VAL 92 H VAL 92 0.064 -2.877 7.422 656 HA VAL 92 HA VAL 92 -1.279 -0.585 6.153 657 HB VAL 92 HB VAL 92 -1.650 -1.262 9.063 658 HG11 VAL 92 HG11 VAL 92 -3.164 0.458 7.104 659 HG12 VAL 92 HG12 VAL 92 -2.134 1.018 8.423 660 HG13 VAL 92 HG13 VAL 92 -3.643 0.175 8.780 661 HG21 VAL 92 HG21 VAL 92 -2.485 -3.170 7.783 662 HG22 VAL 92 HG22 VAL 92 -3.435 -2.085 6.770 663 HG23 VAL 92 HG23 VAL 92 -3.819 -2.252 8.482 664 H ILE 93 H ILE 93 0.252 0.878 5.902 665 HA ILE 93 HA ILE 93 1.864 1.607 8.259 666 HB ILE 93 HB ILE 93 3.569 2.476 6.529 667 HG12 ILE 93 HG12 ILE 93 2.367 0.374 4.760 668 HG13 ILE 93 HG11 ILE 93 1.890 2.046 4.631 669 HG21 ILE 93 HG21 ILE 93 4.669 0.289 6.403 670 HG22 ILE 93 HG22 ILE 93 3.163 -0.492 6.887 671 HG23 ILE 93 HG23 ILE 93 3.995 0.590 8.004 672 HD11 ILE 93 HD11 ILE 93 4.261 2.649 4.296 673 HD12 ILE 93 HD12 ILE 93 3.574 1.627 3.018 674 HD13 ILE 93 HD13 ILE 93 4.633 0.923 4.246 675 H GLN 94 H GLN 94 1.271 3.550 8.989 676 HA GLN 94 HA GLN 94 -0.118 5.315 7.112 677 HB2 GLN 94 HB2 GLN 94 -1.066 6.415 9.101 678 HB3 GLN 94 HB1 GLN 94 -1.447 4.703 9.027 679 HG2 GLN 94 HG2 GLN 94 0.242 4.222 10.693 680 HG3 GLN 94 HG1 GLN 94 0.711 5.922 10.735 681 HE21 GLN 94 HE21 GLN 94 -1.704 3.585 11.609 682 HE22 GLN 94 HE22 GLN 94 -2.576 4.598 12.707 683 H GLN 95 H GLN 95 0.853 6.991 6.346 684 HA GLN 95 HA GLN 95 2.815 8.444 7.973 685 HB2 GLN 95 HB2 GLN 95 3.347 6.961 5.591 686 HB3 GLN 95 HB1 GLN 95 3.515 8.667 5.213 687 HG2 GLN 95 HG2 GLN 95 4.956 7.154 7.379 688 HG3 GLN 95 HG1 GLN 95 5.641 7.734 5.863 689 HE21 GLN 95 HE21 GLN 95 4.121 10.279 6.063 690 HE22 GLN 95 HE22 GLN 95 4.960 11.210 7.251 691 H GLU 96 H GLU 96 2.473 10.609 7.968 692 HA GLU 96 HA GLU 96 0.228 11.614 6.427 693 HB2 GLU 96 HB2 GLU 96 0.435 12.176 8.808 694 HB3 GLU 96 HB1 GLU 96 1.960 12.984 8.493 695 HG2 GLU 96 HG2 GLU 96 0.775 14.594 7.063 696 HG3 GLU 96 HG1 GLU 96 -0.745 13.786 7.445 697 H THR 97 H THR 97 0.311 13.201 4.923 698 HA THR 97 HA THR 97 2.630 13.282 3.301 699 HB THR 97 HB THR 97 1.301 14.989 1.999 700 HG1 THR 97 HG1 THR 97 -1.073 14.634 3.035 701 HG21 THR 97 HG21 THR 97 1.179 12.521 1.616 702 HG22 THR 97 HG22 THR 97 -0.302 13.383 1.189 703 HG23 THR 97 HG23 THR 97 -0.215 12.472 2.697 704 H THR 98 H THR 98 4.199 14.751 3.109 705 HA THR 98 HA THR 98 4.718 16.545 5.248 706 HB THR 98 HB THR 98 6.108 16.466 2.570 707 HG1 THR 98 HG1 THR 98 7.401 14.818 3.442 708 HG21 THR 98 HG21 THR 98 7.089 17.187 5.339 709 HG22 THR 98 HG22 THR 98 6.756 18.321 4.031 710 HG23 THR 98 HG23 THR 98 8.074 17.159 3.876 711 H GLY 99 H GLY 99 3.378 16.822 2.076 712 HA2 GLY 99 HA2 GLY 99 3.668 19.436 1.369 713 HA3 GLY 99 HA1 GLY 99 2.230 18.514 1.044 714 H THR 100 H THR 100 3.188 21.332 2.187 715 HA THR 100 HA THR 100 1.206 21.586 4.298 716 HB THR 100 HB THR 100 2.958 23.680 2.990 717 HG1 THR 100 HG1 THR 100 3.413 23.002 5.619 718 HG21 THR 100 HG21 THR 100 0.970 24.660 3.952 719 HG22 THR 100 HG22 THR 100 2.394 25.073 4.899 720 HG23 THR 100 HG23 THR 100 1.280 23.835 5.479 721 HA PRO 101 HA PRO 101 -2.063 22.328 1.313 722 HB2 PRO 101 HB2 PRO 101 -3.298 23.641 3.677 723 HB3 PRO 101 HB1 PRO 101 -3.957 22.397 2.611 724 HG2 PRO 101 HG2 PRO 101 -3.116 21.795 5.069 725 HG3 PRO 101 HG1 PRO 101 -2.859 20.684 3.712 726 HD2 PRO 101 HD2 PRO 101 -0.920 22.494 5.078 727 HD3 PRO 101 HD1 PRO 101 -0.668 20.877 4.389 728 H ARG 102 H ARG 102 -1.620 23.897 -0.100 729 HA ARG 102 HA ARG 102 -1.874 26.671 0.706 730 HB2 ARG 102 HB2 ARG 102 0.466 26.301 1.125 731 HB3 ARG 102 HB1 ARG 102 0.670 25.512 -0.433 732 HG2 ARG 102 HG2 ARG 102 0.253 27.608 -1.578 733 HG3 ARG 102 HG1 ARG 102 -0.030 28.413 -0.032 734 HD2 ARG 102 HD2 ARG 102 2.245 28.798 -0.933 735 HD3 ARG 102 HD1 ARG 102 2.240 28.017 0.645 736 HE ARG 102 HE ARG 102 2.451 26.316 -1.724 737 HH11 ARG 102 HH11 ARG 102 3.998 27.788 1.049 738 HH12 ARG 102 HH12 ARG 102 5.369 26.728 1.012 739 HH21 ARG 102 HH21 ARG 102 4.253 24.911 -1.777 740 HH22 ARG 102 HH22 ARG 102 5.517 25.094 -0.601 741 H SER 103 H SER 103 -3.404 27.255 -0.678 742 HA SER 103 HA SER 103 -3.015 26.642 -3.527 743 HB2 SER 103 HB2 SER 103 -5.445 27.195 -3.746 744 HB3 SER 103 HB1 SER 103 -5.141 25.816 -2.689 745 HG SER 103 HG SER 103 -5.741 28.493 -1.927 746 H ASP 104 H ASP 104 -4.366 28.554 -4.771 747 HA ASP 104 HA ASP 104 -4.515 30.723 -5.397 748 HB2 ASP 104 HB2 ASP 104 -3.921 31.310 -2.489 749 HB3 ASP 104 HB1 ASP 104 -4.467 32.494 -3.672 750 H GLY 105 H GLY 105 -2.309 29.667 -6.223 751 HA2 GLY 105 HA2 GLY 105 -0.120 31.495 -5.511 752 HA3 GLY 105 HA1 GLY 105 0.039 30.017 -6.454 753 H THR 106 H THR 106 -2.217 32.713 -6.766 754 HA THR 106 HA THR 106 -2.970 33.853 -8.554 755 HB THR 106 HB THR 106 -1.198 34.910 -10.023 756 HG1 THR 106 HG1 THR 106 0.322 33.026 -9.159 757 HG21 THR 106 HG21 THR 106 -0.389 36.387 -8.238 758 HG22 THR 106 HG22 THR 106 -0.937 35.221 -7.034 759 HG23 THR 106 HG23 THR 106 -2.109 36.037 -8.068
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