NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
591031 | 2n2j | 19390 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 11.680 15.766 -3.763 2 H2 GLY 1 H2 GLY 1 12.443 15.000 -2.451 3 H3 GLY 1 H3 GLY 1 13.202 16.291 -3.238 4 HA2 GLY 1 HA2 GLY 1 12.318 17.101 -1.193 5 HA3 GLY 1 HA3 GLY 1 11.389 17.774 -2.525 6 H ALA 2 H ALA 2 9.346 17.963 -1.824 7 HA ALA 2 HA ALA 2 8.082 15.576 -0.672 8 HB1 ALA 2 HB1 ALA 2 8.752 17.046 1.179 9 HB2 ALA 2 HB2 ALA 2 7.000 16.878 1.058 10 HB3 ALA 2 HB3 ALA 2 7.787 18.346 0.479 11 H MET 3 H MET 3 8.025 17.210 -3.281 12 HA MET 3 HA MET 3 5.082 17.325 -3.403 13 HB2 MET 3 HB2 MET 3 5.192 19.286 -4.879 14 HB3 MET 3 HB3 MET 3 5.869 19.629 -3.294 15 HG2 MET 3 HG2 MET 3 8.116 19.403 -4.189 16 HG3 MET 3 HG3 MET 3 7.458 19.008 -5.775 17 HE1 MET 3 HE1 MET 3 5.744 22.360 -6.817 18 HE2 MET 3 HE2 MET 3 4.981 21.013 -5.974 19 HE3 MET 3 HE3 MET 3 6.120 20.702 -7.284 20 H GLU 4 H GLU 4 8.122 16.736 -4.979 21 HA GLU 4 HA GLU 4 6.791 15.776 -7.395 22 HB2 GLU 4 HB2 GLU 4 9.571 15.395 -7.640 23 HB3 GLU 4 HB3 GLU 4 8.592 16.628 -8.416 24 HG2 GLU 4 HG2 GLU 4 10.464 17.654 -7.326 25 HG3 GLU 4 HG3 GLU 4 8.983 18.116 -6.496 26 H MET 5 H MET 5 7.151 14.560 -4.586 27 HA MET 5 HA MET 5 8.453 12.079 -4.943 28 HB2 MET 5 HB2 MET 5 7.071 11.424 -2.922 29 HB3 MET 5 HB3 MET 5 8.091 12.840 -2.720 30 HG2 MET 5 HG2 MET 5 6.094 14.245 -3.222 31 HG3 MET 5 HG3 MET 5 5.120 12.785 -3.176 32 HE1 MET 5 HE1 MET 5 6.908 11.292 -0.799 33 HE2 MET 5 HE2 MET 5 5.154 11.159 -0.922 34 HE3 MET 5 HE3 MET 5 5.897 11.663 0.598 35 HA PRO 6 HA PRO 6 5.761 10.196 -7.833 36 HB2 PRO 6 HB2 PRO 6 6.427 7.577 -7.216 37 HB3 PRO 6 HB3 PRO 6 7.341 8.638 -8.295 38 HG2 PRO 6 HG2 PRO 6 7.831 7.984 -5.425 39 HG3 PRO 6 HG3 PRO 6 8.994 8.189 -6.747 40 HD2 PRO 6 HD2 PRO 6 8.596 10.114 -4.923 41 HD3 PRO 6 HD3 PRO 6 8.916 10.503 -6.625 42 H THR 7 H THR 7 3.703 9.635 -7.832 43 HA THR 7 HA THR 7 2.518 8.737 -5.286 44 HB THR 7 HB THR 7 1.158 10.366 -7.429 45 HG1 THR 7 HG1 THR 7 3.080 11.156 -5.786 46 HG21 THR 7 HG21 THR 7 -0.440 10.884 -5.656 47 HG22 THR 7 HG22 THR 7 0.473 9.878 -4.530 48 HG23 THR 7 HG23 THR 7 -0.330 9.143 -5.917 49 H PHE 8 H PHE 8 1.207 7.003 -5.298 50 HA PHE 8 HA PHE 8 0.361 5.868 -7.891 51 HB2 PHE 8 HB2 PHE 8 0.977 4.397 -5.311 52 HB3 PHE 8 HB3 PHE 8 0.404 3.657 -6.796 53 HD1 PHE 8 HD1 PHE 8 3.233 5.476 -5.265 54 HD2 PHE 8 HD2 PHE 8 1.921 3.058 -8.512 55 HE1 PHE 8 HE1 PHE 8 5.570 5.167 -5.972 56 HE2 PHE 8 HE2 PHE 8 4.261 2.748 -9.230 57 HZ PHE 8 HZ PHE 8 6.083 3.805 -7.959 58 H TYR 9 H TYR 9 -1.795 5.117 -8.012 59 HA TYR 9 HA TYR 9 -3.453 5.655 -5.637 60 HB2 TYR 9 HB2 TYR 9 -3.551 7.389 -7.581 61 HB3 TYR 9 HB3 TYR 9 -4.471 6.148 -8.422 62 HD1 TYR 9 HD1 TYR 9 -6.717 5.503 -7.615 63 HD2 TYR 9 HD2 TYR 9 -4.482 8.595 -5.736 64 HE1 TYR 9 HE1 TYR 9 -8.760 6.293 -6.489 65 HE2 TYR 9 HE2 TYR 9 -6.515 9.392 -4.610 66 HH TYR 9 HH TYR 9 -8.905 9.317 -4.861 67 H LEU 10 H LEU 10 -4.573 3.930 -5.032 68 HA LEU 10 HA LEU 10 -5.539 2.058 -7.048 69 HB2 LEU 10 HB2 LEU 10 -4.834 0.161 -5.446 70 HB3 LEU 10 HB3 LEU 10 -3.639 0.859 -6.519 71 HG LEU 10 HG LEU 10 -2.987 2.331 -4.503 72 HD11 LEU 10 HD11 LEU 10 -4.411 0.114 -3.051 73 HD12 LEU 10 HD12 LEU 10 -4.922 1.802 -3.109 74 HD13 LEU 10 HD13 LEU 10 -3.402 1.366 -2.324 75 HD21 LEU 10 HD21 LEU 10 -1.483 0.594 -3.678 76 HD22 LEU 10 HD22 LEU 10 -1.581 0.596 -5.440 77 HD23 LEU 10 HD23 LEU 10 -2.446 -0.628 -4.509 78 H ALA 11 H ALA 11 -7.235 0.631 -6.247 79 HA ALA 11 HA ALA 11 -8.577 1.690 -3.844 80 HB1 ALA 11 HB1 ALA 11 -9.904 0.811 -6.402 81 HB2 ALA 11 HB2 ALA 11 -9.744 2.474 -5.833 82 HB3 ALA 11 HB3 ALA 11 -10.730 1.324 -4.929 83 H LEU 12 H LEU 12 -9.147 0.237 -2.383 84 HA LEU 12 HA LEU 12 -8.781 -2.602 -3.099 85 HB2 LEU 12 HB2 LEU 12 -8.078 -1.309 -0.465 86 HB3 LEU 12 HB3 LEU 12 -7.762 -2.963 -0.944 87 HG LEU 12 HG LEU 12 -6.481 -0.529 -2.186 88 HD11 LEU 12 HD11 LEU 12 -5.727 -0.860 0.094 89 HD12 LEU 12 HD12 LEU 12 -4.452 -1.298 -1.043 90 HD13 LEU 12 HD13 LEU 12 -5.392 -2.558 -0.243 91 HD21 LEU 12 HD21 LEU 12 -5.008 -2.141 -3.284 92 HD22 LEU 12 HD22 LEU 12 -6.691 -2.385 -3.756 93 HD23 LEU 12 HD23 LEU 12 -5.938 -3.468 -2.586 94 H HIS 13 H HIS 13 -10.226 -4.045 -2.284 95 HA HIS 13 HA HIS 13 -12.719 -3.056 -1.298 96 HB2 HIS 13 HB2 HIS 13 -11.625 -5.839 -1.708 97 HB3 HIS 13 HB3 HIS 13 -13.216 -5.555 -1.009 98 HD1 HIS 13 HD1 HIS 13 -11.612 -6.128 -4.172 99 HD2 HIS 13 HD2 HIS 13 -14.879 -3.903 -2.865 100 HE1 HIS 13 HE1 HIS 13 -12.976 -5.648 -6.224 101 HE2 HIS 13 HE2 HIS 13 -14.835 -4.152 -5.436 102 H GLY 14 H GLY 14 -13.403 -2.809 0.716 103 HA2 GLY 14 HA2 GLY 14 -11.629 -2.847 2.887 104 HA3 GLY 14 HA3 GLY 14 -13.373 -2.684 3.002 105 H GLY 15 H GLY 15 -10.766 -4.543 3.834 106 HA2 GLY 15 HA2 GLY 15 -10.953 -6.313 5.387 107 HA3 GLY 15 HA3 GLY 15 -12.553 -6.661 4.767 108 H GLN 16 H GLN 16 -10.330 -6.182 2.277 109 HA GLN 16 HA GLN 16 -10.132 -9.098 1.946 110 HB2 GLN 16 HB2 GLN 16 -10.014 -6.941 -0.162 111 HB3 GLN 16 HB3 GLN 16 -9.929 -8.669 -0.460 112 HG2 GLN 16 HG2 GLN 16 -12.292 -7.226 0.719 113 HG3 GLN 16 HG3 GLN 16 -12.130 -7.684 -0.971 114 HE21 GLN 16 HE21 GLN 16 -11.184 -9.649 1.803 115 HE22 GLN 16 HE22 GLN 16 -12.362 -10.886 1.557 116 H THR 17 H THR 17 -8.204 -10.000 1.150 117 HA THR 17 HA THR 17 -5.833 -8.559 2.067 118 HB THR 17 HB THR 17 -5.987 -11.413 1.057 119 HG1 THR 17 HG1 THR 17 -7.107 -10.339 3.281 120 HG21 THR 17 HG21 THR 17 -4.033 -11.720 2.516 121 HG22 THR 17 HG22 THR 17 -4.083 -10.006 2.936 122 HG23 THR 17 HG23 THR 17 -3.739 -10.499 1.277 123 H TYR 18 H TYR 18 -4.220 -7.906 0.806 124 HA TYR 18 HA TYR 18 -4.246 -8.597 -2.049 125 HB2 TYR 18 HB2 TYR 18 -3.840 -5.888 -0.777 126 HB3 TYR 18 HB3 TYR 18 -3.378 -6.245 -2.439 127 HD1 TYR 18 HD1 TYR 18 -5.057 -6.591 -4.147 128 HD2 TYR 18 HD2 TYR 18 -6.188 -5.717 -0.142 129 HE1 TYR 18 HE1 TYR 18 -7.334 -6.088 -4.914 130 HE2 TYR 18 HE2 TYR 18 -8.472 -5.202 -0.893 131 HH TYR 18 HH TYR 18 -9.594 -5.961 -4.039 132 H HIS 19 H HIS 19 -2.255 -8.679 -3.056 133 HA HIS 19 HA HIS 19 0.052 -8.968 -1.288 134 HB2 HIS 19 HB2 HIS 19 -0.723 -9.951 -3.973 135 HB3 HIS 19 HB3 HIS 19 0.980 -9.584 -3.761 136 HD1 HIS 19 HD1 HIS 19 -0.810 -12.423 -3.914 137 HD2 HIS 19 HD2 HIS 19 1.474 -10.845 -0.815 138 HE1 HIS 19 HE1 HIS 19 -0.175 -14.383 -2.474 139 HE2 HIS 19 HE2 HIS 19 1.377 -13.432 -0.726 140 H LEU 20 H LEU 20 1.312 -7.311 -1.005 141 HA LEU 20 HA LEU 20 1.361 -5.170 -3.011 142 HB2 LEU 20 HB2 LEU 20 0.542 -4.228 -1.031 143 HB3 LEU 20 HB3 LEU 20 1.579 -5.216 -0.022 144 HG LEU 20 HG LEU 20 3.504 -3.861 -0.609 145 HD11 LEU 20 HD11 LEU 20 3.210 -1.804 -1.931 146 HD12 LEU 20 HD12 LEU 20 1.570 -2.320 -2.327 147 HD13 LEU 20 HD13 LEU 20 2.953 -3.274 -2.871 148 HD21 LEU 20 HD21 LEU 20 2.145 -3.185 1.292 149 HD22 LEU 20 HD22 LEU 20 1.126 -2.208 0.234 150 HD23 LEU 20 HD23 LEU 20 2.819 -1.775 0.473 151 H ILE 21 H ILE 21 3.129 -5.060 -4.176 152 HA ILE 21 HA ILE 21 5.688 -5.815 -2.927 153 HB ILE 21 HB ILE 21 4.944 -6.295 -5.821 154 HG12 ILE 21 HG12 ILE 21 5.487 -8.532 -3.932 155 HG13 ILE 21 HG13 ILE 21 3.925 -7.729 -3.800 156 HG21 ILE 21 HG21 ILE 21 7.045 -7.578 -5.884 157 HG22 ILE 21 HG22 ILE 21 7.368 -7.115 -4.214 158 HG23 ILE 21 HG23 ILE 21 7.324 -5.884 -5.474 159 HD11 ILE 21 HD11 ILE 21 5.030 -8.956 -6.314 160 HD12 ILE 21 HD12 ILE 21 3.432 -8.237 -6.102 161 HD13 ILE 21 HD13 ILE 21 3.858 -9.712 -5.234 162 H VAL 22 H VAL 22 7.086 -4.185 -2.924 163 HA VAL 22 HA VAL 22 6.816 -2.114 -4.993 164 HB VAL 22 HB VAL 22 6.522 -1.233 -2.705 165 HG11 VAL 22 HG11 VAL 22 7.904 -2.798 -1.471 166 HG12 VAL 22 HG12 VAL 22 8.433 -1.144 -1.164 167 HG13 VAL 22 HG13 VAL 22 9.350 -2.173 -2.264 168 HG21 VAL 22 HG21 VAL 22 9.060 -0.322 -4.051 169 HG22 VAL 22 HG22 VAL 22 8.137 0.602 -2.865 170 HG23 VAL 22 HG23 VAL 22 7.425 0.219 -4.433 171 H ASP 23 H ASP 23 8.501 -1.709 -6.281 172 HA ASP 23 HA ASP 23 11.115 -2.874 -5.729 173 HB2 ASP 23 HB2 ASP 23 9.859 -4.656 -6.895 174 HB3 ASP 23 HB3 ASP 23 9.482 -3.536 -8.197 175 H THR 24 H THR 24 12.644 -2.134 -7.647 176 HA THR 24 HA THR 24 11.759 0.583 -8.354 177 HB THR 24 HB THR 24 14.342 1.004 -8.446 178 HG1 THR 24 HG1 THR 24 14.151 -1.227 -6.666 179 HG21 THR 24 HG21 THR 24 12.871 0.756 -5.821 180 HG22 THR 24 HG22 THR 24 12.811 2.136 -6.920 181 HG23 THR 24 HG23 THR 24 14.320 1.721 -6.106 182 H ASP 25 H ASP 25 12.087 1.359 -10.324 183 HA ASP 25 HA ASP 25 12.632 -0.450 -12.486 184 HB2 ASP 25 HB2 ASP 25 10.944 1.305 -12.707 185 HB3 ASP 25 HB3 ASP 25 12.153 2.541 -12.387 186 H SER 26 H SER 26 14.290 0.171 -14.193 187 HA SER 26 HA SER 26 16.862 0.199 -13.135 188 HB2 SER 26 HB2 SER 26 16.010 1.054 -15.910 189 HB3 SER 26 HB3 SER 26 17.615 0.493 -15.433 190 HG SER 26 HG SER 26 16.827 -1.537 -15.109 191 H LEU 27 H LEU 27 14.770 2.854 -14.071 192 HA LEU 27 HA LEU 27 16.788 4.875 -14.093 193 HB2 LEU 27 HB2 LEU 27 13.815 5.125 -13.648 194 HB3 LEU 27 HB3 LEU 27 14.902 6.448 -14.012 195 HG LEU 27 HG LEU 27 14.298 4.136 -15.854 196 HD11 LEU 27 HD11 LEU 27 13.383 7.007 -15.921 197 HD12 LEU 27 HD12 LEU 27 12.383 5.596 -15.573 198 HD13 LEU 27 HD13 LEU 27 13.090 5.803 -17.176 199 HD21 LEU 27 HD21 LEU 27 15.898 6.653 -16.310 200 HD22 LEU 27 HD22 LEU 27 15.497 5.447 -17.533 201 HD23 LEU 27 HD23 LEU 27 16.546 5.017 -16.182 202 H GLY 28 H GLY 28 15.213 3.183 -11.591 203 HA2 GLY 28 HA2 GLY 28 15.940 3.361 -9.323 204 HA3 GLY 28 HA3 GLY 28 16.334 5.050 -9.614 205 H ASN 29 H ASN 29 13.446 4.504 -11.071 206 HA ASN 29 HA ASN 29 12.003 5.804 -8.920 207 HB2 ASN 29 HB2 ASN 29 11.047 4.976 -11.666 208 HB3 ASN 29 HB3 ASN 29 10.137 5.940 -10.518 209 HD21 ASN 29 HD21 ASN 29 11.021 6.557 -13.221 210 HD22 ASN 29 HD22 ASN 29 11.962 8.010 -13.105 211 HA PRO 30 HA PRO 30 10.425 2.047 -7.271 212 HB2 PRO 30 HB2 PRO 30 8.345 3.680 -6.042 213 HB3 PRO 30 HB3 PRO 30 9.656 2.780 -5.276 214 HG2 PRO 30 HG2 PRO 30 9.574 5.490 -5.383 215 HG3 PRO 30 HG3 PRO 30 11.080 4.565 -5.312 216 HD2 PRO 30 HD2 PRO 30 9.779 5.911 -7.638 217 HD3 PRO 30 HD3 PRO 30 11.500 5.717 -7.248 218 H SER 31 H SER 31 8.768 0.732 -7.405 219 HA SER 31 HA SER 31 6.694 1.371 -9.352 220 HB2 SER 31 HB2 SER 31 8.704 -0.872 -9.253 221 HB3 SER 31 HB3 SER 31 7.294 -0.908 -10.257 222 HG SER 31 HG SER 31 8.944 1.324 -10.407 223 H LEU 32 H LEU 32 4.736 0.280 -8.945 224 HA LEU 32 HA LEU 32 4.699 -1.224 -6.408 225 HB2 LEU 32 HB2 LEU 32 3.893 1.211 -6.357 226 HB3 LEU 32 HB3 LEU 32 2.509 0.647 -7.273 227 HG LEU 32 HG LEU 32 2.087 -0.999 -5.397 228 HD11 LEU 32 HD11 LEU 32 4.312 -0.928 -4.408 229 HD12 LEU 32 HD12 LEU 32 3.079 -0.470 -3.232 230 HD13 LEU 32 HD13 LEU 32 4.080 0.770 -3.989 231 HD21 LEU 32 HD21 LEU 32 0.755 1.012 -5.688 232 HD22 LEU 32 HD22 LEU 32 1.948 1.949 -4.786 233 HD23 LEU 32 HD23 LEU 32 1.024 0.683 -3.977 234 H SER 33 H SER 33 3.589 -3.074 -6.400 235 HA SER 33 HA SER 33 1.559 -3.515 -8.476 236 HB2 SER 33 HB2 SER 33 3.663 -5.528 -7.639 237 HB3 SER 33 HB3 SER 33 2.361 -5.811 -8.798 238 HG SER 33 HG SER 33 3.698 -3.599 -9.491 239 H VAL 34 H VAL 34 -0.322 -4.061 -7.609 240 HA VAL 34 HA VAL 34 -0.327 -5.455 -5.012 241 HB VAL 34 HB VAL 34 -2.166 -3.218 -5.887 242 HG11 VAL 34 HG11 VAL 34 -3.321 -3.515 -3.757 243 HG12 VAL 34 HG12 VAL 34 -2.313 -4.917 -3.398 244 HG13 VAL 34 HG13 VAL 34 -3.444 -4.966 -4.751 245 HG21 VAL 34 HG21 VAL 34 -1.302 -2.052 -3.935 246 HG22 VAL 34 HG22 VAL 34 0.022 -2.521 -5.003 247 HG23 VAL 34 HG23 VAL 34 -0.291 -3.442 -3.531 248 H ILE 35 H ILE 35 -1.320 -7.338 -5.068 249 HA ILE 35 HA ILE 35 -3.280 -7.841 -7.224 250 HB ILE 35 HB ILE 35 -1.782 -10.115 -6.028 251 HG12 ILE 35 HG12 ILE 35 -0.609 -8.279 -8.130 252 HG13 ILE 35 HG13 ILE 35 0.007 -8.496 -6.501 253 HG21 ILE 35 HG21 ILE 35 -2.728 -9.483 -8.818 254 HG22 ILE 35 HG22 ILE 35 -3.613 -10.429 -7.621 255 HG23 ILE 35 HG23 ILE 35 -2.081 -11.029 -8.262 256 HD11 ILE 35 HD11 ILE 35 1.341 -9.721 -8.116 257 HD12 ILE 35 HD12 ILE 35 -0.090 -10.609 -8.639 258 HD13 ILE 35 HD13 ILE 35 0.531 -10.822 -7.002 259 HA PRO 36 HA PRO 36 -6.034 -8.819 -3.825 260 HB2 PRO 36 HB2 PRO 36 -7.951 -10.052 -5.335 261 HB3 PRO 36 HB3 PRO 36 -7.799 -8.297 -5.187 262 HG2 PRO 36 HG2 PRO 36 -6.847 -10.105 -7.371 263 HG3 PRO 36 HG3 PRO 36 -7.626 -8.518 -7.493 264 HD2 PRO 36 HD2 PRO 36 -4.964 -8.837 -7.776 265 HD3 PRO 36 HD3 PRO 36 -5.664 -7.383 -7.034 266 H SER 37 H SER 37 -6.037 -10.529 -2.479 267 HA SER 37 HA SER 37 -4.865 -13.007 -3.174 268 HB2 SER 37 HB2 SER 37 -6.552 -12.239 -0.788 269 HB3 SER 37 HB3 SER 37 -5.642 -13.745 -0.934 270 HG SER 37 HG SER 37 -3.835 -12.109 -1.435 271 H ASN 38 H ASN 38 -8.079 -11.766 -3.308 272 HA ASN 38 HA ASN 38 -8.913 -14.255 -4.618 273 HB2 ASN 38 HB2 ASN 38 -10.427 -12.646 -2.585 274 HB3 ASN 38 HB3 ASN 38 -11.281 -13.615 -3.776 275 HD21 ASN 38 HD21 ASN 38 -11.170 -13.865 -0.871 276 HD22 ASN 38 HD22 ASN 38 -10.588 -15.470 -0.565 277 HA PRO 39 HA PRO 39 -9.197 -10.970 -7.666 278 HB2 PRO 39 HB2 PRO 39 -9.325 -12.600 -9.826 279 HB3 PRO 39 HB3 PRO 39 -7.815 -12.259 -8.971 280 HG2 PRO 39 HG2 PRO 39 -9.620 -14.635 -8.756 281 HG3 PRO 39 HG3 PRO 39 -7.849 -14.581 -8.829 282 HD2 PRO 39 HD2 PRO 39 -9.218 -14.896 -6.501 283 HD3 PRO 39 HD3 PRO 39 -7.649 -14.071 -6.592 284 H TYR 40 H TYR 40 -11.447 -13.586 -7.175 285 HA TYR 40 HA TYR 40 -13.336 -12.605 -9.112 286 HB2 TYR 40 HB2 TYR 40 -13.592 -14.752 -6.999 287 HB3 TYR 40 HB3 TYR 40 -14.804 -14.407 -8.231 288 HD1 TYR 40 HD1 TYR 40 -14.273 -14.813 -10.628 289 HD2 TYR 40 HD2 TYR 40 -11.637 -16.015 -7.514 290 HE1 TYR 40 HE1 TYR 40 -13.100 -16.299 -12.201 291 HE2 TYR 40 HE2 TYR 40 -10.456 -17.496 -9.073 292 HH TYR 40 HH TYR 40 -10.893 -18.673 -11.190 293 H GLN 41 H GLN 41 -12.675 -12.129 -5.770 294 HA GLN 41 HA GLN 41 -15.200 -11.002 -5.074 295 HB2 GLN 41 HB2 GLN 41 -12.504 -11.117 -3.795 296 HB3 GLN 41 HB3 GLN 41 -13.674 -9.950 -3.196 297 HG2 GLN 41 HG2 GLN 41 -13.722 -12.017 -1.907 298 HG3 GLN 41 HG3 GLN 41 -15.253 -11.731 -2.728 299 HE21 GLN 41 HE21 GLN 41 -15.856 -13.877 -2.641 300 HE22 GLN 41 HE22 GLN 41 -15.106 -15.097 -3.618 301 H GLU 42 H GLU 42 -12.381 -9.868 -6.691 302 HA GLU 42 HA GLU 42 -12.866 -7.086 -6.482 303 HB2 GLU 42 HB2 GLU 42 -11.533 -8.664 -8.695 304 HB3 GLU 42 HB3 GLU 42 -11.481 -6.914 -8.535 305 HG2 GLU 42 HG2 GLU 42 -10.350 -8.910 -6.589 306 HG3 GLU 42 HG3 GLU 42 -9.432 -7.932 -7.733 307 H GLN 43 H GLN 43 -14.128 -9.644 -8.465 308 HA GLN 43 HA GLN 43 -15.592 -7.888 -10.237 309 HB2 GLN 43 HB2 GLN 43 -15.880 -10.876 -9.871 310 HB3 GLN 43 HB3 GLN 43 -16.392 -9.923 -11.255 311 HG2 GLN 43 HG2 GLN 43 -14.132 -9.504 -11.892 312 HG3 GLN 43 HG3 GLN 43 -13.529 -10.221 -10.399 313 HE21 GLN 43 HE21 GLN 43 -16.179 -11.594 -12.195 314 HE22 GLN 43 HE22 GLN 43 -15.333 -13.009 -12.739 315 H LEU 44 H LEU 44 -16.236 -10.097 -7.576 316 HA LEU 44 HA LEU 44 -19.036 -9.281 -7.450 317 HB2 LEU 44 HB2 LEU 44 -17.535 -11.315 -5.791 318 HB3 LEU 44 HB3 LEU 44 -19.275 -11.087 -5.839 319 HG LEU 44 HG LEU 44 -17.617 -11.979 -8.201 320 HD11 LEU 44 HD11 LEU 44 -19.320 -13.602 -6.320 321 HD12 LEU 44 HD12 LEU 44 -17.560 -13.643 -6.423 322 HD13 LEU 44 HD13 LEU 44 -18.537 -14.198 -7.784 323 HD21 LEU 44 HD21 LEU 44 -19.790 -12.574 -9.162 324 HD22 LEU 44 HD22 LEU 44 -19.686 -10.849 -8.816 325 HD23 LEU 44 HD23 LEU 44 -20.599 -11.909 -7.742 326 H SER 45 H SER 45 -18.521 -7.105 -6.792 327 HA SER 45 HA SER 45 -17.088 -6.804 -4.290 328 HB2 SER 45 HB2 SER 45 -17.372 -4.322 -4.854 329 HB3 SER 45 HB3 SER 45 -16.348 -5.286 -5.920 330 HG SER 45 HG SER 45 -19.100 -4.886 -6.441 331 H ASP 46 H ASP 46 -18.910 -7.864 -3.105 332 HA ASP 46 HA ASP 46 -21.079 -6.073 -2.415 333 HB2 ASP 46 HB2 ASP 46 -21.604 -7.683 -0.652 334 HB3 ASP 46 HB3 ASP 46 -21.343 -8.532 -2.171 335 H THR 47 H THR 47 -17.850 -6.220 -1.933 336 HA THR 47 HA THR 47 -17.865 -4.753 0.598 337 HB THR 47 HB THR 47 -15.305 -4.942 0.193 338 HG1 THR 47 HG1 THR 47 -15.858 -7.277 -1.238 339 HG21 THR 47 HG21 THR 47 -16.496 -6.167 1.946 340 HG22 THR 47 HG22 THR 47 -15.248 -7.172 1.210 341 HG23 THR 47 HG23 THR 47 -16.941 -7.410 0.777 342 HA PRO 48 HA PRO 48 -17.417 -0.998 -1.763 343 HB2 PRO 48 HB2 PRO 48 -16.691 0.651 0.257 344 HB3 PRO 48 HB3 PRO 48 -18.347 0.071 0.053 345 HG2 PRO 48 HG2 PRO 48 -16.210 -0.905 1.903 346 HG3 PRO 48 HG3 PRO 48 -17.938 -0.657 2.217 347 HD2 PRO 48 HD2 PRO 48 -16.850 -3.103 1.707 348 HD3 PRO 48 HD3 PRO 48 -18.522 -2.677 1.290 349 H LEU 49 H LEU 49 -15.782 0.228 -2.673 350 HA LEU 49 HA LEU 49 -13.061 -0.688 -2.143 351 HB2 LEU 49 HB2 LEU 49 -14.275 0.992 -4.320 352 HB3 LEU 49 HB3 LEU 49 -12.545 0.893 -4.095 353 HG LEU 49 HG LEU 49 -14.355 -1.433 -4.738 354 HD11 LEU 49 HD11 LEU 49 -14.091 0.144 -6.592 355 HD12 LEU 49 HD12 LEU 49 -13.236 -1.365 -6.913 356 HD13 LEU 49 HD13 LEU 49 -12.337 0.068 -6.408 357 HD21 LEU 49 HD21 LEU 49 -11.347 -1.264 -4.559 358 HD22 LEU 49 HD22 LEU 49 -12.292 -2.682 -5.018 359 HD23 LEU 49 HD23 LEU 49 -12.397 -2.046 -3.377 360 H ILE 50 H ILE 50 -11.815 0.375 -0.790 361 HA ILE 50 HA ILE 50 -12.246 3.244 -0.415 362 HB ILE 50 HB ILE 50 -10.265 1.436 0.988 363 HG12 ILE 50 HG12 ILE 50 -12.850 2.566 2.068 364 HG13 ILE 50 HG13 ILE 50 -12.700 0.942 1.414 365 HG21 ILE 50 HG21 ILE 50 -10.082 3.320 2.578 366 HG22 ILE 50 HG22 ILE 50 -11.128 4.278 1.527 367 HG23 ILE 50 HG23 ILE 50 -9.548 3.749 0.952 368 HD11 ILE 50 HD11 ILE 50 -12.594 0.936 3.844 369 HD12 ILE 50 HD12 ILE 50 -11.209 2.026 3.796 370 HD13 ILE 50 HD13 ILE 50 -11.069 0.391 3.148 371 HA PRO 51 HA PRO 51 -8.902 3.809 -3.318 372 HB2 PRO 51 HB2 PRO 51 -9.011 6.490 -3.415 373 HB3 PRO 51 HB3 PRO 51 -10.232 5.485 -4.203 374 HG2 PRO 51 HG2 PRO 51 -10.368 6.928 -1.591 375 HG3 PRO 51 HG3 PRO 51 -11.600 6.779 -2.850 376 HD2 PRO 51 HD2 PRO 51 -11.563 5.245 -0.571 377 HD3 PRO 51 HD3 PRO 51 -12.303 4.736 -2.103 378 H LEU 52 H LEU 52 -6.789 4.024 -2.959 379 HA LEU 52 HA LEU 52 -5.897 5.472 -0.562 380 HB2 LEU 52 HB2 LEU 52 -5.033 2.732 -1.482 381 HB3 LEU 52 HB3 LEU 52 -4.132 3.677 -0.307 382 HG LEU 52 HG LEU 52 -6.545 3.687 0.882 383 HD11 LEU 52 HD11 LEU 52 -6.427 1.059 -0.579 384 HD12 LEU 52 HD12 LEU 52 -7.601 2.347 -0.852 385 HD13 LEU 52 HD13 LEU 52 -7.572 1.495 0.692 386 HD21 LEU 52 HD21 LEU 52 -5.735 1.852 2.273 387 HD22 LEU 52 HD22 LEU 52 -4.460 3.019 1.919 388 HD23 LEU 52 HD23 LEU 52 -4.508 1.478 1.062 389 H THR 53 H THR 53 -4.212 6.764 -0.851 390 HA THR 53 HA THR 53 -2.923 6.734 -3.504 391 HB THR 53 HB THR 53 -2.966 9.074 -1.599 392 HG1 THR 53 HG1 THR 53 -5.109 8.012 -2.649 393 HG21 THR 53 HG21 THR 53 -2.691 8.862 -4.602 394 HG22 THR 53 HG22 THR 53 -1.379 9.163 -3.460 395 HG23 THR 53 HG23 THR 53 -2.661 10.359 -3.669 396 H ILE 54 H ILE 54 -0.908 5.990 -3.464 397 HA ILE 54 HA ILE 54 0.506 6.011 -0.888 398 HB ILE 54 HB ILE 54 0.957 4.194 -3.261 399 HG12 ILE 54 HG12 ILE 54 -0.376 3.731 -0.587 400 HG13 ILE 54 HG13 ILE 54 -1.132 3.649 -2.173 401 HG21 ILE 54 HG21 ILE 54 3.003 4.630 -1.997 402 HG22 ILE 54 HG22 ILE 54 2.460 2.965 -1.785 403 HG23 ILE 54 HG23 ILE 54 2.187 4.151 -0.507 404 HD11 ILE 54 HD11 ILE 54 1.018 1.795 -1.184 405 HD12 ILE 54 HD12 ILE 54 0.156 1.683 -2.718 406 HD13 ILE 54 HD13 ILE 54 -0.711 1.438 -1.201 407 H PHE 55 H PHE 55 2.116 7.319 -0.686 408 HA PHE 55 HA PHE 55 3.426 8.406 -3.090 409 HB2 PHE 55 HB2 PHE 55 3.264 9.492 -0.269 410 HB3 PHE 55 HB3 PHE 55 4.222 10.211 -1.552 411 HD1 PHE 55 HD1 PHE 55 0.740 9.280 -0.689 412 HD2 PHE 55 HD2 PHE 55 3.315 11.826 -2.916 413 HE1 PHE 55 HE1 PHE 55 -1.197 10.642 -1.366 414 HE2 PHE 55 HE2 PHE 55 1.388 13.198 -3.592 415 HZ PHE 55 HZ PHE 55 -0.873 12.605 -2.819 416 H VAL 56 H VAL 56 5.577 8.098 -3.385 417 HA VAL 56 HA VAL 56 6.945 6.376 -1.503 418 HB VAL 56 HB VAL 56 7.505 7.280 -4.276 419 HG11 VAL 56 HG11 VAL 56 9.839 6.745 -4.186 420 HG12 VAL 56 HG12 VAL 56 9.715 6.210 -2.513 421 HG13 VAL 56 HG13 VAL 56 9.543 7.919 -2.907 422 HG21 VAL 56 HG21 VAL 56 6.452 5.139 -3.737 423 HG22 VAL 56 HG22 VAL 56 7.858 4.703 -2.765 424 HG23 VAL 56 HG23 VAL 56 8.020 4.908 -4.511 425 H GLY 57 H GLY 57 8.470 6.918 -0.129 426 HA2 GLY 57 HA2 GLY 57 9.084 9.769 0.101 427 HA3 GLY 57 HA3 GLY 57 9.210 8.582 1.384 428 H GLU 58 H GLU 58 11.233 10.443 0.590 429 HA GLU 58 HA GLU 58 13.233 8.820 -0.760 430 HB2 GLU 58 HB2 GLU 58 13.441 11.573 0.469 431 HB3 GLU 58 HB3 GLU 58 14.683 10.786 -0.493 432 HG2 GLU 58 HG2 GLU 58 13.171 10.773 -2.418 433 HG3 GLU 58 HG3 GLU 58 11.945 11.591 -1.444 434 H ASN 59 H ASN 59 14.309 7.340 0.371 435 HA ASN 59 HA ASN 59 14.639 7.617 3.238 436 HB2 ASN 59 HB2 ASN 59 14.172 5.398 2.118 437 HB3 ASN 59 HB3 ASN 59 15.794 5.468 1.441 438 HD21 ASN 59 HD21 ASN 59 13.930 5.187 4.384 439 HD22 ASN 59 HD22 ASN 59 15.206 4.550 5.358 440 H THR 60 H THR 60 15.763 9.699 2.719 441 HA THR 60 HA THR 60 18.424 9.613 1.671 442 HB THR 60 HB THR 60 17.340 11.835 3.388 443 HG1 THR 60 HG1 THR 60 16.861 11.911 0.628 444 HG21 THR 60 HG21 THR 60 19.654 12.010 2.608 445 HG22 THR 60 HG22 THR 60 18.637 13.230 1.840 446 HG23 THR 60 HG23 THR 60 19.116 11.789 0.943 447 H GLY 61 H GLY 61 16.941 9.543 4.842 448 HA2 GLY 61 HA2 GLY 61 19.599 9.014 6.001 449 HA3 GLY 61 HA3 GLY 61 18.384 9.968 6.845 450 H VAL 62 H VAL 62 19.631 7.588 7.808 451 HA VAL 62 HA VAL 62 17.617 5.519 7.577 452 HB VAL 62 HB VAL 62 19.106 4.258 9.184 453 HG11 VAL 62 HG11 VAL 62 20.302 5.222 6.588 454 HG12 VAL 62 HG12 VAL 62 19.192 3.866 6.796 455 HG13 VAL 62 HG13 VAL 62 20.815 3.788 7.477 456 HG21 VAL 62 HG21 VAL 62 20.935 6.610 8.690 457 HG22 VAL 62 HG22 VAL 62 21.420 5.087 9.435 458 HG23 VAL 62 HG23 VAL 62 20.241 6.124 10.239 459 H1 GLY 1 H1 GLY 1 -11.510 15.802 4.068 460 H2 GLY 1 H2 GLY 1 -12.303 15.066 2.755 461 H3 GLY 1 H3 GLY 1 -13.025 16.371 3.564 462 HA2 GLY 1 HA2 GLY 1 -12.144 17.165 1.514 463 HA3 GLY 1 HA3 GLY 1 -11.209 17.825 2.848 464 H ALA 2 H ALA 2 -9.168 18.002 2.146 465 HA ALA 2 HA ALA 2 -7.924 15.609 0.983 466 HB1 ALA 2 HB1 ALA 2 -8.583 17.088 -0.865 467 HB2 ALA 2 HB2 ALA 2 -6.834 16.908 -0.744 468 HB3 ALA 2 HB3 ALA 2 -7.612 18.381 -0.162 469 H MET 3 H MET 3 -7.850 17.225 3.596 470 HA MET 3 HA MET 3 -4.909 17.331 3.711 471 HB2 MET 3 HB2 MET 3 -5.003 19.287 5.192 472 HB3 MET 3 HB3 MET 3 -5.686 19.640 3.612 473 HG2 MET 3 HG2 MET 3 -7.931 19.423 4.514 474 HG3 MET 3 HG3 MET 3 -7.267 19.011 6.093 475 HE1 MET 3 HE1 MET 3 -5.535 22.350 7.158 476 HE2 MET 3 HE2 MET 3 -4.783 21.003 6.306 477 HE3 MET 3 HE3 MET 3 -5.919 20.692 7.617 478 H GLU 4 H GLU 4 -7.945 16.746 5.294 479 HA GLU 4 HA GLU 4 -6.611 15.764 7.703 480 HB2 GLU 4 HB2 GLU 4 -9.390 15.399 7.957 481 HB3 GLU 4 HB3 GLU 4 -8.402 16.626 8.731 482 HG2 GLU 4 HG2 GLU 4 -10.271 17.670 7.652 483 HG3 GLU 4 HG3 GLU 4 -8.790 18.120 6.812 484 H MET 5 H MET 5 -6.976 14.568 4.892 485 HA MET 5 HA MET 5 -8.300 12.092 5.234 486 HB2 MET 5 HB2 MET 5 -6.925 11.440 3.207 487 HB3 MET 5 HB3 MET 5 -7.938 12.864 3.010 488 HG2 MET 5 HG2 MET 5 -5.931 14.254 3.518 489 HG3 MET 5 HG3 MET 5 -4.969 12.786 3.457 490 HE1 MET 5 HE1 MET 5 -6.774 11.324 1.078 491 HE2 MET 5 HE2 MET 5 -5.019 11.178 1.196 492 HE3 MET 5 HE3 MET 5 -5.760 11.694 -0.318 493 HA PRO 6 HA PRO 6 -5.609 10.186 8.110 494 HB2 PRO 6 HB2 PRO 6 -6.289 7.577 7.480 495 HB3 PRO 6 HB3 PRO 6 -7.192 8.632 8.568 496 HG2 PRO 6 HG2 PRO 6 -7.693 7.999 5.698 497 HG3 PRO 6 HG3 PRO 6 -8.855 8.200 7.024 498 HD2 PRO 6 HD2 PRO 6 -8.450 10.133 5.207 499 HD3 PRO 6 HD3 PRO 6 -8.764 10.515 6.913 500 H THR 7 H THR 7 -3.554 9.610 8.100 501 HA THR 7 HA THR 7 -2.380 8.719 5.547 502 HB THR 7 HB THR 7 -1.006 10.334 7.690 503 HG1 THR 7 HG1 THR 7 -2.931 11.144 6.063 504 HG21 THR 7 HG21 THR 7 0.587 10.856 5.913 505 HG22 THR 7 HG22 THR 7 -0.335 9.861 4.786 506 HG23 THR 7 HG23 THR 7 0.473 9.114 6.165 507 H PHE 8 H PHE 8 -1.073 6.985 5.546 508 HA PHE 8 HA PHE 8 -0.230 5.832 8.130 509 HB2 PHE 8 HB2 PHE 8 -0.861 4.376 5.548 510 HB3 PHE 8 HB3 PHE 8 -0.287 3.628 7.027 511 HD1 PHE 8 HD1 PHE 8 -3.114 5.466 5.514 512 HD2 PHE 8 HD2 PHE 8 -1.798 3.025 8.744 513 HE1 PHE 8 HE1 PHE 8 -5.447 5.162 6.229 514 HE2 PHE 8 HE2 PHE 8 -4.136 2.717 9.465 515 HZ PHE 8 HZ PHE 8 -5.960 3.788 8.206 516 H TYR 9 H TYR 9 1.930 5.081 8.251 517 HA TYR 9 HA TYR 9 3.579 5.610 5.863 518 HB2 TYR 9 HB2 TYR 9 3.696 7.334 7.810 519 HB3 TYR 9 HB3 TYR 9 4.608 6.086 8.647 520 HD1 TYR 9 HD1 TYR 9 6.849 5.437 7.843 521 HD2 TYR 9 HD2 TYR 9 4.628 8.540 5.963 522 HE1 TYR 9 HE1 TYR 9 8.895 6.218 6.716 523 HE2 TYR 9 HE2 TYR 9 6.663 9.325 4.837 524 HH TYR 9 HH TYR 9 9.055 9.226 5.070 525 H LEU 10 H LEU 10 4.681 3.880 5.238 526 HA LEU 10 HA LEU 10 5.649 2.001 7.247 527 HB2 LEU 10 HB2 LEU 10 4.932 0.112 5.641 528 HB3 LEU 10 HB3 LEU 10 3.744 0.811 6.723 529 HG LEU 10 HG LEU 10 3.088 2.293 4.717 530 HD11 LEU 10 HD11 LEU 10 4.498 0.077 3.249 531 HD12 LEU 10 HD12 LEU 10 5.016 1.763 3.313 532 HD13 LEU 10 HD13 LEU 10 3.493 1.336 2.530 533 HD21 LEU 10 HD21 LEU 10 1.574 0.568 3.886 534 HD22 LEU 10 HD22 LEU 10 1.680 0.553 5.647 535 HD23 LEU 10 HD23 LEU 10 2.535 -0.666 4.702 536 H ALA 11 H ALA 11 7.341 0.563 6.436 537 HA ALA 11 HA ALA 11 8.678 1.626 4.034 538 HB1 ALA 11 HB1 ALA 11 10.012 0.732 6.583 539 HB2 ALA 11 HB2 ALA 11 9.851 2.397 6.020 540 HB3 ALA 11 HB3 ALA 11 10.832 1.249 5.109 541 H LEU 12 H LEU 12 9.232 0.180 2.563 542 HA LEU 12 HA LEU 12 8.855 -2.660 3.271 543 HB2 LEU 12 HB2 LEU 12 8.146 -1.350 0.648 544 HB3 LEU 12 HB3 LEU 12 7.827 -3.007 1.115 545 HG LEU 12 HG LEU 12 6.561 -0.574 2.374 546 HD11 LEU 12 HD11 LEU 12 5.800 -0.894 0.093 547 HD12 LEU 12 HD12 LEU 12 4.526 -1.333 1.232 548 HD13 LEU 12 HD13 LEU 12 5.459 -2.592 0.423 549 HD21 LEU 12 HD21 LEU 12 5.085 -2.184 3.468 550 HD22 LEU 12 HD22 LEU 12 6.766 -2.441 3.934 551 HD23 LEU 12 HD23 LEU 12 6.002 -3.515 2.761 552 H HIS 13 H HIS 13 10.294 -4.112 2.444 553 HA HIS 13 HA HIS 13 12.787 -3.124 1.459 554 HB2 HIS 13 HB2 HIS 13 11.680 -5.901 1.846 555 HB3 HIS 13 HB3 HIS 13 13.271 -5.620 1.149 556 HD1 HIS 13 HD1 HIS 13 11.670 -6.210 4.311 557 HD2 HIS 13 HD2 HIS 13 14.947 -3.989 3.017 558 HE1 HIS 13 HE1 HIS 13 13.040 -5.751 6.363 559 HE2 HIS 13 HE2 HIS 13 14.888 -4.239 5.591 560 H GLY 14 H GLY 14 13.466 -2.867 -0.562 561 HA2 GLY 14 HA2 GLY 14 11.686 -2.892 -2.727 562 HA3 GLY 14 HA3 GLY 14 13.432 -2.743 -2.848 563 H GLY 15 H GLY 15 10.812 -4.582 -3.687 564 HA2 GLY 15 HA2 GLY 15 10.996 -6.353 -5.244 565 HA3 GLY 15 HA3 GLY 15 12.594 -6.707 -4.619 566 H GLN 16 H GLN 16 10.374 -6.220 -2.130 567 HA GLN 16 HA GLN 16 10.155 -9.136 -1.806 568 HB2 GLN 16 HB2 GLN 16 10.049 -6.991 0.312 569 HB3 GLN 16 HB3 GLN 16 9.961 -8.721 0.598 570 HG2 GLN 16 HG2 GLN 16 12.326 -7.275 -0.582 571 HG3 GLN 16 HG3 GLN 16 12.167 -7.743 1.105 572 HE21 GLN 16 HE21 GLN 16 11.211 -9.694 -1.677 573 HE22 GLN 16 HE22 GLN 16 12.391 -10.937 -1.438 574 H THR 17 H THR 17 8.227 -10.022 -0.990 575 HA THR 17 HA THR 17 5.862 -8.585 -1.919 576 HB THR 17 HB THR 17 6.004 -11.437 -0.907 577 HG1 THR 17 HG1 THR 17 7.088 -10.339 -3.159 578 HG21 THR 17 HG21 THR 17 4.048 -11.729 -2.377 579 HG22 THR 17 HG22 THR 17 4.113 -10.015 -2.791 580 HG23 THR 17 HG23 THR 17 3.762 -10.510 -1.134 581 H TYR 18 H TYR 18 4.253 -7.929 -0.652 582 HA TYR 18 HA TYR 18 4.290 -8.630 2.200 583 HB2 TYR 18 HB2 TYR 18 3.889 -5.911 0.950 584 HB3 TYR 18 HB3 TYR 18 3.434 -6.280 2.609 585 HD1 TYR 18 HD1 TYR 18 6.239 -5.751 0.305 586 HD2 TYR 18 HD2 TYR 18 5.113 -6.631 4.310 587 HE1 TYR 18 HE1 TYR 18 8.527 -5.250 1.052 588 HE2 TYR 18 HE2 TYR 18 7.389 -6.141 5.074 589 HH TYR 18 HH TYR 18 9.654 -6.035 4.198 590 H HIS 19 H HIS 19 2.304 -8.705 3.217 591 HA HIS 19 HA HIS 19 -0.011 -8.977 1.456 592 HB2 HIS 19 HB2 HIS 19 0.759 -9.976 4.135 593 HB3 HIS 19 HB3 HIS 19 -0.941 -9.595 3.925 594 HD1 HIS 19 HD1 HIS 19 0.813 -12.456 4.075 595 HD2 HIS 19 HD2 HIS 19 -1.452 -10.842 0.973 596 HE1 HIS 19 HE1 HIS 19 0.174 -14.401 2.612 597 HE2 HIS 19 HE2 HIS 19 -1.352 -13.429 0.856 598 H LEU 20 H LEU 20 -1.268 -7.312 1.183 599 HA LEU 20 HA LEU 20 -1.299 -5.177 3.196 600 HB2 LEU 20 HB2 LEU 20 -0.482 -4.231 1.221 601 HB3 LEU 20 HB3 LEU 20 -1.522 -5.212 0.207 602 HG LEU 20 HG LEU 20 -3.445 -3.848 0.807 603 HD11 LEU 20 HD11 LEU 20 -3.135 -1.800 2.142 604 HD12 LEU 20 HD12 LEU 20 -1.495 -2.327 2.527 605 HD13 LEU 20 HD13 LEU 20 -2.880 -3.277 3.072 606 HD21 LEU 20 HD21 LEU 20 -2.085 -3.168 -1.093 607 HD22 LEU 20 HD22 LEU 20 -1.061 -2.203 -0.030 608 HD23 LEU 20 HD23 LEU 20 -2.753 -1.760 -0.265 609 H ILE 21 H ILE 21 -3.060 -5.084 4.378 610 HA ILE 21 HA ILE 21 -5.631 -5.804 3.128 611 HB ILE 21 HB ILE 21 -4.879 -6.303 6.016 612 HG12 ILE 21 HG12 ILE 21 -5.437 -8.530 4.120 613 HG13 ILE 21 HG13 ILE 21 -3.876 -7.728 3.983 614 HG21 ILE 21 HG21 ILE 21 -6.987 -7.573 6.078 615 HG22 ILE 21 HG22 ILE 21 -7.316 -7.099 4.413 616 HG23 ILE 21 HG23 ILE 21 -7.259 -5.877 5.683 617 HD11 ILE 21 HD11 ILE 21 -4.971 -8.959 6.497 618 HD12 ILE 21 HD12 ILE 21 -3.371 -8.246 6.278 619 HD13 ILE 21 HD13 ILE 21 -3.810 -9.716 5.407 620 H VAL 22 H VAL 22 -7.018 -4.168 3.130 621 HA VAL 22 HA VAL 22 -6.733 -2.107 5.206 622 HB VAL 22 HB VAL 22 -6.444 -1.218 2.924 623 HG11 VAL 22 HG11 VAL 22 -7.836 -2.768 1.685 624 HG12 VAL 22 HG12 VAL 22 -8.363 -1.110 1.389 625 HG13 VAL 22 HG13 VAL 22 -9.276 -2.144 2.489 626 HG21 VAL 22 HG21 VAL 22 -8.970 -0.302 4.285 627 HG22 VAL 22 HG22 VAL 22 -8.053 0.623 3.096 628 HG23 VAL 22 HG23 VAL 22 -7.329 0.232 4.656 629 H ASP 23 H ASP 23 -8.406 -1.706 6.503 630 HA ASP 23 HA ASP 23 -11.029 -2.846 5.955 631 HB2 ASP 23 HB2 ASP 23 -9.792 -4.649 7.113 632 HB3 ASP 23 HB3 ASP 23 -9.395 -3.540 8.418 633 H THR 24 H THR 24 -12.544 -2.120 7.891 634 HA THR 24 HA THR 24 -11.654 0.594 8.600 635 HB THR 24 HB THR 24 -14.241 1.014 8.702 636 HG1 THR 24 HG1 THR 24 -14.054 -1.172 6.874 637 HG21 THR 24 HG21 THR 24 -12.767 0.788 6.075 638 HG22 THR 24 HG22 THR 24 -12.705 2.158 7.186 639 HG23 THR 24 HG23 THR 24 -14.215 1.752 6.372 640 H ASP 25 H ASP 25 -11.977 1.368 10.573 641 HA ASP 25 HA ASP 25 -12.524 -0.446 12.729 642 HB2 ASP 25 HB2 ASP 25 -10.829 1.299 12.957 643 HB3 ASP 25 HB3 ASP 25 -12.031 2.543 12.643 644 H SER 26 H SER 26 -14.174 0.150 14.430 645 HA SER 26 HA SER 26 -16.746 0.215 13.394 646 HB2 SER 26 HB2 SER 26 -15.879 1.060 16.166 647 HB3 SER 26 HB3 SER 26 -17.480 0.489 15.696 648 HG SER 26 HG SER 26 -16.692 -1.533 15.402 649 H LEU 27 H LEU 27 -14.640 2.861 14.342 650 HA LEU 27 HA LEU 27 -16.643 4.892 14.377 651 HB2 LEU 27 HB2 LEU 27 -13.670 5.127 13.925 652 HB3 LEU 27 HB3 LEU 27 -14.751 6.455 14.303 653 HG LEU 27 HG LEU 27 -14.149 4.124 16.128 654 HD11 LEU 27 HD11 LEU 27 -13.221 6.991 16.209 655 HD12 LEU 27 HD12 LEU 27 -12.229 5.578 15.849 656 HD13 LEU 27 HD13 LEU 27 -12.928 5.778 17.456 657 HD21 LEU 27 HD21 LEU 27 -15.735 6.649 16.599 658 HD22 LEU 27 HD22 LEU 27 -15.337 5.436 17.817 659 HD23 LEU 27 HD23 LEU 27 -16.390 5.017 16.468 660 H GLY 28 H GLY 28 -15.088 3.206 11.862 661 HA2 GLY 28 HA2 GLY 28 -15.821 3.396 9.597 662 HA3 GLY 28 HA3 GLY 28 -16.203 5.087 9.894 663 H ASN 29 H ASN 29 -13.313 4.523 11.342 664 HA ASN 29 HA ASN 29 -11.868 5.823 9.196 665 HB2 ASN 29 HB2 ASN 29 -10.912 4.973 11.934 666 HB3 ASN 29 HB3 ASN 29 -9.996 5.935 10.790 667 HD21 ASN 29 HD21 ASN 29 -10.874 6.534 13.511 668 HD22 ASN 29 HD22 ASN 29 -11.795 7.999 13.393 669 HA PRO 30 HA PRO 30 -10.313 2.058 7.519 670 HB2 PRO 30 HB2 PRO 30 -8.229 3.691 6.287 671 HB3 PRO 30 HB3 PRO 30 -9.549 2.805 5.523 672 HG2 PRO 30 HG2 PRO 30 -9.452 5.512 5.651 673 HG3 PRO 30 HG3 PRO 30 -10.963 4.594 5.581 674 HD2 PRO 30 HD2 PRO 30 -9.640 5.913 7.910 675 HD3 PRO 30 HD3 PRO 30 -11.364 5.739 7.527 676 H SER 31 H SER 31 -8.663 0.739 7.644 677 HA SER 31 HA SER 31 -6.584 1.354 9.590 678 HB2 SER 31 HB2 SER 31 -8.600 -0.884 9.480 679 HB3 SER 31 HB3 SER 31 -7.194 -0.921 10.487 680 HG SER 31 HG SER 31 -8.810 1.324 10.654 681 H LEU 32 H LEU 32 -4.633 0.250 9.168 682 HA LEU 32 HA LEU 32 -4.609 -1.228 6.621 683 HB2 LEU 32 HB2 LEU 32 -3.782 1.202 6.587 684 HB3 LEU 32 HB3 LEU 32 -2.400 0.616 7.494 685 HG LEU 32 HG LEU 32 -1.998 -1.018 5.607 686 HD11 LEU 32 HD11 LEU 32 -4.225 -0.932 4.623 687 HD12 LEU 32 HD12 LEU 32 -2.994 -0.475 3.447 688 HD13 LEU 32 HD13 LEU 32 -3.987 0.767 4.210 689 HD21 LEU 32 HD21 LEU 32 -0.656 0.988 5.904 690 HD22 LEU 32 HD22 LEU 32 -1.843 1.932 5.002 691 HD23 LEU 32 HD23 LEU 32 -0.925 0.663 4.193 692 H SER 33 H SER 33 -3.503 -3.086 6.600 693 HA SER 33 HA SER 33 -1.470 -3.543 8.669 694 HB2 SER 33 HB2 SER 33 -3.583 -5.549 7.834 695 HB3 SER 33 HB3 SER 33 -2.282 -5.836 8.992 696 HG SER 33 HG SER 33 -3.605 -3.618 9.691 697 H VAL 34 H VAL 34 0.406 -4.113 7.805 698 HA VAL 34 HA VAL 34 0.393 -5.480 5.195 699 HB VAL 34 HB VAL 34 2.248 -3.259 6.075 700 HG11 VAL 34 HG11 VAL 34 3.399 -3.555 3.943 701 HG12 VAL 34 HG12 VAL 34 2.381 -4.950 3.579 702 HG13 VAL 34 HG13 VAL 34 3.514 -5.012 4.929 703 HG21 VAL 34 HG21 VAL 34 1.385 -2.080 4.132 704 HG22 VAL 34 HG22 VAL 34 0.061 -2.548 5.199 705 HG23 VAL 34 HG23 VAL 34 0.369 -3.464 3.723 706 H ILE 35 H ILE 35 1.379 -7.370 5.238 707 HA ILE 35 HA ILE 35 3.337 -7.895 7.388 708 HB ILE 35 HB ILE 35 1.826 -10.158 6.183 709 HG12 ILE 35 HG12 ILE 35 0.675 -8.328 8.300 710 HG13 ILE 35 HG13 ILE 35 0.047 -8.531 6.674 711 HG21 ILE 35 HG21 ILE 35 2.788 -9.542 8.970 712 HG22 ILE 35 HG22 ILE 35 3.661 -10.490 7.767 713 HG23 ILE 35 HG23 ILE 35 2.128 -11.082 8.416 714 HD11 ILE 35 HD11 ILE 35 -1.280 -9.756 8.289 715 HD12 ILE 35 HD12 ILE 35 0.148 -10.655 8.803 716 HD13 ILE 35 HD13 ILE 35 -0.481 -10.859 7.168 717 HA PRO 36 HA PRO 36 6.083 -8.877 3.973 718 HB2 PRO 36 HB2 PRO 36 7.999 -10.121 5.475 719 HB3 PRO 36 HB3 PRO 36 7.855 -8.366 5.333 720 HG2 PRO 36 HG2 PRO 36 6.901 -10.175 7.518 721 HG3 PRO 36 HG3 PRO 36 7.685 -8.588 7.638 722 HD2 PRO 36 HD2 PRO 36 5.022 -8.898 7.929 723 HD3 PRO 36 HD3 PRO 36 5.728 -7.446 7.188 724 H SER 37 H SER 37 6.069 -10.577 2.621 725 HA SER 37 HA SER 37 4.891 -13.056 3.310 726 HB2 SER 37 HB2 SER 37 6.568 -12.279 0.917 727 HB3 SER 37 HB3 SER 37 5.668 -13.790 1.063 728 HG SER 37 HG SER 37 3.877 -12.095 1.599 729 H ASN 38 H ASN 38 8.108 -11.820 3.446 730 HA ASN 38 HA ASN 38 8.936 -14.322 4.734 731 HB2 ASN 38 HB2 ASN 38 10.450 -12.710 2.702 732 HB3 ASN 38 HB3 ASN 38 11.306 -13.690 3.882 733 HD21 ASN 38 HD21 ASN 38 11.187 -13.931 0.983 734 HD22 ASN 38 HD22 ASN 38 10.583 -15.518 0.653 735 HA PRO 39 HA PRO 39 9.247 -11.049 7.795 736 HB2 PRO 39 HB2 PRO 39 9.367 -12.687 9.945 737 HB3 PRO 39 HB3 PRO 39 7.861 -12.341 9.090 738 HG2 PRO 39 HG2 PRO 39 9.660 -14.724 8.866 739 HG3 PRO 39 HG3 PRO 39 7.889 -14.662 8.943 740 HD2 PRO 39 HD2 PRO 39 9.250 -14.970 6.610 741 HD3 PRO 39 HD3 PRO 39 7.685 -14.138 6.713 742 H TYR 40 H TYR 40 11.478 -13.675 7.288 743 HA TYR 40 HA TYR 40 13.384 -12.716 9.216 744 HB2 TYR 40 HB2 TYR 40 13.627 -14.853 7.091 745 HB3 TYR 40 HB3 TYR 40 14.838 -14.517 8.327 746 HD1 TYR 40 HD1 TYR 40 14.312 -14.937 10.720 747 HD2 TYR 40 HD2 TYR 40 11.662 -16.113 7.607 748 HE1 TYR 40 HE1 TYR 40 13.136 -16.419 12.289 749 HE2 TYR 40 HE2 TYR 40 10.475 -17.594 9.172 750 HH TYR 40 HH TYR 40 10.888 -18.768 11.265 751 H GLN 41 H GLN 41 12.714 -12.221 5.881 752 HA GLN 41 HA GLN 41 15.242 -11.101 5.184 753 HB2 GLN 41 HB2 GLN 41 12.537 -11.197 3.914 754 HB3 GLN 41 HB3 GLN 41 13.714 -10.037 3.312 755 HG2 GLN 41 HG2 GLN 41 13.749 -12.094 2.015 756 HG3 GLN 41 HG3 GLN 41 15.281 -11.825 2.839 757 HE21 GLN 41 HE21 GLN 41 15.866 -13.971 2.750 758 HE22 GLN 41 HE22 GLN 41 15.106 -15.190 3.720 759 H GLU 42 H GLU 42 12.433 -9.965 6.816 760 HA GLU 42 HA GLU 42 12.928 -7.182 6.620 761 HB2 GLU 42 HB2 GLU 42 11.592 -8.766 8.831 762 HB3 GLU 42 HB3 GLU 42 11.547 -7.015 8.679 763 HG2 GLU 42 HG2 GLU 42 10.405 -8.994 6.722 764 HG3 GLU 42 HG3 GLU 42 9.492 -8.021 7.876 765 H GLN 43 H GLN 43 14.182 -9.754 8.588 766 HA GLN 43 HA GLN 43 15.667 -8.019 10.364 767 HB2 GLN 43 HB2 GLN 43 15.936 -11.006 9.969 768 HB3 GLN 43 HB3 GLN 43 16.457 -10.068 11.363 769 HG2 GLN 43 HG2 GLN 43 14.198 -9.636 12.002 770 HG3 GLN 43 HG3 GLN 43 13.590 -10.350 10.508 771 HE21 GLN 43 HE21 GLN 43 16.237 -11.722 12.306 772 HE22 GLN 43 HE22 GLN 43 15.394 -13.130 12.848 773 H LEU 44 H LEU 44 16.290 -10.213 7.686 774 HA LEU 44 HA LEU 44 19.095 -9.413 7.557 775 HB2 LEU 44 HB2 LEU 44 17.572 -11.425 5.893 776 HB3 LEU 44 HB3 LEU 44 19.312 -11.211 5.932 777 HG LEU 44 HG LEU 44 17.662 -12.104 8.294 778 HD11 LEU 44 HD11 LEU 44 19.356 -13.730 6.401 779 HD12 LEU 44 HD12 LEU 44 17.595 -13.768 6.512 780 HD13 LEU 44 HD13 LEU 44 18.576 -14.327 7.867 781 HD21 LEU 44 HD21 LEU 44 19.831 -12.709 9.249 782 HD22 LEU 44 HD22 LEU 44 19.734 -10.982 8.905 783 HD23 LEU 44 HD23 LEU 44 20.639 -12.045 7.829 784 H SER 45 H SER 45 18.598 -7.230 6.905 785 HA SER 45 HA SER 45 17.144 -6.910 4.412 786 HB2 SER 45 HB2 SER 45 17.431 -4.435 4.982 787 HB3 SER 45 HB3 SER 45 16.420 -5.396 6.061 788 HG SER 45 HG SER 45 19.178 -5.003 6.552 789 H ASP 46 H ASP 46 18.958 -7.977 3.220 790 HA ASP 46 HA ASP 46 21.131 -6.192 2.528 791 HB2 ASP 46 HB2 ASP 46 21.649 -7.794 0.759 792 HB3 ASP 46 HB3 ASP 46 21.393 -8.647 2.277 793 H THR 47 H THR 47 17.907 -6.311 2.066 794 HA THR 47 HA THR 47 17.921 -4.841 -0.461 795 HB THR 47 HB THR 47 15.357 -5.021 -0.051 796 HG1 THR 47 HG1 THR 47 15.882 -7.371 1.340 797 HG21 THR 47 HG21 THR 47 16.543 -6.243 -1.817 798 HG22 THR 47 HG22 THR 47 15.285 -7.244 -1.089 799 HG23 THR 47 HG23 THR 47 16.977 -7.499 -0.659 800 HA PRO 48 HA PRO 48 17.500 -1.092 1.916 801 HB2 PRO 48 HB2 PRO 48 16.767 0.568 -0.093 802 HB3 PRO 48 HB3 PRO 48 18.423 -0.017 0.104 803 HG2 PRO 48 HG2 PRO 48 16.279 -0.978 -1.748 804 HG3 PRO 48 HG3 PRO 48 18.008 -0.738 -2.063 805 HD2 PRO 48 HD2 PRO 48 16.907 -3.181 -1.558 806 HD3 PRO 48 HD3 PRO 48 18.583 -2.766 -1.147 807 H LEU 49 H LEU 49 15.874 0.130 2.845 808 HA LEU 49 HA LEU 49 13.149 -0.765 2.312 809 HB2 LEU 49 HB2 LEU 49 14.372 0.898 4.494 810 HB3 LEU 49 HB3 LEU 49 12.642 0.808 4.269 811 HG LEU 49 HG LEU 49 14.439 -1.531 4.900 812 HD11 LEU 49 HD11 LEU 49 14.189 0.039 6.759 813 HD12 LEU 49 HD12 LEU 49 13.328 -1.467 7.075 814 HD13 LEU 49 HD13 LEU 49 12.434 -0.028 6.579 815 HD21 LEU 49 HD21 LEU 49 11.432 -1.349 4.724 816 HD22 LEU 49 HD22 LEU 49 12.372 -2.770 5.177 817 HD23 LEU 49 HD23 LEU 49 12.478 -2.128 3.537 818 H ILE 50 H ILE 50 11.903 0.306 0.964 819 HA ILE 50 HA ILE 50 12.344 3.177 0.606 820 HB ILE 50 HB ILE 50 10.346 1.388 -0.804 821 HG12 ILE 50 HG12 ILE 50 12.938 2.509 -1.883 822 HG13 ILE 50 HG13 ILE 50 12.782 0.883 -1.237 823 HG21 ILE 50 HG21 ILE 50 10.173 3.290 -2.379 824 HG22 ILE 50 HG22 ILE 50 11.225 4.232 -1.320 825 HG23 ILE 50 HG23 ILE 50 9.644 3.706 -0.749 826 HD11 ILE 50 HD11 ILE 50 12.666 0.888 -3.664 827 HD12 ILE 50 HD12 ILE 50 11.284 1.982 -3.604 828 HD13 ILE 50 HD13 ILE 50 11.142 0.347 -2.960 829 HA PRO 51 HA PRO 51 9.008 3.748 3.521 830 HB2 PRO 51 HB2 PRO 51 9.132 6.427 3.628 831 HB3 PRO 51 HB3 PRO 51 10.350 5.412 4.410 832 HG2 PRO 51 HG2 PRO 51 10.481 6.864 1.805 833 HG3 PRO 51 HG3 PRO 51 11.718 6.702 3.059 834 HD2 PRO 51 HD2 PRO 51 11.667 5.182 0.772 835 HD3 PRO 51 HD3 PRO 51 12.411 4.660 2.297 836 H LEU 52 H LEU 52 6.898 3.961 3.161 837 HA LEU 52 HA LEU 52 6.008 5.430 0.776 838 HB2 LEU 52 HB2 LEU 52 5.133 2.693 1.688 839 HB3 LEU 52 HB3 LEU 52 4.230 3.649 0.523 840 HG LEU 52 HG LEU 52 6.633 3.654 -0.678 841 HD11 LEU 52 HD11 LEU 52 6.511 1.024 0.777 842 HD12 LEU 52 HD12 LEU 52 7.689 2.308 1.053 843 HD13 LEU 52 HD13 LEU 52 7.656 1.458 -0.493 844 HD21 LEU 52 HD21 LEU 52 5.811 1.820 -2.070 845 HD22 LEU 52 HD22 LEU 52 4.540 2.987 -1.708 846 HD23 LEU 52 HD23 LEU 52 4.593 1.445 -0.851 847 H THR 53 H THR 53 4.333 6.738 1.078 848 HA THR 53 HA THR 53 3.045 6.701 3.733 849 HB THR 53 HB THR 53 3.088 9.054 1.841 850 HG1 THR 53 HG1 THR 53 5.234 7.974 2.885 851 HG21 THR 53 HG21 THR 53 2.831 8.826 4.844 852 HG22 THR 53 HG22 THR 53 1.513 9.140 3.710 853 HG23 THR 53 HG23 THR 53 2.800 10.328 3.919 854 H ILE 54 H ILE 54 1.025 5.959 3.700 855 HA ILE 54 HA ILE 54 -0.396 6.001 1.125 856 HB ILE 54 HB ILE 54 -0.844 4.178 3.494 857 HG12 ILE 54 HG12 ILE 54 0.478 3.728 0.811 858 HG13 ILE 54 HG13 ILE 54 1.238 3.632 2.396 859 HG21 ILE 54 HG21 ILE 54 -2.892 4.632 2.243 860 HG22 ILE 54 HG22 ILE 54 -2.362 2.965 2.017 861 HG23 ILE 54 HG23 ILE 54 -2.088 4.157 0.746 862 HD11 ILE 54 HD11 ILE 54 -0.926 1.798 1.401 863 HD12 ILE 54 HD12 ILE 54 -0.060 1.673 2.933 864 HD13 ILE 54 HD13 ILE 54 0.799 1.431 1.412 865 H PHE 55 H PHE 55 -2.001 7.326 0.934 866 HA PHE 55 HA PHE 55 -3.299 8.406 3.349 867 HB2 PHE 55 HB2 PHE 55 -3.131 9.506 0.532 868 HB3 PHE 55 HB3 PHE 55 -4.085 10.226 1.817 869 HD1 PHE 55 HD1 PHE 55 -0.614 9.278 0.941 870 HD2 PHE 55 HD2 PHE 55 -3.169 11.821 3.193 871 HE1 PHE 55 HE1 PHE 55 1.330 10.629 1.615 872 HE2 PHE 55 HE2 PHE 55 -1.231 13.182 3.868 873 HZ PHE 55 HZ PHE 55 1.023 12.582 3.079 874 H VAL 56 H VAL 56 -5.450 8.108 3.646 875 HA VAL 56 HA VAL 56 -6.827 6.394 1.763 876 HB VAL 56 HB VAL 56 -7.376 7.291 4.540 877 HG11 VAL 56 HG11 VAL 56 -9.712 6.770 4.458 878 HG12 VAL 56 HG12 VAL 56 -9.597 6.241 2.782 879 HG13 VAL 56 HG13 VAL 56 -9.414 7.948 3.183 880 HG21 VAL 56 HG21 VAL 56 -6.337 5.149 3.992 881 HG22 VAL 56 HG22 VAL 56 -7.748 4.722 3.024 882 HG23 VAL 56 HG23 VAL 56 -7.903 4.923 4.770 883 H GLY 57 H GLY 57 -8.352 6.956 0.391 884 HA2 GLY 57 HA2 GLY 57 -8.958 9.810 0.189 885 HA3 GLY 57 HA3 GLY 57 -9.095 8.634 -1.105 886 H GLU 58 H GLU 58 -11.107 10.485 -0.307 887 HA GLU 58 HA GLU 58 -13.111 8.880 1.050 888 HB2 GLU 58 HB2 GLU 58 -13.301 11.639 -0.174 889 HB3 GLU 58 HB3 GLU 58 -14.547 10.859 0.791 890 HG2 GLU 58 HG2 GLU 58 -13.021 10.819 2.705 891 HG3 GLU 58 HG3 GLU 58 -11.805 11.647 1.734 892 H ASN 59 H ASN 59 -14.210 7.416 -0.075 893 HA ASN 59 HA ASN 59 -14.535 7.709 -2.945 894 HB2 ASN 59 HB2 ASN 59 -14.072 5.483 -1.842 895 HB3 ASN 59 HB3 ASN 59 -15.695 5.557 -1.161 896 HD21 ASN 59 HD21 ASN 59 -13.833 5.267 -4.110 897 HD22 ASN 59 HD22 ASN 59 -15.121 4.650 -5.081 898 H THR 60 H THR 60 -15.654 9.780 -2.429 899 HA THR 60 HA THR 60 -18.308 9.714 -1.359 900 HB THR 60 HB THR 60 -17.192 11.934 -3.061 901 HG1 THR 60 HG1 THR 60 -16.723 12.028 -0.309 902 HG21 THR 60 HG21 THR 60 -19.507 12.120 -2.289 903 HG22 THR 60 HG22 THR 60 -18.485 13.333 -1.518 904 HG23 THR 60 HG23 THR 60 -18.975 11.894 -0.623 905 H GLY 61 H GLY 61 -16.826 9.673 -4.534 906 HA2 GLY 61 HA2 GLY 61 -19.495 9.148 -5.692 907 HA3 GLY 61 HA3 GLY 61 -18.272 10.091 -6.535 908 H VAL 62 H VAL 62 -19.532 7.723 -7.511 909 HA VAL 62 HA VAL 62 -17.532 5.636 -7.285 910 HB VAL 62 HB VAL 62 -19.035 4.390 -8.895 911 HG11 VAL 62 HG11 VAL 62 -20.220 5.354 -6.294 912 HG12 VAL 62 HG12 VAL 62 -19.118 3.994 -6.503 913 HG13 VAL 62 HG13 VAL 62 -20.744 3.926 -7.184 914 HG21 VAL 62 HG21 VAL 62 -20.849 6.751 -8.384 915 HG22 VAL 62 HG22 VAL 62 -21.347 5.233 -9.130 916 HG23 VAL 62 HG23 VAL 62 -20.168 6.266 -9.938 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 10.563 21.716 -3.513 2 H2 GLY 1 H2 GLY 1 10.575 20.085 -3.977 3 H3 GLY 1 H3 GLY 1 11.986 20.805 -3.366 4 HA2 GLY 1 HA2 GLY 1 10.894 19.370 -1.727 5 HA3 GLY 1 HA3 GLY 1 11.020 21.045 -1.207 6 H ALA 2 H ALA 2 8.740 19.542 -3.495 7 HA ALA 2 HA ALA 2 6.541 19.720 -1.660 8 HB1 ALA 2 HB1 ALA 2 6.796 22.092 -2.207 9 HB2 ALA 2 HB2 ALA 2 5.270 21.443 -2.810 10 HB3 ALA 2 HB3 ALA 2 6.612 21.713 -3.921 11 H MET 3 H MET 3 6.471 17.523 -2.372 12 HA MET 3 HA MET 3 5.236 15.892 -3.333 13 HB2 MET 3 HB2 MET 3 3.455 17.655 -3.204 14 HB3 MET 3 HB3 MET 3 3.829 18.081 -4.866 15 HG2 MET 3 HG2 MET 3 3.189 15.855 -5.599 16 HG3 MET 3 HG3 MET 3 2.858 15.388 -3.930 17 HE1 MET 3 HE1 MET 3 -0.713 15.603 -5.578 18 HE2 MET 3 HE2 MET 3 0.410 14.577 -4.684 19 HE3 MET 3 HE3 MET 3 0.782 15.059 -6.340 20 H GLU 4 H GLU 4 7.739 16.512 -4.478 21 HA GLU 4 HA GLU 4 7.271 15.842 -7.302 22 HB2 GLU 4 HB2 GLU 4 9.736 16.130 -7.563 23 HB3 GLU 4 HB3 GLU 4 8.911 17.585 -7.031 24 HG2 GLU 4 HG2 GLU 4 10.297 15.717 -5.131 25 HG3 GLU 4 HG3 GLU 4 11.116 17.064 -5.920 26 H MET 5 H MET 5 6.875 14.200 -4.875 27 HA MET 5 HA MET 5 8.719 11.977 -5.322 28 HB2 MET 5 HB2 MET 5 7.529 11.036 -3.285 29 HB3 MET 5 HB3 MET 5 8.475 12.493 -3.013 30 HG2 MET 5 HG2 MET 5 6.508 13.843 -3.023 31 HG3 MET 5 HG3 MET 5 5.508 12.468 -3.475 32 HE1 MET 5 HE1 MET 5 7.798 14.011 -0.652 33 HE2 MET 5 HE2 MET 5 8.484 12.407 -0.914 34 HE3 MET 5 HE3 MET 5 7.663 12.777 0.602 35 HA PRO 6 HA PRO 6 6.051 9.663 -7.952 36 HB2 PRO 6 HB2 PRO 6 6.844 7.482 -6.066 37 HB3 PRO 6 HB3 PRO 6 6.799 7.476 -7.833 38 HG2 PRO 6 HG2 PRO 6 9.114 7.759 -6.596 39 HG3 PRO 6 HG3 PRO 6 8.744 8.790 -7.994 40 HD2 PRO 6 HD2 PRO 6 8.702 9.462 -5.078 41 HD3 PRO 6 HD3 PRO 6 9.200 10.460 -6.460 42 H THR 7 H THR 7 3.922 9.416 -7.937 43 HA THR 7 HA THR 7 2.655 8.726 -5.380 44 HB THR 7 HB THR 7 1.330 10.285 -7.592 45 HG1 THR 7 HG1 THR 7 3.292 11.128 -6.040 46 HG21 THR 7 HG21 THR 7 -0.162 9.182 -5.985 47 HG22 THR 7 HG22 THR 7 -0.240 10.938 -5.851 48 HG23 THR 7 HG23 THR 7 0.669 10.005 -4.662 49 H PHE 8 H PHE 8 1.231 7.083 -5.332 50 HA PHE 8 HA PHE 8 0.421 5.867 -7.898 51 HB2 PHE 8 HB2 PHE 8 1.056 4.456 -5.293 52 HB3 PHE 8 HB3 PHE 8 0.427 3.684 -6.737 53 HD1 PHE 8 HD1 PHE 8 3.342 5.333 -5.244 54 HD2 PHE 8 HD2 PHE 8 1.857 3.165 -8.591 55 HE1 PHE 8 HE1 PHE 8 5.648 4.948 -6.013 56 HE2 PHE 8 HE2 PHE 8 4.163 2.780 -9.371 57 HZ PHE 8 HZ PHE 8 6.063 3.672 -8.078 58 H TYR 9 H TYR 9 -1.743 5.259 -8.054 59 HA TYR 9 HA TYR 9 -3.378 5.760 -5.658 60 HB2 TYR 9 HB2 TYR 9 -3.465 7.510 -7.602 61 HB3 TYR 9 HB3 TYR 9 -4.452 6.294 -8.407 62 HD1 TYR 9 HD1 TYR 9 -6.460 5.353 -6.939 63 HD2 TYR 9 HD2 TYR 9 -4.495 9.067 -6.267 64 HE1 TYR 9 HE1 TYR 9 -8.425 6.166 -5.683 65 HE2 TYR 9 HE2 TYR 9 -6.443 9.880 -5.018 66 HH TYR 9 HH TYR 9 -8.794 9.449 -4.812 67 H LEU 10 H LEU 10 -4.542 4.074 -5.071 68 HA LEU 10 HA LEU 10 -5.560 2.256 -7.107 69 HB2 LEU 10 HB2 LEU 10 -4.927 0.331 -5.511 70 HB3 LEU 10 HB3 LEU 10 -3.704 0.995 -6.575 71 HG LEU 10 HG LEU 10 -3.039 2.448 -4.535 72 HD11 LEU 10 HD11 LEU 10 -4.961 1.945 -3.140 73 HD12 LEU 10 HD12 LEU 10 -3.472 1.396 -2.373 74 HD13 LEU 10 HD13 LEU 10 -4.541 0.232 -3.156 75 HD21 LEU 10 HD21 LEU 10 -1.570 0.660 -3.720 76 HD22 LEU 10 HD22 LEU 10 -1.635 0.729 -5.480 77 HD23 LEU 10 HD23 LEU 10 -2.533 -0.518 -4.613 78 H ALA 11 H ALA 11 -7.310 0.915 -6.361 79 HA ALA 11 HA ALA 11 -8.635 1.959 -3.947 80 HB1 ALA 11 HB1 ALA 11 -10.779 1.591 -5.043 81 HB2 ALA 11 HB2 ALA 11 -9.947 1.053 -6.502 82 HB3 ALA 11 HB3 ALA 11 -9.782 2.722 -5.957 83 H LEU 12 H LEU 12 -9.178 0.511 -2.466 84 HA LEU 12 HA LEU 12 -8.873 -2.338 -3.177 85 HB2 LEU 12 HB2 LEU 12 -8.104 -1.044 -0.564 86 HB3 LEU 12 HB3 LEU 12 -7.844 -2.711 -1.025 87 HG LEU 12 HG LEU 12 -6.497 -0.328 -2.293 88 HD11 LEU 12 HD11 LEU 12 -5.735 -0.681 -0.019 89 HD12 LEU 12 HD12 LEU 12 -4.485 -1.165 -1.166 90 HD13 LEU 12 HD13 LEU 12 -5.461 -2.391 -0.355 91 HD21 LEU 12 HD21 LEU 12 -6.777 -2.186 -3.855 92 HD22 LEU 12 HD22 LEU 12 -6.041 -3.284 -2.687 93 HD23 LEU 12 HD23 LEU 12 -5.086 -1.982 -3.400 94 H HIS 13 H HIS 13 -10.376 -3.744 -2.338 95 HA HIS 13 HA HIS 13 -12.794 -2.632 -1.292 96 HB2 HIS 13 HB2 HIS 13 -11.871 -5.492 -1.617 97 HB3 HIS 13 HB3 HIS 13 -13.461 -5.057 -0.998 98 HD1 HIS 13 HD1 HIS 13 -11.881 -6.019 -4.035 99 HD2 HIS 13 HD2 HIS 13 -14.828 -3.248 -3.021 100 HE1 HIS 13 HE1 HIS 13 -13.103 -5.502 -6.170 101 HE2 HIS 13 HE2 HIS 13 -14.785 -3.729 -5.568 102 H GLY 14 H GLY 14 -13.369 -2.285 0.751 103 HA2 GLY 14 HA2 GLY 14 -11.443 -2.353 2.801 104 HA3 GLY 14 HA3 GLY 14 -13.153 -2.024 3.017 105 H GLY 15 H GLY 15 -10.622 -4.303 3.367 106 HA2 GLY 15 HA2 GLY 15 -10.972 -5.905 5.199 107 HA3 GLY 15 HA3 GLY 15 -12.549 -6.228 4.509 108 H GLN 16 H GLN 16 -10.557 -5.853 1.941 109 HA GLN 16 HA GLN 16 -10.250 -8.753 1.685 110 HB2 GLN 16 HB2 GLN 16 -10.023 -6.548 -0.365 111 HB3 GLN 16 HB3 GLN 16 -9.814 -8.257 -0.712 112 HG2 GLN 16 HG2 GLN 16 -12.323 -6.891 0.225 113 HG3 GLN 16 HG3 GLN 16 -12.012 -7.576 -1.368 114 HE21 GLN 16 HE21 GLN 16 -14.140 -8.174 0.507 115 HE22 GLN 16 HE22 GLN 16 -14.031 -9.867 0.838 116 H THR 17 H THR 17 -8.270 -9.647 0.845 117 HA THR 17 HA THR 17 -5.937 -8.243 1.931 118 HB THR 17 HB THR 17 -6.054 -11.116 0.997 119 HG1 THR 17 HG1 THR 17 -7.282 -9.976 3.137 120 HG21 THR 17 HG21 THR 17 -3.825 -10.151 1.353 121 HG22 THR 17 HG22 THR 17 -4.181 -11.402 2.543 122 HG23 THR 17 HG23 THR 17 -4.281 -9.700 2.995 123 H TYR 18 H TYR 18 -4.279 -7.642 0.712 124 HA TYR 18 HA TYR 18 -4.248 -8.397 -2.126 125 HB2 TYR 18 HB2 TYR 18 -3.836 -5.650 -0.929 126 HB3 TYR 18 HB3 TYR 18 -3.425 -6.063 -2.590 127 HD1 TYR 18 HD1 TYR 18 -5.171 -6.521 -4.227 128 HD2 TYR 18 HD2 TYR 18 -6.147 -5.381 -0.250 129 HE1 TYR 18 HE1 TYR 18 -7.466 -6.037 -4.947 130 HE2 TYR 18 HE2 TYR 18 -8.451 -4.888 -0.948 131 HH TYR 18 HH TYR 18 -9.718 -5.859 -3.969 132 H HIS 19 H HIS 19 -2.234 -8.496 -3.087 133 HA HIS 19 HA HIS 19 0.027 -8.749 -1.268 134 HB2 HIS 19 HB2 HIS 19 -0.674 -9.789 -3.940 135 HB3 HIS 19 HB3 HIS 19 1.012 -9.336 -3.744 136 HD1 HIS 19 HD1 HIS 19 -0.894 -12.213 -3.638 137 HD2 HIS 19 HD2 HIS 19 1.839 -10.568 -0.963 138 HE1 HIS 19 HE1 HIS 19 -0.039 -14.141 -2.268 139 HE2 HIS 19 HE2 HIS 19 1.837 -13.161 -0.896 140 H LEU 20 H LEU 20 1.285 -7.104 -0.948 141 HA LEU 20 HA LEU 20 1.346 -4.921 -2.904 142 HB2 LEU 20 HB2 LEU 20 0.525 -4.057 -0.891 143 HB3 LEU 20 HB3 LEU 20 1.579 -5.059 0.080 144 HG LEU 20 HG LEU 20 3.482 -3.657 -0.466 145 HD11 LEU 20 HD11 LEU 20 1.536 -2.066 -2.121 146 HD12 LEU 20 HD12 LEU 20 2.882 -3.039 -2.723 147 HD13 LEU 20 HD13 LEU 20 3.197 -1.599 -1.752 148 HD21 LEU 20 HD21 LEU 20 2.111 -3.049 1.450 149 HD22 LEU 20 HD22 LEU 20 1.084 -2.060 0.414 150 HD23 LEU 20 HD23 LEU 20 2.770 -1.612 0.669 151 H ILE 21 H ILE 21 3.101 -4.797 -4.075 152 HA ILE 21 HA ILE 21 5.683 -5.497 -2.841 153 HB ILE 21 HB ILE 21 4.947 -5.937 -5.740 154 HG12 ILE 21 HG12 ILE 21 5.526 -8.219 -3.923 155 HG13 ILE 21 HG13 ILE 21 3.958 -7.438 -3.747 156 HG21 ILE 21 HG21 ILE 21 7.320 -5.494 -5.385 157 HG22 ILE 21 HG22 ILE 21 7.064 -7.178 -5.840 158 HG23 ILE 21 HG23 ILE 21 7.386 -6.758 -4.156 159 HD11 ILE 21 HD11 ILE 21 3.448 -7.872 -6.061 160 HD12 ILE 21 HD12 ILE 21 3.896 -9.371 -5.244 161 HD13 ILE 21 HD13 ILE 21 5.048 -8.566 -6.311 162 H VAL 22 H VAL 22 7.007 -3.795 -2.795 163 HA VAL 22 HA VAL 22 6.749 -1.783 -4.925 164 HB VAL 22 HB VAL 22 6.428 -0.857 -2.650 165 HG11 VAL 22 HG11 VAL 22 9.281 -1.713 -2.208 166 HG12 VAL 22 HG12 VAL 22 7.860 -2.370 -1.398 167 HG13 VAL 22 HG13 VAL 22 8.337 -0.694 -1.119 168 HG21 VAL 22 HG21 VAL 22 8.001 1.007 -2.866 169 HG22 VAL 22 HG22 VAL 22 7.293 0.566 -4.420 170 HG23 VAL 22 HG23 VAL 22 8.939 0.069 -4.029 171 H ASP 23 H ASP 23 8.451 -1.471 -6.236 172 HA ASP 23 HA ASP 23 10.963 -2.846 -5.593 173 HB2 ASP 23 HB2 ASP 23 9.580 -4.357 -6.968 174 HB3 ASP 23 HB3 ASP 23 9.439 -3.107 -8.193 175 H THR 24 H THR 24 12.665 -2.221 -7.324 176 HA THR 24 HA THR 24 12.272 0.583 -8.111 177 HB THR 24 HB THR 24 14.852 0.719 -7.502 178 HG1 THR 24 HG1 THR 24 13.821 -1.399 -5.936 179 HG21 THR 24 HG21 THR 24 14.242 1.698 -5.342 180 HG22 THR 24 HG22 THR 24 12.650 0.944 -5.447 181 HG23 THR 24 HG23 THR 24 13.116 2.189 -6.608 182 H ASP 25 H ASP 25 13.003 1.090 -10.087 183 HA ASP 25 HA ASP 25 14.009 -1.083 -11.718 184 HB2 ASP 25 HB2 ASP 25 13.244 0.079 -13.531 185 HB3 ASP 25 HB3 ASP 25 12.244 0.843 -12.302 186 H SER 26 H SER 26 15.710 -0.123 -13.506 187 HA SER 26 HA SER 26 18.145 -0.087 -12.167 188 HB2 SER 26 HB2 SER 26 17.615 0.924 -14.963 189 HB3 SER 26 HB3 SER 26 19.137 0.292 -14.333 190 HG SER 26 HG SER 26 17.737 -1.192 -15.596 191 H LEU 27 H LEU 27 16.102 2.594 -13.143 192 HA LEU 27 HA LEU 27 18.203 4.555 -12.840 193 HB2 LEU 27 HB2 LEU 27 15.231 4.958 -13.135 194 HB3 LEU 27 HB3 LEU 27 16.470 6.185 -13.323 195 HG LEU 27 HG LEU 27 16.179 3.768 -15.105 196 HD11 LEU 27 HD11 LEU 27 15.364 6.631 -15.579 197 HD12 LEU 27 HD12 LEU 27 14.267 5.279 -15.306 198 HD13 LEU 27 HD13 LEU 27 15.279 5.319 -16.753 199 HD21 LEU 27 HD21 LEU 27 18.458 4.626 -14.989 200 HD22 LEU 27 HD22 LEU 27 17.876 6.252 -15.345 201 HD23 LEU 27 HD23 LEU 27 17.734 4.980 -16.557 202 H GLY 28 H GLY 28 15.839 3.068 -10.843 203 HA2 GLY 28 HA2 GLY 28 16.060 3.255 -8.447 204 HA3 GLY 28 HA3 GLY 28 16.557 4.926 -8.671 205 H ASN 29 H ASN 29 13.948 3.864 -10.612 206 HA ASN 29 HA ASN 29 12.091 5.521 -9.089 207 HB2 ASN 29 HB2 ASN 29 11.621 3.986 -11.653 208 HB3 ASN 29 HB3 ASN 29 10.555 5.185 -10.952 209 HD21 ASN 29 HD21 ASN 29 13.472 4.628 -12.708 210 HD22 ASN 29 HD22 ASN 29 13.729 6.274 -13.193 211 HA PRO 30 HA PRO 30 10.358 1.991 -7.119 212 HB2 PRO 30 HB2 PRO 30 8.181 3.535 -6.149 213 HB3 PRO 30 HB3 PRO 30 9.667 3.117 -5.295 214 HG2 PRO 30 HG2 PRO 30 8.912 5.677 -6.117 215 HG3 PRO 30 HG3 PRO 30 10.533 5.182 -5.606 216 HD2 PRO 30 HD2 PRO 30 9.455 5.601 -8.344 217 HD3 PRO 30 HD3 PRO 30 11.102 5.817 -7.718 218 H SER 31 H SER 31 8.789 0.532 -7.516 219 HA SER 31 HA SER 31 6.593 1.314 -9.301 220 HB2 SER 31 HB2 SER 31 8.334 0.053 -10.558 221 HB3 SER 31 HB3 SER 31 8.155 -1.279 -9.421 222 HG SER 31 HG SER 31 6.894 -1.673 -11.255 223 H LEU 32 H LEU 32 4.629 0.400 -8.808 224 HA LEU 32 HA LEU 32 4.569 -1.058 -6.253 225 HB2 LEU 32 HB2 LEU 32 3.686 1.349 -6.360 226 HB3 LEU 32 HB3 LEU 32 2.365 0.694 -7.308 227 HG LEU 32 HG LEU 32 1.894 -0.862 -5.372 228 HD11 LEU 32 HD11 LEU 32 3.742 1.043 -3.945 229 HD12 LEU 32 HD12 LEU 32 4.080 -0.652 -4.289 230 HD13 LEU 32 HD13 LEU 32 2.764 -0.220 -3.197 231 HD21 LEU 32 HD21 LEU 32 1.661 2.095 -4.835 232 HD22 LEU 32 HD22 LEU 32 0.654 0.814 -4.157 233 HD23 LEU 32 HD23 LEU 32 0.588 1.167 -5.882 234 H SER 33 H SER 33 3.568 -2.959 -6.222 235 HA SER 33 HA SER 33 1.668 -3.591 -8.376 236 HB2 SER 33 HB2 SER 33 3.731 -5.485 -7.221 237 HB3 SER 33 HB3 SER 33 2.562 -5.861 -8.488 238 HG SER 33 HG SER 33 3.888 -3.673 -9.201 239 H VAL 34 H VAL 34 -0.259 -4.037 -7.569 240 HA VAL 34 HA VAL 34 -0.423 -5.334 -4.930 241 HB VAL 34 HB VAL 34 -2.169 -3.091 -5.967 242 HG11 VAL 34 HG11 VAL 34 -3.537 -4.771 -4.839 243 HG12 VAL 34 HG12 VAL 34 -3.425 -3.290 -3.888 244 HG13 VAL 34 HG13 VAL 34 -2.469 -4.703 -3.438 245 HG21 VAL 34 HG21 VAL 34 -1.387 -1.900 -3.986 246 HG22 VAL 34 HG22 VAL 34 -0.036 -2.377 -5.015 247 HG23 VAL 34 HG23 VAL 34 -0.387 -3.283 -3.541 248 H ILE 35 H ILE 35 -1.439 -7.204 -4.992 249 HA ILE 35 HA ILE 35 -3.383 -7.710 -7.159 250 HB ILE 35 HB ILE 35 -1.819 -9.997 -6.078 251 HG12 ILE 35 HG12 ILE 35 -0.709 -8.007 -8.067 252 HG13 ILE 35 HG13 ILE 35 -0.035 -8.407 -6.497 253 HG21 ILE 35 HG21 ILE 35 -2.812 -9.284 -8.834 254 HG22 ILE 35 HG22 ILE 35 -3.670 -10.282 -7.661 255 HG23 ILE 35 HG23 ILE 35 -2.137 -10.836 -8.338 256 HD11 ILE 35 HD11 ILE 35 1.228 -9.450 -8.284 257 HD12 ILE 35 HD12 ILE 35 -0.227 -10.264 -8.857 258 HD13 ILE 35 HD13 ILE 35 0.447 -10.669 -7.278 259 HA PRO 36 HA PRO 36 -6.024 -8.820 -3.715 260 HB2 PRO 36 HB2 PRO 36 -7.909 -10.155 -5.205 261 HB3 PRO 36 HB3 PRO 36 -7.864 -8.398 -5.012 262 HG2 PRO 36 HG2 PRO 36 -6.876 -10.087 -7.272 263 HG3 PRO 36 HG3 PRO 36 -7.722 -8.530 -7.321 264 HD2 PRO 36 HD2 PRO 36 -5.060 -8.727 -7.687 265 HD3 PRO 36 HD3 PRO 36 -5.796 -7.328 -6.879 266 H SER 37 H SER 37 -6.105 -10.556 -2.403 267 HA SER 37 HA SER 37 -4.638 -12.902 -3.003 268 HB2 SER 37 HB2 SER 37 -5.696 -13.724 -0.834 269 HB3 SER 37 HB3 SER 37 -4.752 -12.240 -0.723 270 HG SER 37 HG SER 37 -7.590 -12.429 -0.918 271 H ASN 38 H ASN 38 -7.968 -12.009 -3.252 272 HA ASN 38 HA ASN 38 -8.539 -14.495 -4.638 273 HB2 ASN 38 HB2 ASN 38 -10.792 -14.573 -3.376 274 HB3 ASN 38 HB3 ASN 38 -9.361 -15.195 -2.567 275 HD21 ASN 38 HD21 ASN 38 -11.781 -14.396 -1.353 276 HD22 ASN 38 HD22 ASN 38 -11.441 -13.057 -0.306 277 HA PRO 39 HA PRO 39 -10.066 -11.091 -7.156 278 HB2 PRO 39 HB2 PRO 39 -10.337 -12.594 -9.416 279 HB3 PRO 39 HB3 PRO 39 -8.800 -11.904 -8.881 280 HG2 PRO 39 HG2 PRO 39 -9.852 -14.685 -8.539 281 HG3 PRO 39 HG3 PRO 39 -8.217 -14.151 -8.974 282 HD2 PRO 39 HD2 PRO 39 -8.856 -14.943 -6.475 283 HD3 PRO 39 HD3 PRO 39 -7.653 -13.678 -6.789 284 H TYR 40 H TYR 40 -11.557 -14.067 -6.322 285 HA TYR 40 HA TYR 40 -14.011 -13.761 -7.692 286 HB2 TYR 40 HB2 TYR 40 -13.506 -15.171 -5.063 287 HB3 TYR 40 HB3 TYR 40 -14.882 -15.419 -6.134 288 HD1 TYR 40 HD1 TYR 40 -14.608 -16.630 -8.245 289 HD2 TYR 40 HD2 TYR 40 -11.358 -16.140 -5.548 290 HE1 TYR 40 HE1 TYR 40 -13.370 -18.395 -9.426 291 HE2 TYR 40 HE2 TYR 40 -10.110 -17.904 -6.720 292 HH TYR 40 HH TYR 40 -10.512 -19.798 -8.155 293 H GLN 41 H GLN 41 -12.785 -12.614 -4.611 294 HA GLN 41 HA GLN 41 -15.252 -11.451 -3.764 295 HB2 GLN 41 HB2 GLN 41 -12.401 -11.285 -2.849 296 HB3 GLN 41 HB3 GLN 41 -13.626 -10.218 -2.163 297 HG2 GLN 41 HG2 GLN 41 -13.805 -13.221 -2.201 298 HG3 GLN 41 HG3 GLN 41 -13.202 -12.274 -0.840 299 HE21 GLN 41 HE21 GLN 41 -15.972 -13.220 -2.676 300 HE22 GLN 41 HE22 GLN 41 -17.171 -12.593 -1.590 301 H GLU 42 H GLU 42 -12.680 -10.487 -5.833 302 HA GLU 42 HA GLU 42 -13.132 -7.683 -5.748 303 HB2 GLU 42 HB2 GLU 42 -11.880 -9.435 -7.865 304 HB3 GLU 42 HB3 GLU 42 -11.894 -7.678 -7.924 305 HG2 GLU 42 HG2 GLU 42 -10.634 -9.331 -5.747 306 HG3 GLU 42 HG3 GLU 42 -9.773 -8.588 -7.095 307 H GLN 43 H GLN 43 -14.307 -10.289 -7.840 308 HA GLN 43 HA GLN 43 -15.910 -8.506 -9.424 309 HB2 GLN 43 HB2 GLN 43 -16.785 -10.597 -10.452 310 HB3 GLN 43 HB3 GLN 43 -15.035 -10.488 -10.479 311 HG2 GLN 43 HG2 GLN 43 -14.924 -11.979 -8.537 312 HG3 GLN 43 HG3 GLN 43 -16.680 -12.117 -8.566 313 HE21 GLN 43 HE21 GLN 43 -14.747 -11.949 -11.463 314 HE22 GLN 43 HE22 GLN 43 -15.041 -13.571 -11.983 315 H LEU 44 H LEU 44 -16.407 -10.622 -6.687 316 HA LEU 44 HA LEU 44 -19.256 -9.915 -6.612 317 HB2 LEU 44 HB2 LEU 44 -17.693 -11.949 -5.011 318 HB3 LEU 44 HB3 LEU 44 -19.428 -11.703 -4.935 319 HG LEU 44 HG LEU 44 -18.068 -12.475 -7.501 320 HD11 LEU 44 HD11 LEU 44 -18.586 -14.794 -6.998 321 HD12 LEU 44 HD12 LEU 44 -19.160 -14.329 -5.395 322 HD13 LEU 44 HD13 LEU 44 -17.457 -14.130 -5.816 323 HD21 LEU 44 HD21 LEU 44 -20.345 -11.613 -7.655 324 HD22 LEU 44 HD22 LEU 44 -20.886 -12.804 -6.474 325 HD23 LEU 44 HD23 LEU 44 -20.291 -13.330 -8.049 326 H SER 45 H SER 45 -18.021 -7.746 -6.114 327 HA SER 45 HA SER 45 -16.889 -7.491 -3.515 328 HB2 SER 45 HB2 SER 45 -17.035 -4.978 -4.172 329 HB3 SER 45 HB3 SER 45 -15.954 -6.043 -5.073 330 HG SER 45 HG SER 45 -18.618 -5.607 -5.930 331 H ASP 46 H ASP 46 -18.387 -8.031 -1.975 332 HA ASP 46 HA ASP 46 -20.854 -6.532 -1.720 333 HB2 ASP 46 HB2 ASP 46 -21.197 -7.765 0.302 334 HB3 ASP 46 HB3 ASP 46 -20.507 -8.900 -0.852 335 H THR 47 H THR 47 -17.589 -6.198 -1.004 336 HA THR 47 HA THR 47 -18.005 -4.176 1.064 337 HB THR 47 HB THR 47 -15.325 -4.436 0.912 338 HG1 THR 47 HG1 THR 47 -16.311 -7.048 0.319 339 HG21 THR 47 HG21 THR 47 -15.505 -6.046 2.770 340 HG22 THR 47 HG22 THR 47 -17.207 -6.292 2.372 341 HG23 THR 47 HG23 THR 47 -16.650 -4.715 2.933 342 HA PRO 48 HA PRO 48 -17.359 -1.008 -1.948 343 HB2 PRO 48 HB2 PRO 48 -16.823 1.058 -0.292 344 HB3 PRO 48 HB3 PRO 48 -18.438 0.356 -0.439 345 HG2 PRO 48 HG2 PRO 48 -16.348 -0.122 1.653 346 HG3 PRO 48 HG3 PRO 48 -18.092 0.137 1.853 347 HD2 PRO 48 HD2 PRO 48 -16.959 -2.325 1.913 348 HD3 PRO 48 HD3 PRO 48 -18.603 -2.042 1.311 349 H LEU 49 H LEU 49 -15.768 0.318 -2.885 350 HA LEU 49 HA LEU 49 -13.035 -0.484 -2.318 351 HB2 LEU 49 HB2 LEU 49 -14.302 1.208 -4.453 352 HB3 LEU 49 HB3 LEU 49 -12.567 1.175 -4.233 353 HG LEU 49 HG LEU 49 -14.276 -1.223 -4.899 354 HD11 LEU 49 HD11 LEU 49 -13.228 -1.079 -7.089 355 HD12 LEU 49 HD12 LEU 49 -12.356 0.373 -6.590 356 HD13 LEU 49 HD13 LEU 49 -14.117 0.402 -6.729 357 HD21 LEU 49 HD21 LEU 49 -11.280 -0.897 -4.737 358 HD22 LEU 49 HD22 LEU 49 -12.140 -2.346 -5.265 359 HD23 LEU 49 HD23 LEU 49 -12.284 -1.792 -3.596 360 H ILE 50 H ILE 50 -11.766 0.565 -0.983 361 HA ILE 50 HA ILE 50 -12.289 3.385 -0.400 362 HB ILE 50 HB ILE 50 -10.227 1.530 0.816 363 HG12 ILE 50 HG12 ILE 50 -12.804 2.531 2.037 364 HG13 ILE 50 HG13 ILE 50 -12.639 0.954 1.278 365 HG21 ILE 50 HG21 ILE 50 -9.562 3.870 0.911 366 HG22 ILE 50 HG22 ILE 50 -10.000 3.296 2.522 367 HG23 ILE 50 HG23 ILE 50 -11.123 4.305 1.606 368 HD11 ILE 50 HD11 ILE 50 -12.464 0.798 3.694 369 HD12 ILE 50 HD12 ILE 50 -11.109 1.926 3.680 370 HD13 ILE 50 HD13 ILE 50 -10.944 0.342 2.926 371 HA PRO 51 HA PRO 51 -9.032 4.340 -3.315 372 HB2 PRO 51 HB2 PRO 51 -9.119 7.033 -2.936 373 HB3 PRO 51 HB3 PRO 51 -10.263 6.162 -3.965 374 HG2 PRO 51 HG2 PRO 51 -10.589 7.236 -1.227 375 HG3 PRO 51 HG3 PRO 51 -11.773 7.119 -2.530 376 HD2 PRO 51 HD2 PRO 51 -11.650 5.403 -0.374 377 HD3 PRO 51 HD3 PRO 51 -12.402 5.019 -1.935 378 H LEU 52 H LEU 52 -6.906 4.446 -2.999 379 HA LEU 52 HA LEU 52 -5.878 5.709 -0.561 380 HB2 LEU 52 HB2 LEU 52 -5.113 2.982 -1.598 381 HB3 LEU 52 HB3 LEU 52 -4.192 3.857 -0.391 382 HG LEU 52 HG LEU 52 -6.633 3.856 0.781 383 HD11 LEU 52 HD11 LEU 52 -7.653 2.526 -0.983 384 HD12 LEU 52 HD12 LEU 52 -7.612 1.639 0.541 385 HD13 LEU 52 HD13 LEU 52 -6.453 1.260 -0.734 386 HD21 LEU 52 HD21 LEU 52 -4.539 1.696 0.939 387 HD22 LEU 52 HD22 LEU 52 -5.803 1.984 2.137 388 HD23 LEU 52 HD23 LEU 52 -4.567 3.208 1.848 389 H THR 53 H THR 53 -4.213 7.002 -0.897 390 HA THR 53 HA THR 53 -2.872 6.898 -3.530 391 HB THR 53 HB THR 53 -2.906 9.265 -1.651 392 HG1 THR 53 HG1 THR 53 -5.025 8.273 -2.812 393 HG21 THR 53 HG21 THR 53 -2.454 9.000 -4.626 394 HG22 THR 53 HG22 THR 53 -1.215 9.316 -3.408 395 HG23 THR 53 HG23 THR 53 -2.470 10.515 -3.729 396 H ILE 54 H ILE 54 -0.854 6.156 -3.468 397 HA ILE 54 HA ILE 54 0.558 6.198 -0.886 398 HB ILE 54 HB ILE 54 1.022 4.398 -3.268 399 HG12 ILE 54 HG12 ILE 54 -0.281 3.911 -0.582 400 HG13 ILE 54 HG13 ILE 54 -1.043 3.809 -2.166 401 HG21 ILE 54 HG21 ILE 54 2.307 4.419 -0.539 402 HG22 ILE 54 HG22 ILE 54 3.084 4.832 -2.068 403 HG23 ILE 54 HG23 ILE 54 2.546 3.178 -1.770 404 HD11 ILE 54 HD11 ILE 54 -0.595 1.605 -1.245 405 HD12 ILE 54 HD12 ILE 54 1.122 1.994 -1.132 406 HD13 ILE 54 HD13 ILE 54 0.345 1.884 -2.710 407 H PHE 55 H PHE 55 2.248 7.444 -0.673 408 HA PHE 55 HA PHE 55 3.546 8.523 -3.088 409 HB2 PHE 55 HB2 PHE 55 3.378 9.609 -0.271 410 HB3 PHE 55 HB3 PHE 55 4.428 10.281 -1.513 411 HD1 PHE 55 HD1 PHE 55 0.906 9.674 -0.595 412 HD2 PHE 55 HD2 PHE 55 3.603 11.757 -3.139 413 HE1 PHE 55 HE1 PHE 55 -0.942 11.104 -1.381 414 HE2 PHE 55 HE2 PHE 55 1.766 13.190 -3.927 415 HZ PHE 55 HZ PHE 55 -0.509 12.862 -3.051 416 H VAL 56 H VAL 56 5.658 8.197 -3.420 417 HA VAL 56 HA VAL 56 7.104 6.505 -1.530 418 HB VAL 56 HB VAL 56 7.731 7.388 -4.348 419 HG11 VAL 56 HG11 VAL 56 9.481 5.818 -2.453 420 HG12 VAL 56 HG12 VAL 56 9.804 7.432 -3.082 421 HG13 VAL 56 HG13 VAL 56 9.789 6.049 -4.174 422 HG21 VAL 56 HG21 VAL 56 6.159 5.550 -4.118 423 HG22 VAL 56 HG22 VAL 56 7.322 4.678 -3.119 424 HG23 VAL 56 HG23 VAL 56 7.688 5.004 -4.817 425 H GLY 57 H GLY 57 8.268 7.504 0.024 426 HA2 GLY 57 HA2 GLY 57 10.562 8.695 -0.368 427 HA3 GLY 57 HA3 GLY 57 9.496 10.051 -0.660 428 H GLU 58 H GLU 58 11.258 10.479 1.162 429 HA GLU 58 HA GLU 58 10.854 9.279 3.695 430 HB2 GLU 58 HB2 GLU 58 12.396 11.788 3.034 431 HB3 GLU 58 HB3 GLU 58 12.599 10.767 4.453 432 HG2 GLU 58 HG2 GLU 58 13.404 8.952 3.103 433 HG3 GLU 58 HG3 GLU 58 13.061 9.850 1.626 434 H ASN 59 H ASN 59 9.974 12.442 2.358 435 HA ASN 59 HA ASN 59 8.259 13.848 2.882 436 HB2 ASN 59 HB2 ASN 59 6.809 11.948 3.182 437 HB3 ASN 59 HB3 ASN 59 7.469 11.630 4.779 438 HD21 ASN 59 HD21 ASN 59 5.307 13.578 2.910 439 HD22 ASN 59 HD22 ASN 59 4.533 14.362 4.240 440 H THR 60 H THR 60 10.272 12.608 5.409 441 HA THR 60 HA THR 60 11.454 13.702 7.021 442 HB THR 60 HB THR 60 9.710 16.137 6.588 443 HG1 THR 60 HG1 THR 60 11.405 15.093 4.890 444 HG21 THR 60 HG21 THR 60 10.929 16.108 8.721 445 HG22 THR 60 HG22 THR 60 11.559 17.345 7.637 446 HG23 THR 60 HG23 THR 60 12.439 15.831 7.855 447 H GLY 61 H GLY 61 8.073 13.317 6.916 448 HA2 GLY 61 HA2 GLY 61 7.641 13.825 9.736 449 HA3 GLY 61 HA3 GLY 61 6.457 13.215 8.589 450 H VAL 62 H VAL 62 9.513 12.194 10.086 451 HA VAL 62 HA VAL 62 8.692 9.422 9.997 452 HB VAL 62 HB VAL 62 11.021 9.890 9.532 453 HG11 VAL 62 HG11 VAL 62 11.312 11.937 10.792 454 HG12 VAL 62 HG12 VAL 62 12.543 10.761 11.250 455 HG13 VAL 62 HG13 VAL 62 11.164 11.054 12.310 456 HG21 VAL 62 HG21 VAL 62 10.699 8.509 12.194 457 HG22 VAL 62 HG22 VAL 62 12.087 8.359 11.117 458 HG23 VAL 62 HG23 VAL 62 10.507 7.769 10.604 459 H1 GLY 1 H1 GLY 1 -10.362 21.744 3.839 460 H2 GLY 1 H2 GLY 1 -10.380 20.113 4.299 461 H3 GLY 1 H3 GLY 1 -11.789 20.840 3.692 462 HA2 GLY 1 HA2 GLY 1 -10.713 19.406 2.048 463 HA3 GLY 1 HA3 GLY 1 -10.825 21.083 1.534 464 H ALA 2 H ALA 2 -8.550 19.567 3.816 465 HA ALA 2 HA ALA 2 -6.356 19.733 1.977 466 HB1 ALA 2 HB1 ALA 2 -6.596 22.108 2.533 467 HB2 ALA 2 HB2 ALA 2 -5.075 21.448 3.131 468 HB3 ALA 2 HB3 ALA 2 -6.414 21.723 4.244 469 H MET 3 H MET 3 -6.292 17.538 2.675 470 HA MET 3 HA MET 3 -5.064 15.895 3.623 471 HB2 MET 3 HB2 MET 3 -3.278 17.653 3.502 472 HB3 MET 3 HB3 MET 3 -3.646 18.070 5.169 473 HG2 MET 3 HG2 MET 3 -3.015 15.839 5.887 474 HG3 MET 3 HG3 MET 3 -2.695 15.377 4.215 475 HE1 MET 3 HE1 MET 3 0.886 15.564 5.850 476 HE2 MET 3 HE2 MET 3 -0.243 14.547 4.955 477 HE3 MET 3 HE3 MET 3 -0.609 15.024 6.613 478 H GLU 4 H GLU 4 -7.567 16.517 4.777 479 HA GLU 4 HA GLU 4 -7.098 15.834 7.596 480 HB2 GLU 4 HB2 GLU 4 -9.562 16.127 7.856 481 HB3 GLU 4 HB3 GLU 4 -8.729 17.581 7.336 482 HG2 GLU 4 HG2 GLU 4 -10.132 15.734 5.426 483 HG3 GLU 4 HG3 GLU 4 -10.931 17.088 6.222 484 H MET 5 H MET 5 -6.715 14.204 5.157 485 HA MET 5 HA MET 5 -8.568 11.988 5.601 486 HB2 MET 5 HB2 MET 5 -7.388 11.050 3.558 487 HB3 MET 5 HB3 MET 5 -8.324 12.515 3.295 488 HG2 MET 5 HG2 MET 5 -6.344 13.849 3.303 489 HG3 MET 5 HG3 MET 5 -5.355 12.466 3.751 490 HE1 MET 5 HE1 MET 5 -7.631 14.040 0.946 491 HE2 MET 5 HE2 MET 5 -8.339 12.442 1.187 492 HE3 MET 5 HE3 MET 5 -7.508 12.818 -0.322 493 HA PRO 6 HA PRO 6 -5.907 9.639 8.211 494 HB2 PRO 6 HB2 PRO 6 -6.714 7.476 6.313 495 HB3 PRO 6 HB3 PRO 6 -6.670 7.458 8.077 496 HG2 PRO 6 HG2 PRO 6 -8.983 7.759 6.841 497 HG3 PRO 6 HG3 PRO 6 -8.608 8.779 8.247 498 HD2 PRO 6 HD2 PRO 6 -8.559 9.473 5.337 499 HD3 PRO 6 HD3 PRO 6 -9.054 10.464 6.723 500 H THR 7 H THR 7 -3.780 9.407 8.185 501 HA THR 7 HA THR 7 -2.514 8.696 5.635 502 HB THR 7 HB THR 7 -1.184 10.243 7.848 503 HG1 THR 7 HG1 THR 7 -3.150 11.095 6.303 504 HG21 THR 7 HG21 THR 7 0.300 9.144 6.230 505 HG22 THR 7 HG22 THR 7 0.384 10.900 6.109 506 HG23 THR 7 HG23 THR 7 -0.533 9.979 4.917 507 H PHE 8 H PHE 8 -1.105 7.047 5.584 508 HA PHE 8 HA PHE 8 -0.295 5.814 8.139 509 HB2 PHE 8 HB2 PHE 8 -0.941 4.434 5.523 510 HB3 PHE 8 HB3 PHE 8 -0.314 3.642 6.958 511 HD1 PHE 8 HD1 PHE 8 -3.224 5.317 5.477 512 HD2 PHE 8 HD2 PHE 8 -1.746 3.124 8.811 513 HE1 PHE 8 HE1 PHE 8 -5.528 4.944 6.250 514 HE2 PHE 8 HE2 PHE 8 -4.053 2.752 9.593 515 HZ PHE 8 HZ PHE 8 -5.946 3.661 8.309 516 H TYR 9 H TYR 9 1.867 5.193 8.285 517 HA TYR 9 HA TYR 9 3.496 5.702 5.883 518 HB2 TYR 9 HB2 TYR 9 3.595 7.443 7.840 519 HB3 TYR 9 HB3 TYR 9 4.579 6.217 8.632 520 HD1 TYR 9 HD1 TYR 9 6.572 5.276 7.161 521 HD2 TYR 9 HD2 TYR 9 4.630 9.009 6.510 522 HE1 TYR 9 HE1 TYR 9 8.538 6.081 5.910 523 HE2 TYR 9 HE2 TYR 9 6.585 9.814 5.265 524 HH TYR 9 HH TYR 9 8.946 9.360 5.062 525 H LEU 10 H LEU 10 4.656 4.016 5.288 526 HA LEU 10 HA LEU 10 5.663 2.186 7.317 527 HB2 LEU 10 HB2 LEU 10 5.023 0.271 5.715 528 HB3 LEU 10 HB3 LEU 10 3.804 0.936 6.780 529 HG LEU 10 HG LEU 10 3.146 2.404 4.748 530 HD11 LEU 10 HD11 LEU 10 5.059 1.897 3.345 531 HD12 LEU 10 HD12 LEU 10 3.565 1.357 2.580 532 HD13 LEU 10 HD13 LEU 10 4.631 0.187 3.356 533 HD21 LEU 10 HD21 LEU 10 1.667 0.630 3.927 534 HD22 LEU 10 HD22 LEU 10 1.733 0.685 5.690 535 HD23 LEU 10 HD23 LEU 10 2.622 -0.559 4.812 536 H ALA 11 H ALA 11 7.409 0.835 6.568 537 HA ALA 11 HA ALA 11 8.735 1.885 4.157 538 HB1 ALA 11 HB1 ALA 11 10.883 1.506 5.243 539 HB2 ALA 11 HB2 ALA 11 10.053 0.971 6.706 540 HB3 ALA 11 HB3 ALA 11 9.894 2.640 6.161 541 H LEU 12 H LEU 12 9.270 0.446 2.668 542 HA LEU 12 HA LEU 12 8.954 -2.405 3.367 543 HB2 LEU 12 HB2 LEU 12 8.191 -1.099 0.758 544 HB3 LEU 12 HB3 LEU 12 7.921 -2.767 1.216 545 HG LEU 12 HG LEU 12 6.588 -0.378 2.490 546 HD11 LEU 12 HD11 LEU 12 5.824 -0.717 0.217 547 HD12 LEU 12 HD12 LEU 12 4.570 -1.203 1.358 548 HD13 LEU 12 HD13 LEU 12 5.543 -2.428 0.540 549 HD21 LEU 12 HD21 LEU 12 6.866 -2.247 4.040 550 HD22 LEU 12 HD22 LEU 12 6.114 -3.335 2.872 551 HD23 LEU 12 HD23 LEU 12 5.173 -2.032 3.595 552 H HIS 13 H HIS 13 10.445 -3.816 2.508 553 HA HIS 13 HA HIS 13 12.871 -2.706 1.471 554 HB2 HIS 13 HB2 HIS 13 11.932 -5.564 1.783 555 HB3 HIS 13 HB3 HIS 13 13.521 -5.133 1.162 556 HD1 HIS 13 HD1 HIS 13 11.946 -6.104 4.195 557 HD2 HIS 13 HD2 HIS 13 14.895 -3.336 3.192 558 HE1 HIS 13 HE1 HIS 13 13.175 -5.604 6.334 559 HE2 HIS 13 HE2 HIS 13 14.893 -3.862 5.726 560 H GLY 14 H GLY 14 13.444 -2.358 -0.563 561 HA2 GLY 14 HA2 GLY 14 11.521 -2.403 -2.617 562 HA3 GLY 14 HA3 GLY 14 13.233 -2.081 -2.829 563 H GLY 15 H GLY 15 10.692 -4.342 -3.193 564 HA2 GLY 15 HA2 GLY 15 11.017 -5.939 -5.031 565 HA3 GLY 15 HA3 GLY 15 12.600 -6.270 -4.356 566 H GLN 16 H GLN 16 10.607 -5.901 -1.779 567 HA GLN 16 HA GLN 16 10.293 -8.802 -1.541 568 HB2 GLN 16 HB2 GLN 16 10.079 -6.609 0.523 569 HB3 GLN 16 HB3 GLN 16 9.861 -8.322 0.857 570 HG2 GLN 16 HG2 GLN 16 12.377 -6.963 -0.076 571 HG3 GLN 16 HG3 GLN 16 12.065 -7.650 1.516 572 HE21 GLN 16 HE21 GLN 16 14.184 -8.249 -0.364 573 HE22 GLN 16 HE22 GLN 16 14.064 -9.939 -0.714 574 H THR 17 H THR 17 8.314 -9.688 -0.703 575 HA THR 17 HA THR 17 5.984 -8.268 -1.778 576 HB THR 17 HB THR 17 6.088 -11.149 -0.860 577 HG1 THR 17 HG1 THR 17 7.303 -9.994 -3.025 578 HG21 THR 17 HG21 THR 17 3.866 -10.173 -1.203 579 HG22 THR 17 HG22 THR 17 4.216 -11.414 -2.407 580 HG23 THR 17 HG23 THR 17 4.321 -9.707 -2.841 581 H TYR 18 H TYR 18 4.327 -7.669 -0.551 582 HA TYR 18 HA TYR 18 4.302 -8.436 2.282 583 HB2 TYR 18 HB2 TYR 18 3.904 -5.682 1.099 584 HB3 TYR 18 HB3 TYR 18 3.490 -6.098 2.757 585 HD1 TYR 18 HD1 TYR 18 5.236 -6.580 4.392 586 HD2 TYR 18 HD2 TYR 18 6.208 -5.412 0.420 587 HE1 TYR 18 HE1 TYR 18 7.534 -6.112 5.109 588 HE2 TYR 18 HE2 TYR 18 8.518 -4.935 1.119 589 HH TYR 18 HH TYR 18 9.779 -5.945 4.123 590 H HIS 19 H HIS 19 2.283 -8.530 3.247 591 HA HIS 19 HA HIS 19 0.023 -8.768 1.424 592 HB2 HIS 19 HB2 HIS 19 0.721 -9.816 4.092 593 HB3 HIS 19 HB3 HIS 19 -0.962 -9.351 3.901 594 HD1 HIS 19 HD1 HIS 19 0.915 -12.247 3.784 595 HD2 HIS 19 HD2 HIS 19 -1.805 -10.565 1.117 596 HE1 HIS 19 HE1 HIS 19 0.051 -14.159 2.395 597 HE2 HIS 19 HE2 HIS 19 -1.801 -13.154 1.012 598 H LEU 20 H LEU 20 -1.241 -7.123 1.119 599 HA LEU 20 HA LEU 20 -1.278 -4.942 3.082 600 HB2 LEU 20 HB2 LEU 20 -0.456 -4.067 1.073 601 HB3 LEU 20 HB3 LEU 20 -1.517 -5.059 0.097 602 HG LEU 20 HG LEU 20 -3.413 -3.649 0.652 603 HD11 LEU 20 HD11 LEU 20 -1.454 -2.076 2.311 604 HD12 LEU 20 HD12 LEU 20 -2.806 -3.038 2.912 605 HD13 LEU 20 HD13 LEU 20 -3.112 -1.594 1.944 606 HD21 LEU 20 HD21 LEU 20 -2.039 -3.035 -1.261 607 HD22 LEU 20 HD22 LEU 20 -1.005 -2.059 -0.218 608 HD23 LEU 20 HD23 LEU 20 -2.689 -1.598 -0.469 609 H ILE 21 H ILE 21 -3.030 -4.804 4.252 610 HA ILE 21 HA ILE 21 -5.621 -5.496 3.021 611 HB ILE 21 HB ILE 21 -4.880 -5.950 5.922 612 HG12 ILE 21 HG12 ILE 21 -5.479 -8.218 4.095 613 HG13 ILE 21 HG13 ILE 21 -3.907 -7.447 3.916 614 HG21 ILE 21 HG21 ILE 21 -7.253 -5.491 5.563 615 HG22 ILE 21 HG22 ILE 21 -7.008 -7.179 6.010 616 HG23 ILE 21 HG23 ILE 21 -7.323 -6.749 4.329 617 HD11 ILE 21 HD11 ILE 21 -3.386 -7.894 6.224 618 HD12 ILE 21 HD12 ILE 21 -3.848 -9.386 5.406 619 HD13 ILE 21 HD13 ILE 21 -4.992 -8.581 6.481 620 H VAL 22 H VAL 22 -6.934 -3.785 2.987 621 HA VAL 22 HA VAL 22 -6.664 -1.786 5.124 622 HB VAL 22 HB VAL 22 -6.344 -0.847 2.852 623 HG11 VAL 22 HG11 VAL 22 -9.204 -1.681 2.406 624 HG12 VAL 22 HG12 VAL 22 -7.785 -2.341 1.589 625 HG13 VAL 22 HG13 VAL 22 -8.254 -0.662 1.325 626 HG21 VAL 22 HG21 VAL 22 -7.908 1.023 3.083 627 HG22 VAL 22 HG22 VAL 22 -7.197 0.572 4.632 628 HG23 VAL 22 HG23 VAL 22 -8.847 0.089 4.243 629 H ASP 23 H ASP 23 -8.361 -1.475 6.442 630 HA ASP 23 HA ASP 23 -10.883 -2.827 5.791 631 HB2 ASP 23 HB2 ASP 23 -9.509 -4.356 7.154 632 HB3 ASP 23 HB3 ASP 23 -9.354 -3.110 8.383 633 H THR 24 H THR 24 -12.577 -2.206 7.536 634 HA THR 24 HA THR 24 -12.174 0.594 8.334 635 HB THR 24 HB THR 24 -14.752 0.744 7.727 636 HG1 THR 24 HG1 THR 24 -13.723 -1.361 6.138 637 HG21 THR 24 HG21 THR 24 -14.142 1.725 5.567 638 HG22 THR 24 HG22 THR 24 -12.556 0.958 5.661 639 HG23 THR 24 HG23 THR 24 -13.004 2.205 6.826 640 H ASP 25 H ASP 25 -12.895 1.088 10.316 641 HA ASP 25 HA ASP 25 -13.914 -1.085 11.935 642 HB2 ASP 25 HB2 ASP 25 -13.149 0.071 13.757 643 HB3 ASP 25 HB3 ASP 25 -12.142 0.827 12.530 644 H SER 26 H SER 26 -15.610 -0.134 13.726 645 HA SER 26 HA SER 26 -18.048 -0.075 12.390 646 HB2 SER 26 HB2 SER 26 -17.519 0.929 15.191 647 HB3 SER 26 HB3 SER 26 -19.039 0.291 14.557 648 HG SER 26 HG SER 26 -17.658 -1.195 15.825 649 H LEU 27 H LEU 27 -15.985 2.589 13.384 650 HA LEU 27 HA LEU 27 -18.078 4.563 13.092 651 HB2 LEU 27 HB2 LEU 27 -15.104 4.961 13.379 652 HB3 LEU 27 HB3 LEU 27 -16.339 6.188 13.575 653 HG LEU 27 HG LEU 27 -16.051 3.766 15.350 654 HD11 LEU 27 HD11 LEU 27 -15.220 6.623 15.837 655 HD12 LEU 27 HD12 LEU 27 -14.129 5.265 15.553 656 HD13 LEU 27 HD13 LEU 27 -15.137 5.303 17.003 657 HD21 LEU 27 HD21 LEU 27 -18.325 4.635 15.245 658 HD22 LEU 27 HD22 LEU 27 -17.735 6.257 15.610 659 HD23 LEU 27 HD23 LEU 27 -17.595 4.975 16.814 660 H GLY 28 H GLY 28 -15.714 3.081 11.084 661 HA2 GLY 28 HA2 GLY 28 -15.951 3.274 8.689 662 HA3 GLY 28 HA3 GLY 28 -16.441 4.946 8.920 663 H ASN 29 H ASN 29 -13.835 3.879 10.855 664 HA ASN 29 HA ASN 29 -11.968 5.527 9.332 665 HB2 ASN 29 HB2 ASN 29 -11.500 3.976 11.889 666 HB3 ASN 29 HB3 ASN 29 -10.429 5.173 11.191 667 HD21 ASN 29 HD21 ASN 29 -13.350 4.621 12.947 668 HD22 ASN 29 HD22 ASN 29 -13.595 6.266 13.443 669 HA PRO 30 HA PRO 30 -10.258 1.998 7.341 670 HB2 PRO 30 HB2 PRO 30 -8.072 3.533 6.375 671 HB3 PRO 30 HB3 PRO 30 -9.561 3.131 5.521 672 HG2 PRO 30 HG2 PRO 30 -8.790 5.680 6.358 673 HG3 PRO 30 HG3 PRO 30 -10.413 5.195 5.846 674 HD2 PRO 30 HD2 PRO 30 -9.329 5.592 8.584 675 HD3 PRO 30 HD3 PRO 30 -10.975 5.824 7.962 676 H SER 31 H SER 31 -8.693 0.529 7.722 677 HA SER 31 HA SER 31 -6.492 1.293 9.515 678 HB2 SER 31 HB2 SER 31 -8.253 0.044 10.762 679 HB3 SER 31 HB3 SER 31 -8.075 -1.288 9.626 680 HG SER 31 HG SER 31 -6.826 -1.749 11.400 681 H LEU 32 H LEU 32 -4.528 0.361 9.030 682 HA LEU 32 HA LEU 32 -4.476 -1.077 6.457 683 HB2 LEU 32 HB2 LEU 32 -3.591 1.324 6.573 684 HB3 LEU 32 HB3 LEU 32 -2.268 0.666 7.518 685 HG LEU 32 HG LEU 32 -1.803 -0.885 5.573 686 HD11 LEU 32 HD11 LEU 32 -3.650 1.029 4.156 687 HD12 LEU 32 HD12 LEU 32 -3.989 -0.667 4.494 688 HD13 LEU 32 HD13 LEU 32 -2.676 -0.231 3.402 689 HD21 LEU 32 HD21 LEU 32 -1.561 2.070 5.044 690 HD22 LEU 32 HD22 LEU 32 -0.557 0.788 4.367 691 HD23 LEU 32 HD23 LEU 32 -0.491 1.140 6.094 692 H SER 33 H SER 33 -3.489 -2.983 6.414 693 HA SER 33 HA SER 33 -1.596 -3.633 8.566 694 HB2 SER 33 HB2 SER 33 -3.662 -5.514 7.396 695 HB3 SER 33 HB3 SER 33 -2.505 -5.896 8.674 696 HG SER 33 HG SER 33 -3.805 -3.720 9.417 697 H VAL 34 H VAL 34 0.336 -4.064 7.746 698 HA VAL 34 HA VAL 34 0.487 -5.368 5.106 699 HB VAL 34 HB VAL 34 2.249 -3.141 6.154 700 HG11 VAL 34 HG11 VAL 34 3.606 -4.823 5.014 701 HG12 VAL 34 HG12 VAL 34 3.502 -3.338 4.070 702 HG13 VAL 34 HG13 VAL 34 2.537 -4.743 3.615 703 HG21 VAL 34 HG21 VAL 34 1.473 -1.928 4.184 704 HG22 VAL 34 HG22 VAL 34 0.117 -2.408 5.205 705 HG23 VAL 34 HG23 VAL 34 0.467 -3.303 3.725 706 H ILE 35 H ILE 35 1.495 -7.249 5.160 707 HA ILE 35 HA ILE 35 3.440 -7.773 7.320 708 HB ILE 35 HB ILE 35 1.866 -10.048 6.231 709 HG12 ILE 35 HG12 ILE 35 0.766 -8.058 8.222 710 HG13 ILE 35 HG13 ILE 35 0.088 -8.454 6.655 711 HG21 ILE 35 HG21 ILE 35 2.861 -9.350 8.989 712 HG22 ILE 35 HG22 ILE 35 3.716 -10.345 7.810 713 HG23 ILE 35 HG23 ILE 35 2.181 -10.898 8.487 714 HD11 ILE 35 HD11 ILE 35 -1.171 -9.490 8.446 715 HD12 ILE 35 HD12 ILE 35 0.282 -10.314 9.010 716 HD13 ILE 35 HD13 ILE 35 -0.401 -10.709 7.432 717 HA PRO 36 HA PRO 36 6.080 -8.882 3.869 718 HB2 PRO 36 HB2 PRO 36 7.952 -10.230 5.353 719 HB3 PRO 36 HB3 PRO 36 7.917 -8.475 5.170 720 HG2 PRO 36 HG2 PRO 36 6.918 -10.169 7.422 721 HG3 PRO 36 HG3 PRO 36 7.773 -8.615 7.479 722 HD2 PRO 36 HD2 PRO 36 5.108 -8.804 7.842 723 HD3 PRO 36 HD3 PRO 36 5.852 -7.402 7.045 724 H SER 37 H SER 37 6.137 -10.604 2.551 725 HA SER 37 HA SER 37 4.666 -12.950 3.131 726 HB2 SER 37 HB2 SER 37 5.729 -13.760 0.959 727 HB3 SER 37 HB3 SER 37 4.780 -12.277 0.857 728 HG SER 37 HG SER 37 7.616 -12.483 1.028 729 H ASN 38 H ASN 38 8.001 -12.073 3.374 730 HA ASN 38 HA ASN 38 8.559 -14.563 4.756 731 HB2 ASN 38 HB2 ASN 38 10.804 -14.656 3.493 732 HB3 ASN 38 HB3 ASN 38 9.371 -15.255 2.675 733 HD21 ASN 38 HD21 ASN 38 11.791 -14.489 1.464 734 HD22 ASN 38 HD22 ASN 38 11.471 -13.134 0.431 735 HA PRO 39 HA PRO 39 10.109 -11.185 7.287 736 HB2 PRO 39 HB2 PRO 39 10.373 -12.695 9.538 737 HB3 PRO 39 HB3 PRO 39 8.839 -11.998 9.009 738 HG2 PRO 39 HG2 PRO 39 9.879 -14.782 8.655 739 HG3 PRO 39 HG3 PRO 39 8.246 -14.245 9.095 740 HD2 PRO 39 HD2 PRO 39 8.880 -15.030 6.588 741 HD3 PRO 39 HD3 PRO 39 7.682 -13.760 6.908 742 H TYR 40 H TYR 40 11.580 -14.172 6.443 743 HA TYR 40 HA TYR 40 14.039 -13.883 7.808 744 HB2 TYR 40 HB2 TYR 40 13.525 -15.278 5.171 745 HB3 TYR 40 HB3 TYR 40 14.899 -15.539 6.239 746 HD1 TYR 40 HD1 TYR 40 14.620 -16.763 8.346 747 HD2 TYR 40 HD2 TYR 40 11.366 -16.231 5.658 748 HE1 TYR 40 HE1 TYR 40 13.372 -18.528 9.516 749 HE2 TYR 40 HE2 TYR 40 10.111 -17.994 6.823 750 HH TYR 40 HH TYR 40 10.532 -19.923 8.241 751 H GLN 41 H GLN 41 12.813 -12.716 4.741 752 HA GLN 41 HA GLN 41 15.284 -11.557 3.892 753 HB2 GLN 41 HB2 GLN 41 12.437 -11.369 2.973 754 HB3 GLN 41 HB3 GLN 41 13.675 -10.311 2.295 755 HG2 GLN 41 HG2 GLN 41 13.837 -13.314 2.331 756 HG3 GLN 41 HG3 GLN 41 13.233 -12.366 0.971 757 HE21 GLN 41 HE21 GLN 41 16.023 -13.290 2.816 758 HE22 GLN 41 HE22 GLN 41 17.207 -12.686 1.707 759 H GLU 42 H GLU 42 12.718 -10.583 5.969 760 HA GLU 42 HA GLU 42 13.192 -7.782 5.898 761 HB2 GLU 42 HB2 GLU 42 11.932 -9.541 8.008 762 HB3 GLU 42 HB3 GLU 42 11.955 -7.784 8.077 763 HG2 GLU 42 HG2 GLU 42 10.684 -9.417 5.892 764 HG3 GLU 42 HG3 GLU 42 9.828 -8.679 7.246 765 H GLN 43 H GLN 43 14.343 -10.401 7.987 766 HA GLN 43 HA GLN 43 15.965 -8.639 9.573 767 HB2 GLN 43 HB2 GLN 43 16.830 -10.736 10.590 768 HB3 GLN 43 HB3 GLN 43 15.079 -10.622 10.614 769 HG2 GLN 43 HG2 GLN 43 14.965 -12.109 8.670 770 HG3 GLN 43 HG3 GLN 43 16.720 -12.246 8.695 771 HE21 GLN 43 HE21 GLN 43 14.784 -12.086 11.586 772 HE22 GLN 43 HE22 GLN 43 15.058 -13.718 12.089 773 H LEU 44 H LEU 44 16.446 -10.737 6.820 774 HA LEU 44 HA LEU 44 19.299 -10.049 6.746 775 HB2 LEU 44 HB2 LEU 44 17.728 -12.069 5.131 776 HB3 LEU 44 HB3 LEU 44 19.466 -11.829 5.059 777 HG LEU 44 HG LEU 44 18.100 -12.613 7.620 778 HD11 LEU 44 HD11 LEU 44 18.629 -14.931 7.106 779 HD12 LEU 44 HD12 LEU 44 19.187 -14.456 5.502 780 HD13 LEU 44 HD13 LEU 44 17.489 -14.263 5.938 781 HD21 LEU 44 HD21 LEU 44 20.380 -11.753 7.779 782 HD22 LEU 44 HD22 LEU 44 20.915 -12.943 6.589 783 HD23 LEU 44 HD23 LEU 44 20.325 -13.475 8.162 784 H SER 45 H SER 45 18.073 -7.868 6.260 785 HA SER 45 HA SER 45 16.947 -7.598 3.658 786 HB2 SER 45 HB2 SER 45 17.085 -5.097 4.311 787 HB3 SER 45 HB3 SER 45 16.024 -6.155 5.237 788 HG SER 45 HG SER 45 18.682 -5.816 6.086 789 H ASP 46 H ASP 46 18.446 -8.146 2.122 790 HA ASP 46 HA ASP 46 20.917 -6.657 1.861 791 HB2 ASP 46 HB2 ASP 46 21.242 -7.878 -0.175 792 HB3 ASP 46 HB3 ASP 46 20.554 -9.018 0.980 793 H THR 47 H THR 47 17.649 -6.295 1.164 794 HA THR 47 HA THR 47 18.076 -4.269 -0.898 795 HB THR 47 HB THR 47 15.390 -4.512 -0.742 796 HG1 THR 47 HG1 THR 47 16.360 -7.137 -0.175 797 HG21 THR 47 HG21 THR 47 15.556 -6.117 -2.611 798 HG22 THR 47 HG22 THR 47 17.260 -6.366 -2.227 799 HG23 THR 47 HG23 THR 47 16.701 -4.785 -2.774 800 HA PRO 48 HA PRO 48 17.449 -1.112 2.131 801 HB2 PRO 48 HB2 PRO 48 16.921 0.969 0.485 802 HB3 PRO 48 HB3 PRO 48 18.532 0.256 0.627 803 HG2 PRO 48 HG2 PRO 48 16.439 -0.202 -1.465 804 HG3 PRO 48 HG3 PRO 48 18.182 0.049 -1.666 805 HD2 PRO 48 HD2 PRO 48 17.038 -2.407 -1.737 806 HD3 PRO 48 HD3 PRO 48 18.684 -2.135 -1.135 807 H LEU 49 H LEU 49 15.859 0.220 3.077 808 HA LEU 49 HA LEU 49 13.128 -0.570 2.511 809 HB2 LEU 49 HB2 LEU 49 14.400 1.109 4.651 810 HB3 LEU 49 HB3 LEU 49 12.667 1.084 4.430 811 HG LEU 49 HG LEU 49 14.364 -1.325 5.083 812 HD11 LEU 49 HD11 LEU 49 13.317 -1.187 7.277 813 HD12 LEU 49 HD12 LEU 49 12.458 0.275 6.786 814 HD13 LEU 49 HD13 LEU 49 14.218 0.290 6.926 815 HD21 LEU 49 HD21 LEU 49 11.369 -0.982 4.932 816 HD22 LEU 49 HD22 LEU 49 12.223 -2.439 5.442 817 HD23 LEU 49 HD23 LEU 49 12.363 -1.871 3.777 818 H ILE 50 H ILE 50 11.866 0.489 1.171 819 HA ILE 50 HA ILE 50 12.396 3.313 0.611 820 HB ILE 50 HB ILE 50 10.326 1.474 -0.614 821 HG12 ILE 50 HG12 ILE 50 12.906 2.478 -1.829 822 HG13 ILE 50 HG13 ILE 50 12.736 0.895 -1.082 823 HG21 ILE 50 HG21 ILE 50 9.670 3.824 -0.693 824 HG22 ILE 50 HG22 ILE 50 10.101 3.251 -2.305 825 HG23 ILE 50 HG23 ILE 50 11.232 4.251 -1.392 826 HD11 ILE 50 HD11 ILE 50 12.551 0.751 -3.494 827 HD12 ILE 50 HD12 ILE 50 11.207 1.893 -3.472 828 HD13 ILE 50 HD13 ILE 50 11.029 0.306 -2.723 829 HA PRO 51 HA PRO 51 9.143 4.274 3.534 830 HB2 PRO 51 HB2 PRO 51 9.240 6.968 3.164 831 HB3 PRO 51 HB3 PRO 51 10.382 6.087 4.187 832 HG2 PRO 51 HG2 PRO 51 10.710 7.170 1.456 833 HG3 PRO 51 HG3 PRO 51 11.892 7.043 2.757 834 HD2 PRO 51 HD2 PRO 51 11.762 5.336 0.594 835 HD3 PRO 51 HD3 PRO 51 12.513 4.944 2.152 836 H LEU 52 H LEU 52 7.016 4.393 3.224 837 HA LEU 52 HA LEU 52 5.995 5.668 0.788 838 HB2 LEU 52 HB2 LEU 52 5.216 2.936 1.813 839 HB3 LEU 52 HB3 LEU 52 4.297 3.824 0.611 840 HG LEU 52 HG LEU 52 6.733 3.820 -0.567 841 HD11 LEU 52 HD11 LEU 52 7.752 2.485 1.191 842 HD12 LEU 52 HD12 LEU 52 7.710 1.603 -0.335 843 HD13 LEU 52 HD13 LEU 52 6.552 1.218 0.937 844 HD21 LEU 52 HD21 LEU 52 4.634 1.661 -0.730 845 HD22 LEU 52 HD22 LEU 52 5.900 1.947 -1.925 846 HD23 LEU 52 HD23 LEU 52 4.664 3.174 -1.639 847 H THR 53 H THR 53 4.333 6.966 1.130 848 HA THR 53 HA THR 53 2.997 6.857 3.763 849 HB THR 53 HB THR 53 3.051 9.241 1.904 850 HG1 THR 53 HG1 THR 53 5.157 8.220 3.050 851 HG21 THR 53 HG21 THR 53 2.591 8.953 4.874 852 HG22 THR 53 HG22 THR 53 1.357 9.284 3.655 853 HG23 THR 53 HG23 THR 53 2.615 10.475 3.988 854 H ILE 54 H ILE 54 0.973 6.136 3.707 855 HA ILE 54 HA ILE 54 -0.434 6.193 1.126 856 HB ILE 54 HB ILE 54 -0.901 4.378 3.495 857 HG12 ILE 54 HG12 ILE 54 0.389 3.902 0.801 858 HG13 ILE 54 HG13 ILE 54 1.158 3.785 2.382 859 HG21 ILE 54 HG21 ILE 54 -2.191 4.420 0.772 860 HG22 ILE 54 HG22 ILE 54 -2.964 4.832 2.304 861 HG23 ILE 54 HG23 ILE 54 -2.433 3.176 1.999 862 HD11 ILE 54 HD11 ILE 54 0.689 1.590 1.449 863 HD12 ILE 54 HD12 ILE 54 -1.027 1.993 1.349 864 HD13 ILE 54 HD13 ILE 54 -0.238 1.869 2.923 865 H PHE 55 H PHE 55 -2.121 7.448 0.921 866 HA PHE 55 HA PHE 55 -3.411 8.516 3.340 867 HB2 PHE 55 HB2 PHE 55 -3.249 9.620 0.529 868 HB3 PHE 55 HB3 PHE 55 -4.288 10.289 1.782 869 HD1 PHE 55 HD1 PHE 55 -0.766 9.670 0.849 870 HD2 PHE 55 HD2 PHE 55 -3.454 11.753 3.407 871 HE1 PHE 55 HE1 PHE 55 1.088 11.086 1.640 872 HE2 PHE 55 HE2 PHE 55 -1.609 13.171 4.197 873 HZ PHE 55 HZ PHE 55 0.665 12.838 3.321 874 H VAL 56 H VAL 56 -5.528 8.199 3.676 875 HA VAL 56 HA VAL 56 -6.977 6.516 1.778 876 HB VAL 56 HB VAL 56 -7.601 7.396 4.598 877 HG11 VAL 56 HG11 VAL 56 -9.358 5.843 2.695 878 HG12 VAL 56 HG12 VAL 56 -9.674 7.459 3.328 879 HG13 VAL 56 HG13 VAL 56 -9.668 6.071 4.417 880 HG21 VAL 56 HG21 VAL 56 -6.038 5.548 4.358 881 HG22 VAL 56 HG22 VAL 56 -7.207 4.690 3.355 882 HG23 VAL 56 HG23 VAL 56 -7.570 5.010 5.054 883 H GLY 57 H GLY 57 -8.141 7.528 0.224 884 HA2 GLY 57 HA2 GLY 57 -10.424 8.728 0.621 885 HA3 GLY 57 HA3 GLY 57 -9.355 10.080 0.923 886 H GLU 58 H GLU 58 -11.097 10.555 -0.879 887 HA GLU 58 HA GLU 58 -10.724 9.346 -3.423 888 HB2 GLU 58 HB2 GLU 58 -12.252 11.860 -2.753 889 HB3 GLU 58 HB3 GLU 58 -12.461 10.844 -4.174 890 HG2 GLU 58 HG2 GLU 58 -13.277 9.032 -2.828 891 HG3 GLU 58 HG3 GLU 58 -12.932 9.924 -1.349 892 H ASN 59 H ASN 59 -9.828 12.508 -2.080 893 HA ASN 59 HA ASN 59 -8.105 13.901 -2.602 894 HB2 ASN 59 HB2 ASN 59 -6.661 11.997 -2.917 895 HB3 ASN 59 HB3 ASN 59 -7.325 11.692 -4.517 896 HD21 ASN 59 HD21 ASN 59 -5.143 13.595 -2.633 897 HD22 ASN 59 HD22 ASN 59 -4.378 14.397 -3.961 898 H THR 60 H THR 60 -10.122 12.678 -5.129 899 HA THR 60 HA THR 60 -11.306 13.785 -6.739 900 HB THR 60 HB THR 60 -9.559 16.213 -6.276 901 HG1 THR 60 HG1 THR 60 -11.186 15.187 -4.572 902 HG21 THR 60 HG21 THR 60 -10.760 16.199 -8.429 903 HG22 THR 60 HG22 THR 60 -11.384 17.439 -7.341 904 HG23 THR 60 HG23 THR 60 -12.279 15.937 -7.572 905 H GLY 61 H GLY 61 -7.929 13.385 -6.642 906 HA2 GLY 61 HA2 GLY 61 -7.492 13.910 -9.461 907 HA3 GLY 61 HA3 GLY 61 -6.315 13.287 -8.314 908 H VAL 62 H VAL 62 -9.379 12.278 -9.813 909 HA VAL 62 HA VAL 62 -8.569 9.506 -9.711 910 HB VAL 62 HB VAL 62 -10.894 9.975 -9.267 911 HG11 VAL 62 HG11 VAL 62 -11.168 12.038 -10.511 912 HG12 VAL 62 HG12 VAL 62 -12.404 10.875 -10.984 913 HG13 VAL 62 HG13 VAL 62 -11.019 11.164 -12.035 914 HG21 VAL 62 HG21 VAL 62 -10.574 8.612 -11.937 915 HG22 VAL 62 HG22 VAL 62 -11.965 8.465 -10.864 916 HG23 VAL 62 HG23 VAL 62 -10.389 7.860 -10.352 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 13.545 12.189 -5.480 2 H2 GLY 1 H2 GLY 1 13.445 12.926 -3.958 3 H3 GLY 1 H3 GLY 1 14.204 13.735 -5.240 4 HA2 GLY 1 HA2 GLY 1 12.111 13.890 -6.430 5 HA3 GLY 1 HA3 GLY 1 11.320 13.025 -5.118 6 H ALA 2 H ALA 2 12.519 14.203 -2.931 7 HA ALA 2 HA ALA 2 12.366 15.949 -1.513 8 HB1 ALA 2 HB1 ALA 2 13.958 17.001 -3.053 9 HB2 ALA 2 HB2 ALA 2 12.882 18.179 -2.303 10 HB3 ALA 2 HB3 ALA 2 12.611 17.676 -3.972 11 H MET 3 H MET 3 10.792 17.857 -4.023 12 HA MET 3 HA MET 3 8.389 17.915 -2.349 13 HB2 MET 3 HB2 MET 3 9.097 19.644 -4.729 14 HB3 MET 3 HB3 MET 3 7.707 19.857 -3.676 15 HG2 MET 3 HG2 MET 3 9.207 21.450 -2.928 16 HG3 MET 3 HG3 MET 3 9.419 20.121 -1.791 17 HE1 MET 3 HE1 MET 3 10.875 21.938 -4.947 18 HE2 MET 3 HE2 MET 3 10.724 20.267 -5.497 19 HE3 MET 3 HE3 MET 3 12.321 20.983 -5.275 20 H GLU 4 H GLU 4 9.581 16.743 -5.355 21 HA GLU 4 HA GLU 4 6.849 16.143 -6.261 22 HB2 GLU 4 HB2 GLU 4 9.401 16.101 -7.881 23 HB3 GLU 4 HB3 GLU 4 7.765 15.894 -8.493 24 HG2 GLU 4 HG2 GLU 4 7.239 18.189 -7.787 25 HG3 GLU 4 HG3 GLU 4 8.911 18.390 -7.264 26 H MET 5 H MET 5 6.316 14.232 -5.426 27 HA MET 5 HA MET 5 8.170 11.990 -5.867 28 HB2 MET 5 HB2 MET 5 7.107 10.903 -3.882 29 HB3 MET 5 HB3 MET 5 8.018 12.355 -3.492 30 HG2 MET 5 HG2 MET 5 5.915 13.624 -3.426 31 HG3 MET 5 HG3 MET 5 5.030 12.135 -3.743 32 HE1 MET 5 HE1 MET 5 7.459 13.956 -1.232 33 HE2 MET 5 HE2 MET 5 8.252 12.412 -1.540 34 HE3 MET 5 HE3 MET 5 7.577 12.754 0.053 35 HA PRO 6 HA PRO 6 5.116 10.394 -8.572 36 HB2 PRO 6 HB2 PRO 6 5.867 7.738 -8.319 37 HB3 PRO 6 HB3 PRO 6 6.590 8.906 -9.427 38 HG2 PRO 6 HG2 PRO 6 7.558 7.945 -6.790 39 HG3 PRO 6 HG3 PRO 6 8.480 8.380 -8.239 40 HD2 PRO 6 HD2 PRO 6 8.299 9.993 -6.077 41 HD3 PRO 6 HD3 PRO 6 8.450 10.628 -7.731 42 H THR 7 H THR 7 3.087 9.783 -8.305 43 HA THR 7 HA THR 7 2.330 8.788 -5.643 44 HB THR 7 HB THR 7 0.673 10.458 -7.531 45 HG1 THR 7 HG1 THR 7 2.778 11.219 -6.156 46 HG21 THR 7 HG21 THR 7 -0.689 10.899 -5.542 47 HG22 THR 7 HG22 THR 7 0.350 9.832 -4.597 48 HG23 THR 7 HG23 THR 7 -0.629 9.174 -5.910 49 H PHE 8 H PHE 8 1.041 7.044 -5.486 50 HA PHE 8 HA PHE 8 0.039 5.844 -7.989 51 HB2 PHE 8 HB2 PHE 8 0.811 4.483 -5.393 52 HB3 PHE 8 HB3 PHE 8 0.185 3.676 -6.820 53 HD1 PHE 8 HD1 PHE 8 3.038 5.644 -5.522 54 HD2 PHE 8 HD2 PHE 8 1.637 3.018 -8.566 55 HE1 PHE 8 HE1 PHE 8 5.345 5.360 -6.336 56 HE2 PHE 8 HE2 PHE 8 3.945 2.734 -9.384 57 HZ PHE 8 HZ PHE 8 5.798 3.905 -8.271 58 H TYR 9 H TYR 9 -2.100 5.241 -8.076 59 HA TYR 9 HA TYR 9 -3.696 5.691 -5.635 60 HB2 TYR 9 HB2 TYR 9 -3.824 7.484 -7.516 61 HB3 TYR 9 HB3 TYR 9 -4.749 6.273 -8.393 62 HD1 TYR 9 HD1 TYR 9 -4.705 8.513 -5.496 63 HD2 TYR 9 HD2 TYR 9 -7.022 5.736 -7.735 64 HE1 TYR 9 HE1 TYR 9 -6.726 9.284 -4.340 65 HE2 TYR 9 HE2 TYR 9 -9.058 6.497 -6.579 66 HH TYR 9 HH TYR 9 -9.139 9.343 -4.688 67 H LEU 10 H LEU 10 -4.790 3.946 -5.051 68 HA LEU 10 HA LEU 10 -5.806 2.119 -7.088 69 HB2 LEU 10 HB2 LEU 10 -5.051 0.193 -5.551 70 HB3 LEU 10 HB3 LEU 10 -3.876 0.928 -6.622 71 HG LEU 10 HG LEU 10 -3.228 2.361 -4.561 72 HD11 LEU 10 HD11 LEU 10 -3.577 1.230 -2.417 73 HD12 LEU 10 HD12 LEU 10 -4.638 0.067 -3.213 74 HD13 LEU 10 HD13 LEU 10 -5.094 1.767 -3.136 75 HD21 LEU 10 HD21 LEU 10 -1.777 0.715 -5.565 76 HD22 LEU 10 HD22 LEU 10 -2.617 -0.584 -4.717 77 HD23 LEU 10 HD23 LEU 10 -1.686 0.609 -3.809 78 H ALA 11 H ALA 11 -7.493 0.685 -6.276 79 HA ALA 11 HA ALA 11 -8.696 1.671 -3.772 80 HB1 ALA 11 HB1 ALA 11 -9.941 2.518 -5.680 81 HB2 ALA 11 HB2 ALA 11 -10.900 1.373 -4.741 82 HB3 ALA 11 HB3 ALA 11 -10.171 0.871 -6.268 83 H LEU 12 H LEU 12 -9.248 0.188 -2.325 84 HA LEU 12 HA LEU 12 -8.880 -2.637 -3.104 85 HB2 LEU 12 HB2 LEU 12 -8.197 -1.384 -0.445 86 HB3 LEU 12 HB3 LEU 12 -7.866 -3.028 -0.948 87 HG LEU 12 HG LEU 12 -6.596 -0.547 -2.107 88 HD11 LEU 12 HD11 LEU 12 -4.563 -1.373 -1.020 89 HD12 LEU 12 HD12 LEU 12 -5.490 -2.682 -0.290 90 HD13 LEU 12 HD13 LEU 12 -5.831 -1.008 0.149 91 HD21 LEU 12 HD21 LEU 12 -5.126 -2.106 -3.288 92 HD22 LEU 12 HD22 LEU 12 -6.811 -2.307 -3.776 93 HD23 LEU 12 HD23 LEU 12 -6.069 -3.463 -2.669 94 H HIS 13 H HIS 13 -10.252 -4.152 -2.172 95 HA HIS 13 HA HIS 13 -12.804 -3.223 -1.278 96 HB2 HIS 13 HB2 HIS 13 -11.586 -5.994 -1.297 97 HB3 HIS 13 HB3 HIS 13 -13.245 -5.660 -0.827 98 HD1 HIS 13 HD1 HIS 13 -14.817 -6.173 -2.653 99 HD2 HIS 13 HD2 HIS 13 -11.161 -4.828 -4.094 100 HE1 HIS 13 HE1 HIS 13 -15.007 -6.234 -5.163 101 HE2 HIS 13 HE2 HIS 13 -12.699 -5.639 -5.989 102 H GLY 14 H GLY 14 -13.463 -2.777 0.723 103 HA2 GLY 14 HA2 GLY 14 -11.690 -2.591 2.873 104 HA3 GLY 14 HA3 GLY 14 -13.439 -2.499 2.997 105 H GLY 15 H GLY 15 -10.703 -4.215 3.840 106 HA2 GLY 15 HA2 GLY 15 -10.804 -5.811 5.599 107 HA3 GLY 15 HA3 GLY 15 -12.389 -6.295 5.034 108 H GLN 16 H GLN 16 -10.384 -5.978 2.395 109 HA GLN 16 HA GLN 16 -10.041 -8.893 2.335 110 HB2 GLN 16 HB2 GLN 16 -10.092 -6.909 0.058 111 HB3 GLN 16 HB3 GLN 16 -9.904 -8.648 -0.115 112 HG2 GLN 16 HG2 GLN 16 -12.313 -7.160 0.896 113 HG3 GLN 16 HG3 GLN 16 -12.166 -8.074 -0.604 114 HE21 GLN 16 HE21 GLN 16 -12.164 -10.340 -0.512 115 HE22 GLN 16 HE22 GLN 16 -12.745 -11.193 0.873 116 H THR 17 H THR 17 -8.131 -9.766 1.324 117 HA THR 17 HA THR 17 -5.763 -8.269 2.187 118 HB THR 17 HB THR 17 -5.919 -11.174 1.353 119 HG1 THR 17 HG1 THR 17 -7.274 -10.381 3.271 120 HG21 THR 17 HG21 THR 17 -3.880 -11.384 2.692 121 HG22 THR 17 HG22 THR 17 -3.940 -9.661 3.061 122 HG23 THR 17 HG23 THR 17 -3.672 -10.198 1.403 123 H TYR 18 H TYR 18 -4.169 -7.689 0.859 124 HA TYR 18 HA TYR 18 -4.265 -8.499 -1.966 125 HB2 TYR 18 HB2 TYR 18 -3.876 -5.736 -0.815 126 HB3 TYR 18 HB3 TYR 18 -3.395 -6.152 -2.458 127 HD1 TYR 18 HD1 TYR 18 -6.248 -5.663 -0.191 128 HD2 TYR 18 HD2 TYR 18 -5.022 -6.521 -4.173 129 HE1 TYR 18 HE1 TYR 18 -8.537 -5.244 -0.981 130 HE2 TYR 18 HE2 TYR 18 -7.304 -6.112 -4.977 131 HH TYR 18 HH TYR 18 -9.577 -6.086 -4.136 132 H HIS 19 H HIS 19 -2.287 -8.559 -3.033 133 HA HIS 19 HA HIS 19 0.045 -8.815 -1.297 134 HB2 HIS 19 HB2 HIS 19 -0.750 -9.828 -3.964 135 HB3 HIS 19 HB3 HIS 19 0.956 -9.468 -3.752 136 HD1 HIS 19 HD1 HIS 19 -1.074 -12.258 -3.694 137 HD2 HIS 19 HD2 HIS 19 1.652 -10.728 -0.941 138 HE1 HIS 19 HE1 HIS 19 -0.381 -14.209 -2.266 139 HE2 HIS 19 HE2 HIS 19 1.440 -13.304 -0.769 140 H LEU 20 H LEU 20 1.329 -7.194 -1.054 141 HA LEU 20 HA LEU 20 1.307 -4.993 -3.000 142 HB2 LEU 20 HB2 LEU 20 0.533 -4.104 -0.995 143 HB3 LEU 20 HB3 LEU 20 1.556 -5.137 -0.020 144 HG LEU 20 HG LEU 20 3.508 -3.774 -0.613 145 HD11 LEU 20 HD11 LEU 20 2.832 -3.014 -2.803 146 HD12 LEU 20 HD12 LEU 20 3.183 -1.633 -1.764 147 HD13 LEU 20 HD13 LEU 20 1.510 -2.080 -2.100 148 HD21 LEU 20 HD21 LEU 20 1.191 -2.158 0.446 149 HD22 LEU 20 HD22 LEU 20 2.902 -1.799 0.677 150 HD23 LEU 20 HD23 LEU 20 2.202 -3.252 1.390 151 H ILE 21 H ILE 21 3.049 -4.786 -4.181 152 HA ILE 21 HA ILE 21 5.654 -5.586 -3.056 153 HB ILE 21 HB ILE 21 4.798 -5.939 -5.937 154 HG12 ILE 21 HG12 ILE 21 5.396 -8.248 -4.148 155 HG13 ILE 21 HG13 ILE 21 3.830 -7.462 -3.980 156 HG21 ILE 21 HG21 ILE 21 6.890 -7.227 -6.131 157 HG22 ILE 21 HG22 ILE 21 7.284 -6.812 -4.462 158 HG23 ILE 21 HG23 ILE 21 7.184 -5.546 -5.685 159 HD11 ILE 21 HD11 ILE 21 4.933 -8.605 -6.530 160 HD12 ILE 21 HD12 ILE 21 3.338 -7.884 -6.303 161 HD13 ILE 21 HD13 ILE 21 3.754 -9.386 -5.478 162 H VAL 22 H VAL 22 7.053 -3.935 -3.050 163 HA VAL 22 HA VAL 22 6.729 -1.836 -5.092 164 HB VAL 22 HB VAL 22 6.441 -0.962 -2.795 165 HG11 VAL 22 HG11 VAL 22 7.844 -2.508 -1.570 166 HG12 VAL 22 HG12 VAL 22 8.388 -0.854 -1.283 167 HG13 VAL 22 HG13 VAL 22 9.277 -1.900 -2.397 168 HG21 VAL 22 HG21 VAL 22 7.311 0.510 -4.514 169 HG22 VAL 22 HG22 VAL 22 8.954 -0.029 -4.171 170 HG23 VAL 22 HG23 VAL 22 8.052 0.882 -2.959 171 H ASP 23 H ASP 23 8.401 -1.487 -6.435 172 HA ASP 23 HA ASP 23 11.024 -2.569 -5.747 173 HB2 ASP 23 HB2 ASP 23 11.268 -3.790 -7.786 174 HB3 ASP 23 HB3 ASP 23 9.765 -4.314 -7.047 175 H THR 24 H THR 24 12.655 -1.848 -7.528 176 HA THR 24 HA THR 24 11.921 0.897 -8.270 177 HB THR 24 HB THR 24 14.624 1.037 -8.045 178 HG1 THR 24 HG1 THR 24 15.323 -0.494 -6.766 179 HG21 THR 24 HG21 THR 24 12.592 1.483 -5.854 180 HG22 THR 24 HG22 THR 24 12.999 2.624 -7.136 181 HG23 THR 24 HG23 THR 24 14.204 2.194 -5.922 182 H ASP 25 H ASP 25 12.184 1.511 -10.229 183 HA ASP 25 HA ASP 25 13.152 -0.162 -12.322 184 HB2 ASP 25 HB2 ASP 25 11.448 1.284 -12.986 185 HB3 ASP 25 HB3 ASP 25 12.095 2.634 -12.063 186 H SER 26 H SER 26 14.873 0.570 -13.833 187 HA SER 26 HA SER 26 17.303 0.588 -12.438 188 HB2 SER 26 HB2 SER 26 16.879 -0.401 -14.712 189 HB3 SER 26 HB3 SER 26 16.911 1.236 -15.367 190 HG SER 26 HG SER 26 19.038 0.187 -13.824 191 H LEU 27 H LEU 27 15.376 3.222 -13.661 192 HA LEU 27 HA LEU 27 17.551 5.132 -13.550 193 HB2 LEU 27 HB2 LEU 27 14.583 5.626 -13.783 194 HB3 LEU 27 HB3 LEU 27 15.856 6.793 -14.075 195 HG LEU 27 HG LEU 27 15.443 4.300 -15.723 196 HD11 LEU 27 HD11 LEU 27 14.477 5.777 -17.397 197 HD12 LEU 27 HD12 LEU 27 14.640 7.147 -16.299 198 HD13 LEU 27 HD13 LEU 27 13.539 5.828 -15.900 199 HD21 LEU 27 HD21 LEU 27 17.730 5.168 -15.732 200 HD22 LEU 27 HD22 LEU 27 17.122 6.763 -16.181 201 HD23 LEU 27 HD23 LEU 27 16.945 5.406 -17.291 202 H GLY 28 H GLY 28 15.491 3.666 -11.340 203 HA2 GLY 28 HA2 GLY 28 15.785 4.040 -8.991 204 HA3 GLY 28 HA3 GLY 28 16.109 5.735 -9.337 205 H ASN 29 H ASN 29 13.545 4.469 -11.145 206 HA ASN 29 HA ASN 29 11.640 6.037 -9.623 207 HB2 ASN 29 HB2 ASN 29 11.271 4.421 -12.154 208 HB3 ASN 29 HB3 ASN 29 10.057 5.466 -11.430 209 HD21 ASN 29 HD21 ASN 29 12.848 5.279 -13.394 210 HD22 ASN 29 HD22 ASN 29 12.974 6.971 -13.762 211 HA PRO 30 HA PRO 30 10.260 2.446 -7.393 212 HB2 PRO 30 HB2 PRO 30 8.162 3.600 -6.128 213 HB3 PRO 30 HB3 PRO 30 9.837 3.888 -5.648 214 HG2 PRO 30 HG2 PRO 30 8.013 5.593 -7.282 215 HG3 PRO 30 HG3 PRO 30 9.177 6.069 -6.034 216 HD2 PRO 30 HD2 PRO 30 9.664 6.267 -8.719 217 HD3 PRO 30 HD3 PRO 30 10.938 6.060 -7.503 218 H SER 31 H SER 31 8.659 0.939 -7.542 219 HA SER 31 HA SER 31 6.485 1.442 -9.452 220 HB2 SER 31 HB2 SER 31 8.055 0.245 -10.748 221 HB3 SER 31 HB3 SER 31 8.513 -0.775 -9.394 222 HG SER 31 HG SER 31 6.994 -2.108 -9.895 223 H LEU 32 H LEU 32 4.568 0.356 -8.987 224 HA LEU 32 HA LEU 32 4.537 -1.013 -6.382 225 HB2 LEU 32 HB2 LEU 32 3.649 1.361 -6.398 226 HB3 LEU 32 HB3 LEU 32 2.346 0.778 -7.415 227 HG LEU 32 HG LEU 32 1.788 -0.859 -5.573 228 HD11 LEU 32 HD11 LEU 32 2.609 -0.302 -3.333 229 HD12 LEU 32 HD12 LEU 32 3.683 0.909 -4.035 230 HD13 LEU 32 HD13 LEU 32 3.919 -0.798 -4.407 231 HD21 LEU 32 HD21 LEU 32 1.609 2.067 -4.880 232 HD22 LEU 32 HD22 LEU 32 0.555 0.774 -4.303 233 HD23 LEU 32 HD23 LEU 32 0.545 1.225 -6.006 234 H SER 33 H SER 33 3.524 -2.907 -6.329 235 HA SER 33 HA SER 33 1.618 -3.551 -8.473 236 HB2 SER 33 HB2 SER 33 3.674 -5.468 -7.340 237 HB3 SER 33 HB3 SER 33 2.546 -5.781 -8.661 238 HG SER 33 HG SER 33 3.871 -3.597 -9.295 239 H VAL 34 H VAL 34 -0.305 -4.053 -7.637 240 HA VAL 34 HA VAL 34 -0.394 -5.339 -4.988 241 HB VAL 34 HB VAL 34 -2.176 -3.099 -5.966 242 HG11 VAL 34 HG11 VAL 34 -2.435 -4.775 -3.469 243 HG12 VAL 34 HG12 VAL 34 -3.537 -4.783 -4.844 244 HG13 VAL 34 HG13 VAL 34 -3.386 -3.339 -3.844 245 HG21 VAL 34 HG21 VAL 34 -1.378 -1.943 -3.958 246 HG22 VAL 34 HG22 VAL 34 -0.046 -2.369 -5.034 247 HG23 VAL 34 HG23 VAL 34 -0.344 -3.325 -3.582 248 H ILE 35 H ILE 35 -1.398 -7.199 -5.021 249 HA ILE 35 HA ILE 35 -3.266 -7.773 -7.239 250 HB ILE 35 HB ILE 35 -1.722 -9.963 -5.919 251 HG12 ILE 35 HG12 ILE 35 -0.631 -8.201 -8.126 252 HG13 ILE 35 HG13 ILE 35 -0.003 -8.299 -6.490 253 HG21 ILE 35 HG21 ILE 35 -2.740 -9.507 -8.718 254 HG22 ILE 35 HG22 ILE 35 -3.515 -10.485 -7.472 255 HG23 ILE 35 HG23 ILE 35 -1.957 -10.978 -8.139 256 HD11 ILE 35 HD11 ILE 35 1.375 -9.558 -8.037 257 HD12 ILE 35 HD12 ILE 35 -0.021 -10.530 -8.508 258 HD13 ILE 35 HD13 ILE 35 0.610 -10.631 -6.865 259 HA PRO 36 HA PRO 36 -6.173 -8.724 -3.956 260 HB2 PRO 36 HB2 PRO 36 -7.856 -10.262 -5.500 261 HB3 PRO 36 HB3 PRO 36 -7.916 -8.500 -5.414 262 HG2 PRO 36 HG2 PRO 36 -6.663 -10.259 -7.479 263 HG3 PRO 36 HG3 PRO 36 -7.564 -8.746 -7.691 264 HD2 PRO 36 HD2 PRO 36 -4.876 -8.838 -7.826 265 HD3 PRO 36 HD3 PRO 36 -5.732 -7.433 -7.152 266 H SER 37 H SER 37 -6.206 -10.330 -2.487 267 HA SER 37 HA SER 37 -4.644 -12.663 -2.803 268 HB2 SER 37 HB2 SER 37 -5.200 -11.523 -0.615 269 HB3 SER 37 HB3 SER 37 -6.812 -12.225 -0.737 270 HG SER 37 HG SER 37 -6.033 -14.163 -0.315 271 H ASN 38 H ASN 38 -7.939 -11.903 -3.465 272 HA ASN 38 HA ASN 38 -8.217 -14.495 -4.762 273 HB2 ASN 38 HB2 ASN 38 -9.357 -14.754 -2.590 274 HB3 ASN 38 HB3 ASN 38 -10.342 -13.337 -2.940 275 HD21 ASN 38 HD21 ASN 38 -9.725 -16.668 -3.741 276 HD22 ASN 38 HD22 ASN 38 -11.201 -16.939 -4.595 277 HA PRO 39 HA PRO 39 -9.114 -11.296 -7.772 278 HB2 PRO 39 HB2 PRO 39 -9.334 -13.020 -9.895 279 HB3 PRO 39 HB3 PRO 39 -7.802 -12.407 -9.269 280 HG2 PRO 39 HG2 PRO 39 -9.142 -15.030 -8.758 281 HG3 PRO 39 HG3 PRO 39 -7.426 -14.684 -9.048 282 HD2 PRO 39 HD2 PRO 39 -8.389 -15.136 -6.573 283 HD3 PRO 39 HD3 PRO 39 -7.071 -13.985 -6.870 284 H TYR 40 H TYR 40 -11.109 -13.994 -6.928 285 HA TYR 40 HA TYR 40 -13.267 -13.270 -8.689 286 HB2 TYR 40 HB2 TYR 40 -13.101 -15.252 -6.412 287 HB3 TYR 40 HB3 TYR 40 -14.527 -15.031 -7.426 288 HD1 TYR 40 HD1 TYR 40 -11.071 -16.283 -7.322 289 HD2 TYR 40 HD2 TYR 40 -14.560 -15.817 -9.714 290 HE1 TYR 40 HE1 TYR 40 -10.139 -17.846 -8.977 291 HE2 TYR 40 HE2 TYR 40 -13.636 -17.377 -11.375 292 HH TYR 40 HH TYR 40 -11.498 -18.236 -12.105 293 H GLN 41 H GLN 41 -12.242 -12.448 -5.491 294 HA GLN 41 HA GLN 41 -14.712 -11.424 -4.527 295 HB2 GLN 41 HB2 GLN 41 -11.841 -10.827 -3.810 296 HB3 GLN 41 HB3 GLN 41 -13.197 -10.062 -2.997 297 HG2 GLN 41 HG2 GLN 41 -12.733 -13.030 -3.127 298 HG3 GLN 41 HG3 GLN 41 -12.272 -11.995 -1.777 299 HE21 GLN 41 HE21 GLN 41 -14.115 -14.251 -1.868 300 HE22 GLN 41 HE22 GLN 41 -15.641 -13.649 -1.315 301 H GLU 42 H GLU 42 -12.293 -10.256 -6.698 302 HA GLU 42 HA GLU 42 -13.021 -7.512 -6.663 303 HB2 GLU 42 HB2 GLU 42 -11.664 -9.163 -8.805 304 HB3 GLU 42 HB3 GLU 42 -11.813 -7.411 -8.836 305 HG2 GLU 42 HG2 GLU 42 -10.301 -9.061 -6.826 306 HG3 GLU 42 HG3 GLU 42 -9.623 -8.009 -8.070 307 H GLN 43 H GLN 43 -14.179 -10.339 -8.356 308 HA GLN 43 HA GLN 43 -15.863 -8.860 -10.170 309 HB2 GLN 43 HB2 GLN 43 -15.966 -11.797 -9.454 310 HB3 GLN 43 HB3 GLN 43 -16.685 -11.035 -10.863 311 HG2 GLN 43 HG2 GLN 43 -14.480 -10.509 -11.727 312 HG3 GLN 43 HG3 GLN 43 -13.738 -11.219 -10.295 313 HE21 GLN 43 HE21 GLN 43 -16.557 -12.562 -11.840 314 HE22 GLN 43 HE22 GLN 43 -15.789 -13.984 -12.453 315 H LEU 44 H LEU 44 -16.254 -10.744 -7.218 316 HA LEU 44 HA LEU 44 -19.092 -10.094 -7.069 317 HB2 LEU 44 HB2 LEU 44 -17.374 -11.713 -5.183 318 HB3 LEU 44 HB3 LEU 44 -19.125 -11.633 -5.189 319 HG LEU 44 HG LEU 44 -17.485 -12.761 -7.458 320 HD11 LEU 44 HD11 LEU 44 -17.191 -14.107 -5.451 321 HD12 LEU 44 HD12 LEU 44 -18.183 -14.954 -6.639 322 HD13 LEU 44 HD13 LEU 44 -18.939 -14.194 -5.237 323 HD21 LEU 44 HD21 LEU 44 -20.436 -12.886 -6.843 324 HD22 LEU 44 HD22 LEU 44 -19.628 -13.694 -8.185 325 HD23 LEU 44 HD23 LEU 44 -19.682 -11.933 -8.120 326 H SER 45 H SER 45 -18.245 -7.758 -6.901 327 HA SER 45 HA SER 45 -17.004 -7.067 -4.396 328 HB2 SER 45 HB2 SER 45 -17.305 -4.695 -5.354 329 HB3 SER 45 HB3 SER 45 -16.194 -5.793 -6.172 330 HG SER 45 HG SER 45 -18.768 -4.950 -6.956 331 H ASP 46 H ASP 46 -18.942 -8.015 -3.222 332 HA ASP 46 HA ASP 46 -21.032 -6.021 -2.808 333 HB2 ASP 46 HB2 ASP 46 -21.941 -7.550 -1.156 334 HB3 ASP 46 HB3 ASP 46 -21.550 -8.460 -2.611 335 H THR 47 H THR 47 -17.925 -6.283 -2.157 336 HA THR 47 HA THR 47 -17.994 -4.971 0.454 337 HB THR 47 HB THR 47 -15.372 -5.141 -0.147 338 HG1 THR 47 HG1 THR 47 -16.193 -7.615 -1.156 339 HG21 THR 47 HG21 THR 47 -16.412 -6.027 1.881 340 HG22 THR 47 HG22 THR 47 -15.306 -7.208 1.182 341 HG23 THR 47 HG23 THR 47 -17.045 -7.396 0.968 342 HA PRO 48 HA PRO 48 -17.590 -1.079 -1.688 343 HB2 PRO 48 HB2 PRO 48 -16.849 0.429 0.463 344 HB3 PRO 48 HB3 PRO 48 -18.515 -0.070 0.154 345 HG2 PRO 48 HG2 PRO 48 -16.492 -1.258 2.010 346 HG3 PRO 48 HG3 PRO 48 -18.220 -0.966 2.277 347 HD2 PRO 48 HD2 PRO 48 -17.238 -3.407 1.663 348 HD3 PRO 48 HD3 PRO 48 -18.843 -2.871 1.132 349 H LEU 49 H LEU 49 -15.961 0.053 -2.638 350 HA LEU 49 HA LEU 49 -13.243 -0.811 -2.106 351 HB2 LEU 49 HB2 LEU 49 -14.395 1.053 -4.176 352 HB3 LEU 49 HB3 LEU 49 -12.682 0.734 -4.012 353 HG LEU 49 HG LEU 49 -14.817 -1.243 -4.797 354 HD11 LEU 49 HD11 LEU 49 -14.157 0.296 -6.559 355 HD12 LEU 49 HD12 LEU 49 -13.526 -1.320 -6.886 356 HD13 LEU 49 HD13 LEU 49 -12.453 -0.062 -6.257 357 HD21 LEU 49 HD21 LEU 49 -11.861 -1.659 -4.362 358 HD22 LEU 49 HD22 LEU 49 -12.980 -2.840 -5.047 359 HD23 LEU 49 HD23 LEU 49 -13.161 -2.321 -3.371 360 H ILE 50 H ILE 50 -11.855 0.241 -0.861 361 HA ILE 50 HA ILE 50 -12.311 3.106 -0.390 362 HB ILE 50 HB ILE 50 -10.379 1.267 1.043 363 HG12 ILE 50 HG12 ILE 50 -12.963 2.455 2.074 364 HG13 ILE 50 HG13 ILE 50 -12.826 0.813 1.456 365 HG21 ILE 50 HG21 ILE 50 -10.177 3.170 2.616 366 HG22 ILE 50 HG22 ILE 50 -11.195 4.133 1.542 367 HG23 ILE 50 HG23 ILE 50 -9.620 3.569 0.990 368 HD11 ILE 50 HD11 ILE 50 -11.355 1.936 3.829 369 HD12 ILE 50 HD12 ILE 50 -11.215 0.289 3.211 370 HD13 ILE 50 HD13 ILE 50 -12.746 0.851 3.880 371 HA PRO 51 HA PRO 51 -8.926 3.649 -3.264 372 HB2 PRO 51 HB2 PRO 51 -9.064 6.332 -3.365 373 HB3 PRO 51 HB3 PRO 51 -10.245 5.307 -4.188 374 HG2 PRO 51 HG2 PRO 51 -10.480 6.737 -1.570 375 HG3 PRO 51 HG3 PRO 51 -11.671 6.580 -2.867 376 HD2 PRO 51 HD2 PRO 51 -11.697 5.050 -0.606 377 HD3 PRO 51 HD3 PRO 51 -12.359 4.517 -2.164 378 H LEU 52 H LEU 52 -6.820 3.907 -2.884 379 HA LEU 52 HA LEU 52 -5.976 5.375 -0.477 380 HB2 LEU 52 HB2 LEU 52 -5.055 2.668 -1.432 381 HB3 LEU 52 HB3 LEU 52 -4.154 3.622 -0.262 382 HG LEU 52 HG LEU 52 -6.565 3.573 0.945 383 HD11 LEU 52 HD11 LEU 52 -6.362 0.964 -0.541 384 HD12 LEU 52 HD12 LEU 52 -7.598 2.200 -0.763 385 HD13 LEU 52 HD13 LEU 52 -7.496 1.322 0.762 386 HD21 LEU 52 HD21 LEU 52 -4.439 1.446 1.116 387 HD22 LEU 52 HD22 LEU 52 -5.681 1.753 2.329 388 HD23 LEU 52 HD23 LEU 52 -4.465 2.981 1.984 389 H THR 53 H THR 53 -4.243 6.655 -0.712 390 HA THR 53 HA THR 53 -3.022 6.750 -3.400 391 HB THR 53 HB THR 53 -3.122 9.009 -1.389 392 HG1 THR 53 HG1 THR 53 -5.218 8.015 -2.443 393 HG21 THR 53 HG21 THR 53 -1.445 9.221 -3.158 394 HG22 THR 53 HG22 THR 53 -2.740 10.399 -3.376 395 HG23 THR 53 HG23 THR 53 -2.692 8.951 -4.379 396 H ILE 54 H ILE 54 -1.006 6.035 -3.451 397 HA ILE 54 HA ILE 54 0.533 6.045 -0.947 398 HB ILE 54 HB ILE 54 0.875 4.268 -3.365 399 HG12 ILE 54 HG12 ILE 54 -0.243 3.747 -0.600 400 HG13 ILE 54 HG13 ILE 54 -1.128 3.689 -2.121 401 HG21 ILE 54 HG21 ILE 54 2.296 4.220 -0.704 402 HG22 ILE 54 HG22 ILE 54 2.997 4.742 -2.236 403 HG23 ILE 54 HG23 ILE 54 2.509 3.062 -2.015 404 HD11 ILE 54 HD11 ILE 54 0.179 1.763 -2.814 405 HD12 ILE 54 HD12 ILE 54 -0.630 1.464 -1.278 406 HD13 ILE 54 HD13 ILE 54 1.095 1.833 -1.312 407 H PHE 55 H PHE 55 2.237 7.248 -0.789 408 HA PHE 55 HA PHE 55 3.460 8.383 -3.221 409 HB2 PHE 55 HB2 PHE 55 3.404 9.449 -0.390 410 HB3 PHE 55 HB3 PHE 55 4.340 10.146 -1.702 411 HD1 PHE 55 HD1 PHE 55 0.897 9.388 -0.600 412 HD2 PHE 55 HD2 PHE 55 3.382 11.696 -3.162 413 HE1 PHE 55 HE1 PHE 55 -1.033 10.791 -1.203 414 HE2 PHE 55 HE2 PHE 55 1.462 13.109 -3.767 415 HZ PHE 55 HZ PHE 55 -0.752 12.656 -2.788 416 H VAL 56 H VAL 56 5.655 8.153 -3.498 417 HA VAL 56 HA VAL 56 7.009 6.280 -1.770 418 HB VAL 56 HB VAL 56 7.318 6.315 -4.276 419 HG11 VAL 56 HG11 VAL 56 8.914 7.924 -5.201 420 HG12 VAL 56 HG12 VAL 56 8.944 8.772 -3.655 421 HG13 VAL 56 HG13 VAL 56 7.458 8.719 -4.602 422 HG21 VAL 56 HG21 VAL 56 8.840 5.127 -2.814 423 HG22 VAL 56 HG22 VAL 56 9.766 6.604 -2.555 424 HG23 VAL 56 HG23 VAL 56 9.724 5.860 -4.153 425 H GLY 57 H GLY 57 8.660 6.736 -0.360 426 HA2 GLY 57 HA2 GLY 57 9.220 9.601 0.065 427 HA3 GLY 57 HA3 GLY 57 9.195 8.401 1.349 428 H GLU 58 H GLU 58 11.338 10.162 0.816 429 HA GLU 58 HA GLU 58 13.391 8.211 0.022 430 HB2 GLU 58 HB2 GLU 58 14.839 10.266 -0.380 431 HB3 GLU 58 HB3 GLU 58 13.546 9.971 -1.532 432 HG2 GLU 58 HG2 GLU 58 12.163 11.633 -0.318 433 HG3 GLU 58 HG3 GLU 58 13.561 11.989 0.698 434 H ASN 59 H ASN 59 12.565 7.805 2.398 435 HA ASN 59 HA ASN 59 13.105 7.584 4.579 436 HB2 ASN 59 HB2 ASN 59 15.340 7.044 3.630 437 HB3 ASN 59 HB3 ASN 59 15.783 8.741 3.772 438 HD21 ASN 59 HD21 ASN 59 16.271 9.589 5.770 439 HD22 ASN 59 HD22 ASN 59 16.488 8.609 7.179 440 H THR 60 H THR 60 11.523 9.201 5.070 441 HA THR 60 HA THR 60 12.747 11.694 6.048 442 HB THR 60 HB THR 60 10.342 12.559 6.026 443 HG1 THR 60 HG1 THR 60 8.830 11.392 5.047 444 HG21 THR 60 HG21 THR 60 10.431 13.109 3.635 445 HG22 THR 60 HG22 THR 60 11.658 11.865 3.396 446 HG23 THR 60 HG23 THR 60 12.012 13.276 4.392 447 H GLY 61 H GLY 61 11.958 8.784 7.113 448 HA2 GLY 61 HA2 GLY 61 10.390 9.378 9.438 449 HA3 GLY 61 HA3 GLY 61 11.273 7.887 9.128 450 H VAL 62 H VAL 62 13.804 9.213 8.695 451 HA VAL 62 HA VAL 62 14.364 10.339 11.342 452 HB VAL 62 HB VAL 62 16.626 9.187 11.234 453 HG11 VAL 62 HG11 VAL 62 14.867 8.466 12.761 454 HG12 VAL 62 HG12 VAL 62 15.768 7.080 12.151 455 HG13 VAL 62 HG13 VAL 62 14.173 7.448 11.499 456 HG21 VAL 62 HG21 VAL 62 16.582 8.552 8.868 457 HG22 VAL 62 HG22 VAL 62 15.214 7.483 9.176 458 HG23 VAL 62 HG23 VAL 62 16.784 7.137 9.903 459 H1 GLY 1 H1 GLY 1 -13.376 12.217 5.743 460 H2 GLY 1 H2 GLY 1 -13.288 12.972 4.226 461 H3 GLY 1 H3 GLY 1 -14.031 13.765 5.530 462 HA2 GLY 1 HA2 GLY 1 -11.939 13.906 6.701 463 HA3 GLY 1 HA3 GLY 1 -11.157 13.048 5.383 464 H ALA 2 H ALA 2 -12.346 14.253 3.206 465 HA ALA 2 HA ALA 2 -12.175 16.009 1.804 466 HB1 ALA 2 HB1 ALA 2 -13.766 17.061 3.342 467 HB2 ALA 2 HB2 ALA 2 -12.673 18.239 2.614 468 HB3 ALA 2 HB3 ALA 2 -12.420 17.713 4.277 469 H MET 3 H MET 3 -10.602 17.892 4.326 470 HA MET 3 HA MET 3 -8.191 17.950 2.666 471 HB2 MET 3 HB2 MET 3 -8.897 19.665 5.055 472 HB3 MET 3 HB3 MET 3 -7.506 19.879 4.005 473 HG2 MET 3 HG2 MET 3 -8.999 21.483 3.269 474 HG3 MET 3 HG3 MET 3 -9.212 20.163 2.123 475 HE1 MET 3 HE1 MET 3 -10.677 21.967 5.282 476 HE2 MET 3 HE2 MET 3 -10.534 20.295 5.825 477 HE3 MET 3 HE3 MET 3 -12.127 21.017 5.596 478 H GLU 4 H GLU 4 -9.397 16.744 5.649 479 HA GLU 4 HA GLU 4 -6.672 16.131 6.568 480 HB2 GLU 4 HB2 GLU 4 -9.235 16.090 8.168 481 HB3 GLU 4 HB3 GLU 4 -7.605 15.868 8.792 482 HG2 GLU 4 HG2 GLU 4 -7.060 18.169 8.107 483 HG3 GLU 4 HG3 GLU 4 -8.729 18.381 7.576 484 H MET 5 H MET 5 -6.136 14.227 5.721 485 HA MET 5 HA MET 5 -8.015 11.995 6.139 486 HB2 MET 5 HB2 MET 5 -6.958 10.919 4.147 487 HB3 MET 5 HB3 MET 5 -7.854 12.383 3.766 488 HG2 MET 5 HG2 MET 5 -5.736 13.630 3.722 489 HG3 MET 5 HG3 MET 5 -4.868 12.130 4.029 490 HE1 MET 5 HE1 MET 5 -7.267 13.995 1.516 491 HE2 MET 5 HE2 MET 5 -8.077 12.459 1.816 492 HE3 MET 5 HE3 MET 5 -7.395 12.799 0.227 493 HA PRO 6 HA PRO 6 -4.977 10.358 8.843 494 HB2 PRO 6 HB2 PRO 6 -5.741 7.706 8.563 495 HB3 PRO 6 HB3 PRO 6 -6.465 8.868 9.678 496 HG2 PRO 6 HG2 PRO 6 -7.429 7.934 7.029 497 HG3 PRO 6 HG3 PRO 6 -8.355 8.361 8.480 498 HD2 PRO 6 HD2 PRO 6 -8.154 9.993 6.330 499 HD3 PRO 6 HD3 PRO 6 -8.315 10.611 7.988 500 H THR 7 H THR 7 -2.952 9.724 8.576 501 HA THR 7 HA THR 7 -2.195 8.760 5.898 502 HB THR 7 HB THR 7 -0.538 10.396 7.812 503 HG1 THR 7 HG1 THR 7 -2.640 11.186 6.445 504 HG21 THR 7 HG21 THR 7 0.830 10.863 5.830 505 HG22 THR 7 HG22 THR 7 -0.210 9.809 4.869 506 HG23 THR 7 HG23 THR 7 0.761 9.134 6.178 507 H PHE 8 H PHE 8 -0.909 7.007 5.732 508 HA PHE 8 HA PHE 8 0.074 5.787 8.230 509 HB2 PHE 8 HB2 PHE 8 -0.696 4.445 5.626 510 HB3 PHE 8 HB3 PHE 8 -0.078 3.624 7.048 511 HD1 PHE 8 HD1 PHE 8 -2.916 5.613 5.754 512 HD2 PHE 8 HD2 PHE 8 -1.541 2.963 8.786 513 HE1 PHE 8 HE1 PHE 8 -5.227 5.339 6.559 514 HE2 PHE 8 HE2 PHE 8 -3.852 2.685 9.597 515 HZ PHE 8 HZ PHE 8 -5.695 3.875 8.483 516 H TYR 9 H TYR 9 2.205 5.153 8.320 517 HA TYR 9 HA TYR 9 3.819 5.627 5.893 518 HB2 TYR 9 HB2 TYR 9 3.945 7.409 7.786 519 HB3 TYR 9 HB3 TYR 9 4.864 6.191 8.660 520 HD1 TYR 9 HD1 TYR 9 4.842 8.450 5.774 521 HD2 TYR 9 HD2 TYR 9 7.132 5.643 8.001 522 HE1 TYR 9 HE1 TYR 9 6.873 9.220 4.631 523 HE2 TYR 9 HE2 TYR 9 9.177 6.401 6.861 524 HH TYR 9 HH TYR 9 9.284 9.257 4.978 525 H LEU 10 H LEU 10 4.899 3.888 5.301 526 HA LEU 10 HA LEU 10 5.902 2.035 7.318 527 HB2 LEU 10 HB2 LEU 10 5.141 0.130 5.765 528 HB3 LEU 10 HB3 LEU 10 3.967 0.864 6.835 529 HG LEU 10 HG LEU 10 3.333 2.312 4.786 530 HD11 LEU 10 HD11 LEU 10 3.684 1.200 2.637 531 HD12 LEU 10 HD12 LEU 10 4.733 0.021 3.422 532 HD13 LEU 10 HD13 LEU 10 5.202 1.719 3.364 533 HD21 LEU 10 HD21 LEU 10 1.876 0.664 5.776 534 HD22 LEU 10 HD22 LEU 10 2.712 -0.629 4.916 535 HD23 LEU 10 HD23 LEU 10 1.785 0.574 4.018 536 H ALA 11 H ALA 11 7.591 0.606 6.504 537 HA ALA 11 HA ALA 11 8.811 1.596 4.009 538 HB1 ALA 11 HB1 ALA 11 10.052 2.417 5.933 539 HB2 ALA 11 HB2 ALA 11 11.008 1.276 4.988 540 HB3 ALA 11 HB3 ALA 11 10.269 0.762 6.505 541 H LEU 12 H LEU 12 9.355 0.121 2.554 542 HA LEU 12 HA LEU 12 8.963 -2.707 3.308 543 HB2 LEU 12 HB2 LEU 12 8.300 -1.426 0.657 544 HB3 LEU 12 HB3 LEU 12 7.955 -3.072 1.144 545 HG LEU 12 HG LEU 12 6.690 -0.595 2.316 546 HD11 LEU 12 HD11 LEU 12 4.659 -1.403 1.213 547 HD12 LEU 12 HD12 LEU 12 5.582 -2.713 0.479 548 HD13 LEU 12 HD13 LEU 12 5.933 -1.037 0.050 549 HD21 LEU 12 HD21 LEU 12 5.211 -2.156 3.482 550 HD22 LEU 12 HD22 LEU 12 6.891 -2.369 3.974 551 HD23 LEU 12 HD23 LEU 12 6.149 -3.513 2.856 552 H HIS 13 H HIS 13 10.324 -4.223 2.366 553 HA HIS 13 HA HIS 13 12.884 -3.296 1.491 554 HB2 HIS 13 HB2 HIS 13 11.662 -6.062 1.482 555 HB3 HIS 13 HB3 HIS 13 13.324 -5.726 1.023 556 HD1 HIS 13 HD1 HIS 13 14.882 -6.278 2.845 557 HD2 HIS 13 HD2 HIS 13 11.233 -4.918 4.293 558 HE1 HIS 13 HE1 HIS 13 15.069 -6.357 5.354 559 HE2 HIS 13 HE2 HIS 13 12.764 -5.756 6.187 560 H GLY 14 H GLY 14 13.555 -2.843 -0.504 561 HA2 GLY 14 HA2 GLY 14 11.785 -2.625 -2.657 562 HA3 GLY 14 HA3 GLY 14 13.534 -2.539 -2.775 563 H GLY 15 H GLY 15 10.799 -4.236 -3.648 564 HA2 GLY 15 HA2 GLY 15 10.893 -5.821 -5.408 565 HA3 GLY 15 HA3 GLY 15 12.477 -6.318 -4.851 566 H GLN 16 H GLN 16 10.460 -6.009 -2.212 567 HA GLN 16 HA GLN 16 10.111 -8.926 -2.175 568 HB2 GLN 16 HB2 GLN 16 10.168 -6.960 0.116 569 HB3 GLN 16 HB3 GLN 16 9.971 -8.699 0.277 570 HG2 GLN 16 HG2 GLN 16 12.389 -7.213 -0.713 571 HG3 GLN 16 HG3 GLN 16 12.233 -8.145 0.775 572 HE21 GLN 16 HE21 GLN 16 12.222 -10.403 0.658 573 HE22 GLN 16 HE22 GLN 16 12.808 -11.246 -0.732 574 H THR 17 H THR 17 8.191 -9.801 -1.185 575 HA THR 17 HA THR 17 5.838 -8.279 -2.035 576 HB THR 17 HB THR 17 5.972 -11.194 -1.226 577 HG1 THR 17 HG1 THR 17 7.322 -10.361 -3.157 578 HG21 THR 17 HG21 THR 17 3.933 -11.382 -2.563 579 HG22 THR 17 HG22 THR 17 4.004 -9.657 -2.926 580 HG23 THR 17 HG23 THR 17 3.733 -10.201 -1.271 581 H TYR 18 H TYR 18 4.240 -7.701 -0.713 582 HA TYR 18 HA TYR 18 4.321 -8.531 2.107 583 HB2 TYR 18 HB2 TYR 18 3.959 -5.759 0.973 584 HB3 TYR 18 HB3 TYR 18 3.463 -6.182 2.609 585 HD1 TYR 18 HD1 TYR 18 6.329 -5.694 0.365 586 HD2 TYR 18 HD2 TYR 18 5.084 -6.579 4.333 587 HE1 TYR 18 HE1 TYR 18 8.617 -5.292 1.167 588 HE2 TYR 18 HE2 TYR 18 7.361 -6.186 5.151 589 HH TYR 18 HH TYR 18 9.645 -6.168 4.310 590 H HIS 19 H HIS 19 2.342 -8.601 3.164 591 HA HIS 19 HA HIS 19 0.011 -8.821 1.423 592 HB2 HIS 19 HB2 HIS 19 0.788 -9.860 4.087 593 HB3 HIS 19 HB3 HIS 19 -0.914 -9.488 3.871 594 HD1 HIS 19 HD1 HIS 19 1.097 -12.289 3.796 595 HD2 HIS 19 HD2 HIS 19 -1.609 -10.720 1.050 596 HE1 HIS 19 HE1 HIS 19 0.403 -14.224 2.346 597 HE2 HIS 19 HE2 HIS 19 -1.408 -13.295 0.852 598 H LEU 20 H LEU 20 -1.264 -7.188 1.191 599 HA LEU 20 HA LEU 20 -1.234 -5.006 3.157 600 HB2 LEU 20 HB2 LEU 20 -0.450 -4.106 1.161 601 HB3 LEU 20 HB3 LEU 20 -1.476 -5.127 0.177 602 HG LEU 20 HG LEU 20 -3.421 -3.754 0.773 603 HD11 LEU 20 HD11 LEU 20 -2.741 -3.018 2.968 604 HD12 LEU 20 HD12 LEU 20 -3.085 -1.626 1.941 605 HD13 LEU 20 HD13 LEU 20 -1.415 -2.084 2.273 606 HD21 LEU 20 HD21 LEU 20 -1.093 -2.144 -0.268 607 HD22 LEU 20 HD22 LEU 20 -2.801 -1.774 -0.503 608 HD23 LEU 20 HD23 LEU 20 -2.104 -3.225 -1.226 609 H ILE 21 H ILE 21 -2.979 -4.790 4.333 610 HA ILE 21 HA ILE 21 -5.583 -5.573 3.195 611 HB ILE 21 HB ILE 21 -4.738 -5.958 6.078 612 HG12 ILE 21 HG12 ILE 21 -5.343 -8.248 4.263 613 HG13 ILE 21 HG13 ILE 21 -3.774 -7.467 4.111 614 HG21 ILE 21 HG21 ILE 21 -6.839 -7.231 6.255 615 HG22 ILE 21 HG22 ILE 21 -7.227 -6.803 4.588 616 HG23 ILE 21 HG23 ILE 21 -7.119 -5.545 5.821 617 HD11 ILE 21 HD11 ILE 21 -4.890 -8.625 6.649 618 HD12 ILE 21 HD12 ILE 21 -3.289 -7.915 6.426 619 HD13 ILE 21 HD13 ILE 21 -3.717 -9.409 5.591 620 H VAL 22 H VAL 22 -6.970 -3.920 3.199 621 HA VAL 22 HA VAL 22 -6.644 -1.837 5.254 622 HB VAL 22 HB VAL 22 -6.341 -0.946 2.965 623 HG11 VAL 22 HG11 VAL 22 -7.748 -2.474 1.722 624 HG12 VAL 22 HG12 VAL 22 -8.281 -0.815 1.447 625 HG13 VAL 22 HG13 VAL 22 -9.183 -1.861 2.546 626 HG21 VAL 22 HG21 VAL 22 -7.210 0.515 4.694 627 HG22 VAL 22 HG22 VAL 22 -8.855 -0.013 4.337 628 HG23 VAL 22 HG23 VAL 22 -7.944 0.906 3.139 629 H ASP 23 H ASP 23 -8.320 -1.486 6.594 630 HA ASP 23 HA ASP 23 -10.945 -2.550 5.887 631 HB2 ASP 23 HB2 ASP 23 -11.198 -3.797 7.909 632 HB3 ASP 23 HB3 ASP 23 -9.688 -4.310 7.175 633 H THR 24 H THR 24 -12.580 -1.831 7.662 634 HA THR 24 HA THR 24 -11.836 0.903 8.439 635 HB THR 24 HB THR 24 -14.535 1.055 8.211 636 HG1 THR 24 HG1 THR 24 -15.246 -0.445 6.903 637 HG21 THR 24 HG21 THR 24 -12.500 1.501 6.024 638 HG22 THR 24 HG22 THR 24 -12.907 2.637 7.311 639 HG23 THR 24 HG23 THR 24 -14.111 2.215 6.092 640 H ASP 25 H ASP 25 -12.093 1.496 10.407 641 HA ASP 25 HA ASP 25 -13.087 -0.185 12.482 642 HB2 ASP 25 HB2 ASP 25 -11.380 1.246 13.167 643 HB3 ASP 25 HB3 ASP 25 -12.007 2.602 12.242 644 H SER 26 H SER 26 -14.809 0.533 13.986 645 HA SER 26 HA SER 26 -17.233 0.589 12.591 646 HB2 SER 26 HB2 SER 26 -16.808 -0.430 14.853 647 HB3 SER 26 HB3 SER 26 -16.847 1.199 15.527 648 HG SER 26 HG SER 26 -18.972 0.236 13.937 649 H LEU 27 H LEU 27 -15.290 3.200 13.833 650 HA LEU 27 HA LEU 27 -17.454 5.126 13.739 651 HB2 LEU 27 HB2 LEU 27 -14.486 5.607 13.985 652 HB3 LEU 27 HB3 LEU 27 -15.757 6.774 14.287 653 HG LEU 27 HG LEU 27 -15.360 4.262 15.907 654 HD11 LEU 27 HD11 LEU 27 -14.388 5.715 17.597 655 HD12 LEU 27 HD12 LEU 27 -14.541 7.099 16.514 656 HD13 LEU 27 HD13 LEU 27 -13.447 5.776 16.103 657 HD21 LEU 27 HD21 LEU 27 -17.644 5.143 15.918 658 HD22 LEU 27 HD22 LEU 27 -17.031 6.729 16.387 659 HD23 LEU 27 HD23 LEU 27 -16.863 5.356 17.485 660 H GLY 28 H GLY 28 -15.404 3.666 11.520 661 HA2 GLY 28 HA2 GLY 28 -15.683 4.062 9.173 662 HA3 GLY 28 HA3 GLY 28 -15.997 5.755 9.531 663 H ASN 29 H ASN 29 -13.450 4.452 11.333 664 HA ASN 29 HA ASN 29 -11.533 6.022 9.831 665 HB2 ASN 29 HB2 ASN 29 -11.171 4.386 12.348 666 HB3 ASN 29 HB3 ASN 29 -9.957 5.441 11.636 667 HD21 ASN 29 HD21 ASN 29 -12.761 5.231 13.593 668 HD22 ASN 29 HD22 ASN 29 -12.866 6.914 13.991 669 HA PRO 30 HA PRO 30 -10.158 2.446 7.577 670 HB2 PRO 30 HB2 PRO 30 -8.055 3.599 6.326 671 HB3 PRO 30 HB3 PRO 30 -9.731 3.905 5.849 672 HG2 PRO 30 HG2 PRO 30 -7.897 5.581 7.507 673 HG3 PRO 30 HG3 PRO 30 -9.050 6.080 6.258 674 HD2 PRO 30 HD2 PRO 30 -9.555 6.253 8.942 675 HD3 PRO 30 HD3 PRO 30 -10.821 6.063 7.714 676 H SER 31 H SER 31 -8.568 0.935 7.718 677 HA SER 31 HA SER 31 -6.398 1.407 9.639 678 HB2 SER 31 HB2 SER 31 -7.977 0.206 10.925 679 HB3 SER 31 HB3 SER 31 -8.444 -0.796 9.560 680 HG SER 31 HG SER 31 -6.943 -2.148 10.052 681 H LEU 32 H LEU 32 -4.490 0.317 9.165 682 HA LEU 32 HA LEU 32 -4.454 -1.036 6.554 683 HB2 LEU 32 HB2 LEU 32 -3.553 1.335 6.598 684 HB3 LEU 32 HB3 LEU 32 -2.259 0.732 7.615 685 HG LEU 32 HG LEU 32 -1.702 -0.888 5.761 686 HD11 LEU 32 HD11 LEU 32 -2.508 -0.310 3.524 687 HD12 LEU 32 HD12 LEU 32 -3.579 0.901 4.229 688 HD13 LEU 32 HD13 LEU 32 -3.825 -0.808 4.588 689 HD21 LEU 32 HD21 LEU 32 -1.502 2.042 5.095 690 HD22 LEU 32 HD22 LEU 32 -0.455 0.747 4.508 691 HD23 LEU 32 HD23 LEU 32 -0.446 1.184 6.217 692 H SER 33 H SER 33 -3.448 -2.935 6.489 693 HA SER 33 HA SER 33 -1.555 -3.602 8.640 694 HB2 SER 33 HB2 SER 33 -3.614 -5.497 7.482 695 HB3 SER 33 HB3 SER 33 -2.500 -5.828 8.810 696 HG SER 33 HG SER 33 -3.808 -3.644 9.461 697 H VAL 34 H VAL 34 0.374 -4.092 7.791 698 HA VAL 34 HA VAL 34 0.458 -5.374 5.147 699 HB VAL 34 HB VAL 34 2.250 -3.153 6.144 700 HG11 VAL 34 HG11 VAL 34 2.502 -4.816 3.636 701 HG12 VAL 34 HG12 VAL 34 3.606 -4.836 5.012 702 HG13 VAL 34 HG13 VAL 34 3.461 -3.385 4.018 703 HG21 VAL 34 HG21 VAL 34 1.455 -1.976 4.147 704 HG22 VAL 34 HG22 VAL 34 0.121 -2.410 5.216 705 HG23 VAL 34 HG23 VAL 34 0.421 -3.350 3.753 706 H ILE 35 H ILE 35 1.452 -7.239 5.166 707 HA ILE 35 HA ILE 35 3.310 -7.841 7.381 708 HB ILE 35 HB ILE 35 1.757 -10.014 6.043 709 HG12 ILE 35 HG12 ILE 35 0.670 -8.261 8.258 710 HG13 ILE 35 HG13 ILE 35 0.042 -8.347 6.619 711 HG21 ILE 35 HG21 ILE 35 2.762 -9.584 8.848 712 HG22 ILE 35 HG22 ILE 35 3.546 -10.550 7.599 713 HG23 ILE 35 HG23 ILE 35 1.983 -11.049 8.252 714 HD11 ILE 35 HD11 ILE 35 -1.340 -9.611 8.163 715 HD12 ILE 35 HD12 ILE 35 0.051 -10.592 8.622 716 HD13 ILE 35 HD13 ILE 35 -0.582 -10.674 6.978 717 HA PRO 36 HA PRO 36 6.220 -8.780 4.098 718 HB2 PRO 36 HB2 PRO 36 7.893 -10.341 5.634 719 HB3 PRO 36 HB3 PRO 36 7.958 -8.577 5.564 720 HG2 PRO 36 HG2 PRO 36 6.693 -10.346 7.613 721 HG3 PRO 36 HG3 PRO 36 7.601 -8.840 7.835 722 HD2 PRO 36 HD2 PRO 36 4.912 -8.922 7.966 723 HD3 PRO 36 HD3 PRO 36 5.780 -7.518 7.309 724 H SER 37 H SER 37 6.258 -10.381 2.621 725 HA SER 37 HA SER 37 4.682 -12.712 2.908 726 HB2 SER 37 HB2 SER 37 5.254 -11.551 0.735 727 HB3 SER 37 HB3 SER 37 6.861 -12.260 0.857 728 HG SER 37 HG SER 37 6.050 -14.221 0.475 729 H ASN 38 H ASN 38 7.973 -11.969 3.601 730 HA ASN 38 HA ASN 38 8.240 -14.574 4.871 731 HB2 ASN 38 HB2 ASN 38 9.386 -14.818 2.701 732 HB3 ASN 38 HB3 ASN 38 10.375 -13.408 3.068 733 HD21 ASN 38 HD21 ASN 38 9.723 -16.736 3.836 734 HD22 ASN 38 HD22 ASN 38 11.195 -17.027 4.700 735 HA PRO 39 HA PRO 39 9.136 -11.402 7.905 736 HB2 PRO 39 HB2 PRO 39 9.351 -13.148 10.011 737 HB3 PRO 39 HB3 PRO 39 7.821 -12.518 9.393 738 HG2 PRO 39 HG2 PRO 39 9.143 -15.144 8.857 739 HG3 PRO 39 HG3 PRO 39 7.431 -14.789 9.147 740 HD2 PRO 39 HD2 PRO 39 8.397 -15.227 6.674 741 HD3 PRO 39 HD3 PRO 39 7.087 -14.067 6.976 742 H TYR 40 H TYR 40 11.120 -14.105 7.056 743 HA TYR 40 HA TYR 40 13.275 -13.403 8.823 744 HB2 TYR 40 HB2 TYR 40 13.114 -15.370 6.535 745 HB3 TYR 40 HB3 TYR 40 14.535 -15.162 7.556 746 HD1 TYR 40 HD1 TYR 40 11.075 -16.386 7.427 747 HD2 TYR 40 HD2 TYR 40 14.556 -15.970 9.837 748 HE1 TYR 40 HE1 TYR 40 10.125 -17.959 9.059 749 HE2 TYR 40 HE2 TYR 40 13.615 -17.538 11.476 750 HH TYR 40 HH TYR 40 11.473 -18.388 12.186 751 H GLN 41 H GLN 41 12.266 -12.556 5.631 752 HA GLN 41 HA GLN 41 14.744 -11.539 4.685 753 HB2 GLN 41 HB2 GLN 41 11.881 -10.913 3.961 754 HB3 GLN 41 HB3 GLN 41 13.250 -10.152 3.161 755 HG2 GLN 41 HG2 GLN 41 12.758 -13.117 3.262 756 HG3 GLN 41 HG3 GLN 41 12.317 -12.066 1.917 757 HE21 GLN 41 HE21 GLN 41 14.135 -14.342 1.998 758 HE22 GLN 41 HE22 GLN 41 15.664 -13.752 1.440 759 H GLU 42 H GLU 42 12.323 -10.364 6.845 760 HA GLU 42 HA GLU 42 13.070 -7.627 6.839 761 HB2 GLU 42 HB2 GLU 42 11.693 -9.287 8.961 762 HB3 GLU 42 HB3 GLU 42 11.850 -7.536 9.008 763 HG2 GLU 42 HG2 GLU 42 10.335 -9.162 6.977 764 HG3 GLU 42 HG3 GLU 42 9.659 -8.118 8.229 765 H GLN 43 H GLN 43 14.204 -10.473 8.518 766 HA GLN 43 HA GLN 43 15.889 -9.020 10.351 767 HB2 GLN 43 HB2 GLN 43 15.973 -11.950 9.604 768 HB3 GLN 43 HB3 GLN 43 16.696 -11.209 11.024 769 HG2 GLN 43 HG2 GLN 43 14.485 -10.669 11.882 770 HG3 GLN 43 HG3 GLN 43 13.751 -11.375 10.441 771 HE21 GLN 43 HE21 GLN 43 16.570 -12.749 11.981 772 HE22 GLN 43 HE22 GLN 43 15.780 -14.176 12.577 773 H LEU 44 H LEU 44 16.279 -10.885 7.390 774 HA LEU 44 HA LEU 44 19.120 -10.250 7.248 775 HB2 LEU 44 HB2 LEU 44 17.400 -11.843 5.345 776 HB3 LEU 44 HB3 LEU 44 19.151 -11.774 5.356 777 HG LEU 44 HG LEU 44 17.500 -12.908 7.613 778 HD11 LEU 44 HD11 LEU 44 17.202 -14.239 5.599 779 HD12 LEU 44 HD12 LEU 44 18.189 -15.100 6.781 780 HD13 LEU 44 HD13 LEU 44 18.952 -14.332 5.388 781 HD21 LEU 44 HD21 LEU 44 20.453 -13.044 7.006 782 HD22 LEU 44 HD22 LEU 44 19.636 -13.857 8.340 783 HD23 LEU 44 HD23 LEU 44 19.698 -12.096 8.286 784 H SER 45 H SER 45 18.299 -7.906 7.092 785 HA SER 45 HA SER 45 17.061 -7.192 4.594 786 HB2 SER 45 HB2 SER 45 17.381 -4.827 5.577 787 HB3 SER 45 HB3 SER 45 16.248 -5.926 6.364 788 HG SER 45 HG SER 45 18.838 -5.144 7.198 789 H ASP 46 H ASP 46 18.998 -8.138 3.422 790 HA ASP 46 HA ASP 46 21.102 -6.157 3.021 791 HB2 ASP 46 HB2 ASP 46 21.993 -7.682 1.355 792 HB3 ASP 46 HB3 ASP 46 21.607 -8.594 2.809 793 H THR 47 H THR 47 17.985 -6.399 2.355 794 HA THR 47 HA THR 47 18.078 -5.053 -0.240 795 HB THR 47 HB THR 47 15.454 -5.204 0.342 796 HG1 THR 47 HG1 THR 47 16.247 -7.694 1.355 797 HG21 THR 47 HG21 THR 47 16.496 -6.096 -1.682 798 HG22 THR 47 HG22 THR 47 15.374 -7.267 -0.991 799 HG23 THR 47 HG23 THR 47 17.111 -7.474 -0.769 800 HA PRO 48 HA PRO 48 17.684 -1.175 1.931 801 HB2 PRO 48 HB2 PRO 48 16.957 0.352 -0.208 802 HB3 PRO 48 HB3 PRO 48 18.620 -0.156 0.099 803 HG2 PRO 48 HG2 PRO 48 16.599 -1.316 -1.771 804 HG3 PRO 48 HG3 PRO 48 18.331 -1.035 -2.028 805 HD2 PRO 48 HD2 PRO 48 17.327 -3.476 -1.436 806 HD3 PRO 48 HD3 PRO 48 18.936 -2.953 -0.898 807 H LEU 49 H LEU 49 16.056 -0.043 2.882 808 HA LEU 49 HA LEU 49 13.336 -0.896 2.338 809 HB2 LEU 49 HB2 LEU 49 14.494 0.948 4.422 810 HB3 LEU 49 HB3 LEU 49 12.782 0.640 4.252 811 HG LEU 49 HG LEU 49 14.901 -1.353 5.033 812 HD11 LEU 49 HD11 LEU 49 14.243 0.173 6.802 813 HD12 LEU 49 HD12 LEU 49 13.602 -1.441 7.115 814 HD13 LEU 49 HD13 LEU 49 12.540 -0.175 6.492 815 HD21 LEU 49 HD21 LEU 49 11.946 -1.758 4.582 816 HD22 LEU 49 HD22 LEU 49 13.058 -2.945 5.262 817 HD23 LEU 49 HD23 LEU 49 13.249 -2.414 3.592 818 H ILE 50 H ILE 50 11.957 0.173 1.098 819 HA ILE 50 HA ILE 50 12.434 3.039 0.652 820 HB ILE 50 HB ILE 50 10.498 1.224 -0.804 821 HG12 ILE 50 HG12 ILE 50 13.087 2.410 -1.821 822 HG13 ILE 50 HG13 ILE 50 12.948 0.767 -1.213 823 HG21 ILE 50 HG21 ILE 50 10.314 3.142 -2.366 824 HG22 ILE 50 HG22 ILE 50 11.327 4.090 -1.274 825 HG23 ILE 50 HG23 ILE 50 9.746 3.526 -0.740 826 HD11 ILE 50 HD11 ILE 50 11.485 1.909 -3.582 827 HD12 ILE 50 HD12 ILE 50 11.329 0.261 -2.977 828 HD13 ILE 50 HD13 ILE 50 12.869 0.817 -3.636 829 HA PRO 51 HA PRO 51 9.036 3.582 3.515 830 HB2 PRO 51 HB2 PRO 51 9.188 6.262 3.639 831 HB3 PRO 51 HB3 PRO 51 10.363 5.222 4.456 832 HG2 PRO 51 HG2 PRO 51 10.612 6.674 1.851 833 HG3 PRO 51 HG3 PRO 51 11.794 6.504 3.153 834 HD2 PRO 51 HD2 PRO 51 11.829 4.991 0.882 835 HD3 PRO 51 HD3 PRO 51 12.479 4.446 2.441 836 H LEU 52 H LEU 52 6.935 3.859 3.131 837 HA LEU 52 HA LEU 52 6.107 5.344 0.729 838 HB2 LEU 52 HB2 LEU 52 5.171 2.634 1.665 839 HB3 LEU 52 HB3 LEU 52 4.276 3.597 0.499 840 HG LEU 52 HG LEU 52 6.691 3.545 -0.704 841 HD11 LEU 52 HD11 LEU 52 6.474 0.929 0.761 842 HD12 LEU 52 HD12 LEU 52 7.713 2.162 1.001 843 HD13 LEU 52 HD13 LEU 52 7.615 1.297 -0.532 844 HD21 LEU 52 HD21 LEU 52 4.559 1.428 -0.890 845 HD22 LEU 52 HD22 LEU 52 5.803 1.738 -2.100 846 HD23 LEU 52 HD23 LEU 52 4.586 2.966 -1.752 847 H THR 53 H THR 53 4.386 6.637 0.977 848 HA THR 53 HA THR 53 3.160 6.713 3.663 849 HB THR 53 HB THR 53 3.272 8.984 1.667 850 HG1 THR 53 HG1 THR 53 5.354 7.965 2.728 851 HG21 THR 53 HG21 THR 53 1.592 9.192 3.434 852 HG22 THR 53 HG22 THR 53 2.891 10.364 3.663 853 HG23 THR 53 HG23 THR 53 2.836 8.910 4.657 854 H ILE 54 H ILE 54 1.135 6.008 3.706 855 HA ILE 54 HA ILE 54 -0.393 6.046 1.197 856 HB ILE 54 HB ILE 54 -0.754 4.246 3.596 857 HG12 ILE 54 HG12 ILE 54 0.367 3.745 0.830 858 HG13 ILE 54 HG13 ILE 54 1.250 3.671 2.352 859 HG21 ILE 54 HG21 ILE 54 -2.167 4.240 0.929 860 HG22 ILE 54 HG22 ILE 54 -2.868 4.747 2.467 861 HG23 ILE 54 HG23 ILE 54 -2.392 3.065 2.225 862 HD11 ILE 54 HD11 ILE 54 -0.072 1.744 3.029 863 HD12 ILE 54 HD12 ILE 54 0.743 1.451 1.493 864 HD13 ILE 54 HD13 ILE 54 -0.978 1.828 1.518 865 H PHE 55 H PHE 55 -2.095 7.253 1.040 866 HA PHE 55 HA PHE 55 -3.321 8.376 3.476 867 HB2 PHE 55 HB2 PHE 55 -3.248 9.467 0.655 868 HB3 PHE 55 HB3 PHE 55 -4.184 10.160 1.971 869 HD1 PHE 55 HD1 PHE 55 -0.739 9.385 0.877 870 HD2 PHE 55 HD2 PHE 55 -3.223 11.694 3.438 871 HE1 PHE 55 HE1 PHE 55 1.196 10.776 1.498 872 HE2 PHE 55 HE2 PHE 55 -1.297 13.094 4.061 873 HZ PHE 55 HZ PHE 55 0.920 12.633 3.089 874 H VAL 56 H VAL 56 -5.512 8.166 3.741 875 HA VAL 56 HA VAL 56 -6.866 6.300 1.998 876 HB VAL 56 HB VAL 56 -7.189 6.327 4.502 877 HG11 VAL 56 HG11 VAL 56 -8.779 7.936 5.431 878 HG12 VAL 56 HG12 VAL 56 -8.799 8.798 3.893 879 HG13 VAL 56 HG13 VAL 56 -7.316 8.725 4.845 880 HG21 VAL 56 HG21 VAL 56 -8.716 5.163 3.018 881 HG22 VAL 56 HG22 VAL 56 -9.634 6.647 2.778 882 HG23 VAL 56 HG23 VAL 56 -9.596 5.881 4.366 883 H GLY 57 H GLY 57 -8.525 6.779 0.596 884 HA2 GLY 57 HA2 GLY 57 -9.055 9.649 0.177 885 HA3 GLY 57 HA3 GLY 57 -9.037 8.452 -1.111 886 H GLU 58 H GLU 58 -11.169 10.232 -0.559 887 HA GLU 58 HA GLU 58 -13.238 8.286 0.198 888 HB2 GLU 58 HB2 GLU 58 -14.673 10.345 0.612 889 HB3 GLU 58 HB3 GLU 58 -13.391 10.031 1.771 890 HG2 GLU 58 HG2 GLU 58 -11.987 11.698 0.578 891 HG3 GLU 58 HG3 GLU 58 -13.378 12.069 -0.444 892 H ASN 59 H ASN 59 -12.424 7.882 -2.171 893 HA ASN 59 HA ASN 59 -12.948 7.695 -4.357 894 HB2 ASN 59 HB2 ASN 59 -15.182 7.153 -3.419 895 HB3 ASN 59 HB3 ASN 59 -15.625 8.852 -3.546 896 HD21 ASN 59 HD21 ASN 59 -16.095 9.719 -5.547 897 HD22 ASN 59 HD22 ASN 59 -16.306 8.748 -6.960 898 H THR 60 H THR 60 -11.359 9.305 -4.830 899 HA THR 60 HA THR 60 -12.552 11.820 -5.796 900 HB THR 60 HB THR 60 -10.144 12.668 -5.756 901 HG1 THR 60 HG1 THR 60 -8.640 11.486 -4.765 902 HG21 THR 60 HG21 THR 60 -10.241 13.199 -3.362 903 HG22 THR 60 HG22 THR 60 -11.471 11.956 -3.136 904 HG23 THR 60 HG23 THR 60 -11.821 13.376 -4.123 905 H GLY 61 H GLY 61 -11.781 8.909 -6.879 906 HA2 GLY 61 HA2 GLY 61 -10.204 9.514 -9.193 907 HA3 GLY 61 HA3 GLY 61 -11.097 8.027 -8.897 908 H VAL 62 H VAL 62 -13.624 9.351 -8.464 909 HA VAL 62 HA VAL 62 -14.157 10.494 -11.111 910 HB VAL 62 HB VAL 62 -16.434 9.367 -11.010 911 HG11 VAL 62 HG11 VAL 62 -14.678 8.644 -12.539 912 HG12 VAL 62 HG12 VAL 62 -15.593 7.260 -11.938 913 HG13 VAL 62 HG13 VAL 62 -13.994 7.612 -11.284 914 HG21 VAL 62 HG21 VAL 62 -16.398 8.714 -8.652 915 HG22 VAL 62 HG22 VAL 62 -15.038 7.637 -8.967 916 HG23 VAL 62 HG23 VAL 62 -16.610 7.310 -9.698 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 13.120 15.600 -0.218 2 H2 GLY 1 H2 GLY 1 12.951 14.797 1.267 3 H3 GLY 1 H3 GLY 1 13.964 16.149 1.149 4 HA2 GLY 1 HA2 GLY 1 11.829 16.638 2.240 5 HA3 GLY 1 HA3 GLY 1 12.132 17.601 0.801 6 H ALA 2 H ALA 2 10.252 17.929 -0.154 7 HA ALA 2 HA ALA 2 8.731 15.560 -0.991 8 HB1 ALA 2 HB1 ALA 2 7.510 16.553 0.896 9 HB2 ALA 2 HB2 ALA 2 6.614 16.719 -0.614 10 HB3 ALA 2 HB3 ALA 2 7.477 18.104 0.056 11 H MET 3 H MET 3 10.302 16.153 -2.768 12 HA MET 3 HA MET 3 9.554 18.575 -4.244 13 HB2 MET 3 HB2 MET 3 11.921 16.720 -4.562 14 HB3 MET 3 HB3 MET 3 11.644 18.174 -5.508 15 HG2 MET 3 HG2 MET 3 12.043 18.090 -2.527 16 HG3 MET 3 HG3 MET 3 13.280 18.503 -3.713 17 HE1 MET 3 HE1 MET 3 11.877 21.825 -5.230 18 HE2 MET 3 HE2 MET 3 11.653 20.185 -5.832 19 HE3 MET 3 HE3 MET 3 13.228 20.689 -5.215 20 H GLU 4 H GLU 4 10.526 15.257 -5.114 21 HA GLU 4 HA GLU 4 8.443 15.282 -7.186 22 HB2 GLU 4 HB2 GLU 4 11.315 14.421 -7.592 23 HB3 GLU 4 HB3 GLU 4 10.024 14.241 -8.773 24 HG2 GLU 4 HG2 GLU 4 9.791 16.652 -8.916 25 HG3 GLU 4 HG3 GLU 4 11.033 16.859 -7.683 26 H MET 5 H MET 5 7.760 14.099 -5.067 27 HA MET 5 HA MET 5 8.663 11.343 -4.992 28 HB2 MET 5 HB2 MET 5 7.107 11.182 -3.038 29 HB3 MET 5 HB3 MET 5 8.379 12.381 -2.856 30 HG2 MET 5 HG2 MET 5 6.712 14.096 -3.613 31 HG3 MET 5 HG3 MET 5 5.479 12.850 -3.459 32 HE1 MET 5 HE1 MET 5 6.727 11.259 -0.886 33 HE2 MET 5 HE2 MET 5 5.005 11.565 -1.119 34 HE3 MET 5 HE3 MET 5 5.780 12.006 0.402 35 HA PRO 6 HA PRO 6 5.637 10.269 -8.030 36 HB2 PRO 6 HB2 PRO 6 6.034 7.557 -7.773 37 HB3 PRO 6 HB3 PRO 6 7.028 8.629 -8.762 38 HG2 PRO 6 HG2 PRO 6 7.539 7.585 -6.013 39 HG3 PRO 6 HG3 PRO 6 8.666 7.779 -7.367 40 HD2 PRO 6 HD2 PRO 6 8.601 9.533 -5.338 41 HD3 PRO 6 HD3 PRO 6 8.907 10.055 -7.007 42 H THR 7 H THR 7 3.546 9.671 -8.003 43 HA THR 7 HA THR 7 2.456 8.811 -5.405 44 HB THR 7 HB THR 7 1.007 10.449 -7.477 45 HG1 THR 7 HG1 THR 7 3.046 11.239 -5.984 46 HG21 THR 7 HG21 THR 7 -0.445 11.024 -5.593 47 HG22 THR 7 HG22 THR 7 0.521 9.991 -4.538 48 HG23 THR 7 HG23 THR 7 -0.400 9.282 -5.864 49 H PHE 8 H PHE 8 1.132 7.095 -5.369 50 HA PHE 8 HA PHE 8 0.145 6.023 -7.932 51 HB2 PHE 8 HB2 PHE 8 0.872 4.512 -5.405 52 HB3 PHE 8 HB3 PHE 8 0.165 3.796 -6.844 53 HD1 PHE 8 HD1 PHE 8 3.166 5.465 -5.497 54 HD2 PHE 8 HD2 PHE 8 1.510 3.227 -8.717 55 HE1 PHE 8 HE1 PHE 8 5.427 5.088 -6.396 56 HE2 PHE 8 HE2 PHE 8 3.769 2.851 -9.621 57 HZ PHE 8 HZ PHE 8 5.731 3.780 -8.461 58 H TYR 9 H TYR 9 -2.003 5.285 -7.971 59 HA TYR 9 HA TYR 9 -3.569 5.821 -5.532 60 HB2 TYR 9 HB2 TYR 9 -3.682 7.600 -7.456 61 HB3 TYR 9 HB3 TYR 9 -4.704 6.409 -8.250 62 HD1 TYR 9 HD1 TYR 9 -6.679 5.479 -6.710 63 HD2 TYR 9 HD2 TYR 9 -4.675 9.187 -6.136 64 HE1 TYR 9 HE1 TYR 9 -8.611 6.321 -5.444 65 HE2 TYR 9 HE2 TYR 9 -6.599 10.040 -4.871 66 HH TYR 9 HH TYR 9 -9.058 9.569 -4.726 67 H LEU 10 H LEU 10 -4.699 4.114 -4.937 68 HA LEU 10 HA LEU 10 -5.772 2.305 -6.959 69 HB2 LEU 10 HB2 LEU 10 -5.057 0.368 -5.416 70 HB3 LEU 10 HB3 LEU 10 -3.874 1.065 -6.505 71 HG LEU 10 HG LEU 10 -3.153 2.487 -4.475 72 HD11 LEU 10 HD11 LEU 10 -4.612 0.267 -3.057 73 HD12 LEU 10 HD12 LEU 10 -5.034 1.980 -3.025 74 HD13 LEU 10 HD13 LEU 10 -3.520 1.430 -2.305 75 HD21 LEU 10 HD21 LEU 10 -2.655 -0.478 -4.584 76 HD22 LEU 10 HD22 LEU 10 -1.668 0.693 -3.707 77 HD23 LEU 10 HD23 LEU 10 -1.777 0.772 -5.465 78 H ALA 11 H ALA 11 -7.502 0.944 -6.153 79 HA ALA 11 HA ALA 11 -8.673 1.928 -3.634 80 HB1 ALA 11 HB1 ALA 11 -9.931 2.756 -5.555 81 HB2 ALA 11 HB2 ALA 11 -10.884 1.614 -4.607 82 HB3 ALA 11 HB3 ALA 11 -10.152 1.102 -6.127 83 H LEU 12 H LEU 12 -9.187 0.452 -2.173 84 HA LEU 12 HA LEU 12 -8.830 -2.372 -2.953 85 HB2 LEU 12 HB2 LEU 12 -8.167 -1.116 -0.292 86 HB3 LEU 12 HB3 LEU 12 -7.844 -2.764 -0.782 87 HG LEU 12 HG LEU 12 -6.537 -0.304 -1.939 88 HD11 LEU 12 HD11 LEU 12 -4.538 -1.101 -0.817 89 HD12 LEU 12 HD12 LEU 12 -5.437 -2.463 -0.147 90 HD13 LEU 12 HD13 LEU 12 -5.830 -0.815 0.348 91 HD21 LEU 12 HD21 LEU 12 -6.022 -3.225 -2.481 92 HD22 LEU 12 HD22 LEU 12 -5.088 -1.872 -3.119 93 HD23 LEU 12 HD23 LEU 12 -6.773 -2.083 -3.598 94 H HIS 13 H HIS 13 -10.277 -3.852 -2.185 95 HA HIS 13 HA HIS 13 -12.777 -2.914 -1.166 96 HB2 HIS 13 HB2 HIS 13 -11.628 -5.661 -1.628 97 HB3 HIS 13 HB3 HIS 13 -13.194 -5.439 -0.856 98 HD1 HIS 13 HD1 HIS 13 -11.739 -5.959 -4.089 99 HD2 HIS 13 HD2 HIS 13 -14.959 -3.777 -2.608 100 HE1 HIS 13 HE1 HIS 13 -13.205 -5.472 -6.071 101 HE2 HIS 13 HE2 HIS 13 -14.987 -3.927 -5.189 102 H GLY 14 H GLY 14 -13.397 -2.632 0.875 103 HA2 GLY 14 HA2 GLY 14 -11.581 -2.704 3.003 104 HA3 GLY 14 HA3 GLY 14 -13.322 -2.544 3.163 105 H GLY 15 H GLY 15 -10.667 -4.466 3.803 106 HA2 GLY 15 HA2 GLY 15 -10.868 -6.283 5.340 107 HA3 GLY 15 HA3 GLY 15 -12.434 -6.661 4.646 108 H GLN 16 H GLN 16 -10.546 -6.025 2.056 109 HA GLN 16 HA GLN 16 -10.046 -8.851 1.587 110 HB2 GLN 16 HB2 GLN 16 -10.108 -6.405 -0.109 111 HB3 GLN 16 HB3 GLN 16 -9.092 -7.736 -0.642 112 HG2 GLN 16 HG2 GLN 16 -12.046 -7.896 -0.070 113 HG3 GLN 16 HG3 GLN 16 -11.302 -7.805 -1.666 114 HE21 GLN 16 HE21 GLN 16 -11.997 -9.807 1.059 115 HE22 GLN 16 HE22 GLN 16 -11.489 -11.310 0.353 116 H THR 17 H THR 17 -8.030 -9.703 1.015 117 HA THR 17 HA THR 17 -5.738 -8.232 2.109 118 HB THR 17 HB THR 17 -5.869 -11.155 1.302 119 HG1 THR 17 HG1 THR 17 -7.084 -9.998 3.346 120 HG21 THR 17 HG21 THR 17 -3.890 -11.374 2.715 121 HG22 THR 17 HG22 THR 17 -3.948 -9.649 3.083 122 HG23 THR 17 HG23 THR 17 -3.613 -10.187 1.438 123 H TYR 18 H TYR 18 -4.151 -7.549 0.817 124 HA TYR 18 HA TYR 18 -4.207 -8.369 -2.009 125 HB2 TYR 18 HB2 TYR 18 -3.772 -5.628 -0.815 126 HB3 TYR 18 HB3 TYR 18 -3.368 -6.024 -2.482 127 HD1 TYR 18 HD1 TYR 18 -5.106 -6.422 -4.124 128 HD2 TYR 18 HD2 TYR 18 -6.096 -5.439 -0.108 129 HE1 TYR 18 HE1 TYR 18 -7.410 -5.939 -4.825 130 HE2 TYR 18 HE2 TYR 18 -8.406 -4.948 -0.792 131 HH TYR 18 HH TYR 18 -9.642 -5.804 -3.877 132 H HIS 19 H HIS 19 -2.235 -8.459 -3.075 133 HA HIS 19 HA HIS 19 0.092 -8.746 -1.332 134 HB2 HIS 19 HB2 HIS 19 -0.734 -9.778 -3.969 135 HB3 HIS 19 HB3 HIS 19 0.967 -9.369 -3.842 136 HD1 HIS 19 HD1 HIS 19 -0.451 -12.302 -4.035 137 HD2 HIS 19 HD2 HIS 19 1.316 -10.521 -0.716 138 HE1 HIS 19 HE1 HIS 19 0.243 -14.196 -2.532 139 HE2 HIS 19 HE2 HIS 19 1.461 -13.099 -0.617 140 H LEU 20 H LEU 20 1.374 -7.110 -1.072 141 HA LEU 20 HA LEU 20 1.373 -4.926 -3.030 142 HB2 LEU 20 HB2 LEU 20 0.590 -4.083 -0.985 143 HB3 LEU 20 HB3 LEU 20 1.712 -5.052 -0.051 144 HG LEU 20 HG LEU 20 3.560 -3.608 -0.721 145 HD11 LEU 20 HD11 LEU 20 1.464 -2.057 -2.229 146 HD12 LEU 20 HD12 LEU 20 2.793 -2.984 -2.928 147 HD13 LEU 20 HD13 LEU 20 3.132 -1.545 -1.966 148 HD21 LEU 20 HD21 LEU 20 2.295 -3.053 1.288 149 HD22 LEU 20 HD22 LEU 20 1.185 -2.074 0.329 150 HD23 LEU 20 HD23 LEU 20 2.875 -1.595 0.484 151 H ILE 21 H ILE 21 3.119 -4.711 -4.213 152 HA ILE 21 HA ILE 21 5.721 -5.519 -3.090 153 HB ILE 21 HB ILE 21 4.870 -5.969 -5.961 154 HG12 ILE 21 HG12 ILE 21 5.430 -8.213 -4.078 155 HG13 ILE 21 HG13 ILE 21 3.871 -7.407 -3.958 156 HG21 ILE 21 HG21 ILE 21 6.946 -7.277 -6.102 157 HG22 ILE 21 HG22 ILE 21 7.336 -6.829 -4.441 158 HG23 ILE 21 HG23 ILE 21 7.259 -5.591 -5.694 159 HD11 ILE 21 HD11 ILE 21 4.990 -8.683 -6.439 160 HD12 ILE 21 HD12 ILE 21 3.410 -7.911 -6.280 161 HD13 ILE 21 HD13 ILE 21 3.770 -9.382 -5.374 162 H VAL 22 H VAL 22 7.125 -3.883 -3.126 163 HA VAL 22 HA VAL 22 6.831 -1.842 -5.223 164 HB VAL 22 HB VAL 22 6.598 -0.914 -2.949 165 HG11 VAL 22 HG11 VAL 22 7.997 -2.466 -1.708 166 HG12 VAL 22 HG12 VAL 22 8.539 -0.807 -1.445 167 HG13 VAL 22 HG13 VAL 22 9.430 -1.866 -2.542 168 HG21 VAL 22 HG21 VAL 22 8.229 0.900 -3.180 169 HG22 VAL 22 HG22 VAL 22 7.473 0.492 -4.723 170 HG23 VAL 22 HG23 VAL 22 9.112 -0.058 -4.370 171 H ASP 23 H ASP 23 8.483 -1.542 -6.599 172 HA ASP 23 HA ASP 23 11.066 -2.799 -6.073 173 HB2 ASP 23 HB2 ASP 23 9.797 -4.585 -7.112 174 HB3 ASP 23 HB3 ASP 23 9.257 -3.512 -8.394 175 H THR 24 H THR 24 12.737 -2.032 -7.489 176 HA THR 24 HA THR 24 12.026 0.562 -8.682 177 HB THR 24 HB THR 24 14.505 1.050 -8.453 178 HG1 THR 24 HG1 THR 24 14.345 -1.463 -7.181 179 HG21 THR 24 HG21 THR 24 12.933 0.545 -5.925 180 HG22 THR 24 HG22 THR 24 12.846 1.992 -6.929 181 HG23 THR 24 HG23 THR 24 14.338 1.605 -6.071 182 H ASP 25 H ASP 25 12.628 1.074 -10.735 183 HA ASP 25 HA ASP 25 13.276 -1.112 -12.495 184 HB2 ASP 25 HB2 ASP 25 12.561 0.238 -14.205 185 HB3 ASP 25 HB3 ASP 25 11.767 1.071 -12.875 186 H SER 26 H SER 26 14.922 -0.203 -14.399 187 HA SER 26 HA SER 26 17.480 -0.557 -13.397 188 HB2 SER 26 HB2 SER 26 18.217 0.325 -15.641 189 HB3 SER 26 HB3 SER 26 17.006 -0.958 -15.712 190 HG SER 26 HG SER 26 15.640 1.266 -15.589 191 H LEU 27 H LEU 27 15.656 2.429 -13.790 192 HA LEU 27 HA LEU 27 18.001 4.089 -13.345 193 HB2 LEU 27 HB2 LEU 27 15.097 4.888 -13.501 194 HB3 LEU 27 HB3 LEU 27 16.480 5.961 -13.582 195 HG LEU 27 HG LEU 27 15.848 3.850 -15.642 196 HD11 LEU 27 HD11 LEU 27 14.130 5.580 -15.591 197 HD12 LEU 27 HD12 LEU 27 15.126 5.713 -17.042 198 HD13 LEU 27 HD13 LEU 27 15.376 6.826 -15.696 199 HD21 LEU 27 HD21 LEU 27 18.217 4.433 -15.481 200 HD22 LEU 27 HD22 LEU 27 17.807 6.140 -15.654 201 HD23 LEU 27 HD23 LEU 27 17.507 5.023 -16.983 202 H GLY 28 H GLY 28 15.528 2.601 -11.497 203 HA2 GLY 28 HA2 GLY 28 15.766 2.456 -9.106 204 HA3 GLY 28 HA3 GLY 28 16.450 4.076 -9.121 205 H ASN 29 H ASN 29 13.744 3.659 -11.157 206 HA ASN 29 HA ASN 29 12.091 5.305 -9.422 207 HB2 ASN 29 HB2 ASN 29 11.500 4.059 -12.126 208 HB3 ASN 29 HB3 ASN 29 10.446 5.181 -11.276 209 HD21 ASN 29 HD21 ASN 29 13.347 4.786 -13.087 210 HD22 ASN 29 HD22 ASN 29 13.646 6.473 -13.369 211 HA PRO 30 HA PRO 30 10.241 1.786 -7.532 212 HB2 PRO 30 HB2 PRO 30 8.341 3.115 -6.136 213 HB3 PRO 30 HB3 PRO 30 10.042 3.106 -5.665 214 HG2 PRO 30 HG2 PRO 30 8.482 5.208 -7.100 215 HG3 PRO 30 HG3 PRO 30 9.725 5.386 -5.853 216 HD2 PRO 30 HD2 PRO 30 10.189 5.747 -8.521 217 HD3 PRO 30 HD3 PRO 30 11.437 5.251 -7.361 218 H SER 31 H SER 31 8.596 0.479 -7.941 219 HA SER 31 HA SER 31 6.332 1.469 -9.530 220 HB2 SER 31 HB2 SER 31 7.949 0.208 -10.948 221 HB3 SER 31 HB3 SER 31 7.778 -1.172 -9.873 222 HG SER 31 HG SER 31 6.335 -0.654 -11.970 223 H LEU 32 H LEU 32 4.350 0.372 -9.098 224 HA LEU 32 HA LEU 32 4.416 -1.023 -6.505 225 HB2 LEU 32 HB2 LEU 32 3.531 1.374 -6.563 226 HB3 LEU 32 HB3 LEU 32 2.165 0.731 -7.451 227 HG LEU 32 HG LEU 32 1.789 -0.842 -5.504 228 HD11 LEU 32 HD11 LEU 32 2.750 -0.167 -3.360 229 HD12 LEU 32 HD12 LEU 32 3.738 1.039 -4.185 230 HD13 LEU 32 HD13 LEU 32 3.993 -0.677 -4.502 231 HD21 LEU 32 HD21 LEU 32 1.576 2.114 -4.960 232 HD22 LEU 32 HD22 LEU 32 0.631 0.833 -4.202 233 HD23 LEU 32 HD23 LEU 32 0.444 1.166 -5.922 234 H SER 33 H SER 33 3.473 -2.943 -6.444 235 HA SER 33 HA SER 33 1.469 -3.592 -8.500 236 HB2 SER 33 HB2 SER 33 3.536 -5.499 -7.371 237 HB3 SER 33 HB3 SER 33 2.342 -5.866 -8.615 238 HG SER 33 HG SER 33 3.608 -3.770 -9.501 239 H VAL 34 H VAL 34 -0.436 -3.956 -7.586 240 HA VAL 34 HA VAL 34 -0.500 -5.268 -4.952 241 HB VAL 34 HB VAL 34 -2.264 -3.015 -5.933 242 HG11 VAL 34 HG11 VAL 34 -3.637 -4.690 -4.806 243 HG12 VAL 34 HG12 VAL 34 -3.492 -3.227 -3.832 244 HG13 VAL 34 HG13 VAL 34 -2.546 -4.657 -3.422 245 HG21 VAL 34 HG21 VAL 34 -0.134 -2.299 -5.014 246 HG22 VAL 34 HG22 VAL 34 -0.415 -3.262 -3.563 247 HG23 VAL 34 HG23 VAL 34 -1.445 -1.872 -3.915 248 H ILE 35 H ILE 35 -1.523 -7.136 -4.969 249 HA ILE 35 HA ILE 35 -3.448 -7.677 -7.141 250 HB ILE 35 HB ILE 35 -1.904 -9.908 -5.903 251 HG12 ILE 35 HG12 ILE 35 -0.810 -8.185 -8.141 252 HG13 ILE 35 HG13 ILE 35 -0.187 -8.203 -6.497 253 HG21 ILE 35 HG21 ILE 35 -2.935 -9.379 -8.685 254 HG22 ILE 35 HG22 ILE 35 -3.742 -10.341 -7.445 255 HG23 ILE 35 HG23 ILE 35 -2.203 -10.884 -8.123 256 HD11 ILE 35 HD11 ILE 35 -0.197 -10.529 -8.405 257 HD12 ILE 35 HD12 ILE 35 0.431 -10.544 -6.756 258 HD13 ILE 35 HD13 ILE 35 1.194 -9.530 -7.981 259 HA PRO 36 HA PRO 36 -6.217 -8.607 -3.740 260 HB2 PRO 36 HB2 PRO 36 -8.148 -9.825 -5.233 261 HB3 PRO 36 HB3 PRO 36 -7.954 -8.071 -5.141 262 HG2 PRO 36 HG2 PRO 36 -7.012 -9.972 -7.254 263 HG3 PRO 36 HG3 PRO 36 -7.777 -8.382 -7.438 264 HD2 PRO 36 HD2 PRO 36 -5.114 -8.722 -7.684 265 HD3 PRO 36 HD3 PRO 36 -5.814 -7.246 -6.990 266 H SER 37 H SER 37 -6.680 -10.368 -2.473 267 HA SER 37 HA SER 37 -5.299 -12.802 -2.901 268 HB2 SER 37 HB2 SER 37 -6.660 -13.572 -0.900 269 HB3 SER 37 HB3 SER 37 -5.694 -12.118 -0.641 270 HG SER 37 HG SER 37 -8.487 -12.338 -1.038 271 H ASN 38 H ASN 38 -8.500 -11.681 -3.631 272 HA ASN 38 HA ASN 38 -9.016 -14.220 -5.016 273 HB2 ASN 38 HB2 ASN 38 -10.357 -14.032 -2.875 274 HB3 ASN 38 HB3 ASN 38 -11.144 -12.624 -3.576 275 HD21 ASN 38 HD21 ASN 38 -12.332 -15.104 -2.728 276 HD22 ASN 38 HD22 ASN 38 -13.084 -15.801 -4.126 277 HA PRO 39 HA PRO 39 -9.167 -10.998 -8.180 278 HB2 PRO 39 HB2 PRO 39 -9.356 -12.789 -10.257 279 HB3 PRO 39 HB3 PRO 39 -7.833 -12.266 -9.534 280 HG2 PRO 39 HG2 PRO 39 -9.401 -14.762 -9.053 281 HG3 PRO 39 HG3 PRO 39 -7.646 -14.545 -9.172 282 HD2 PRO 39 HD2 PRO 39 -8.906 -14.833 -6.807 283 HD3 PRO 39 HD3 PRO 39 -7.465 -13.812 -6.988 284 H TYR 40 H TYR 40 -11.374 -13.640 -7.619 285 HA TYR 40 HA TYR 40 -13.389 -12.615 -9.420 286 HB2 TYR 40 HB2 TYR 40 -13.575 -14.799 -7.333 287 HB3 TYR 40 HB3 TYR 40 -14.781 -14.446 -8.566 288 HD1 TYR 40 HD1 TYR 40 -14.342 -14.982 -10.920 289 HD2 TYR 40 HD2 TYR 40 -11.558 -15.999 -7.869 290 HE1 TYR 40 HE1 TYR 40 -13.220 -16.530 -12.467 291 HE2 TYR 40 HE2 TYR 40 -10.428 -17.547 -9.406 292 HH TYR 40 HH TYR 40 -10.992 -18.852 -11.445 293 H GLN 41 H GLN 41 -12.477 -12.270 -6.114 294 HA GLN 41 HA GLN 41 -15.011 -11.407 -5.127 295 HB2 GLN 41 HB2 GLN 41 -13.085 -12.324 -3.751 296 HB3 GLN 41 HB3 GLN 41 -12.307 -10.761 -3.959 297 HG2 GLN 41 HG2 GLN 41 -13.324 -10.613 -1.883 298 HG3 GLN 41 HG3 GLN 41 -14.428 -9.767 -2.961 299 HE21 GLN 41 HE21 GLN 41 -15.466 -12.287 -4.090 300 HE22 GLN 41 HE22 GLN 41 -16.501 -12.944 -2.875 301 H GLU 42 H GLU 42 -12.353 -9.900 -6.758 302 HA GLU 42 HA GLU 42 -13.011 -7.201 -6.256 303 HB2 GLU 42 HB2 GLU 42 -11.642 -8.487 -8.625 304 HB3 GLU 42 HB3 GLU 42 -11.755 -6.751 -8.371 305 HG2 GLU 42 HG2 GLU 42 -10.396 -8.702 -6.525 306 HG3 GLU 42 HG3 GLU 42 -9.587 -7.650 -7.689 307 H GLN 43 H GLN 43 -14.212 -9.601 -8.480 308 HA GLN 43 HA GLN 43 -15.881 -7.756 -9.949 309 HB2 GLN 43 HB2 GLN 43 -16.075 -10.770 -9.863 310 HB3 GLN 43 HB3 GLN 43 -16.662 -9.698 -11.126 311 HG2 GLN 43 HG2 GLN 43 -14.434 -9.180 -11.817 312 HG3 GLN 43 HG3 GLN 43 -13.756 -10.050 -10.439 313 HE21 GLN 43 HE21 GLN 43 -15.252 -10.321 -13.553 314 HE22 GLN 43 HE22 GLN 43 -14.951 -12.017 -13.776 315 H LEU 44 H LEU 44 -16.246 -10.242 -7.485 316 HA LEU 44 HA LEU 44 -19.074 -9.735 -7.122 317 HB2 LEU 44 HB2 LEU 44 -17.183 -11.395 -5.448 318 HB3 LEU 44 HB3 LEU 44 -18.934 -11.447 -5.403 319 HG LEU 44 HG LEU 44 -17.307 -12.222 -7.819 320 HD11 LEU 44 HD11 LEU 44 -17.717 -14.526 -7.176 321 HD12 LEU 44 HD12 LEU 44 -18.532 -13.986 -5.707 322 HD13 LEU 44 HD13 LEU 44 -16.807 -13.684 -5.919 323 HD21 LEU 44 HD21 LEU 44 -20.195 -12.694 -7.094 324 HD22 LEU 44 HD22 LEU 44 -19.380 -13.275 -8.548 325 HD23 LEU 44 HD23 LEU 44 -19.604 -11.543 -8.294 326 H SER 45 H SER 45 -18.216 -7.370 -6.757 327 HA SER 45 HA SER 45 -17.017 -6.872 -4.211 328 HB2 SER 45 HB2 SER 45 -17.482 -4.445 -4.882 329 HB3 SER 45 HB3 SER 45 -16.373 -5.374 -5.888 330 HG SER 45 HG SER 45 -18.940 -4.439 -6.447 331 H ASP 46 H ASP 46 -18.761 -8.041 -3.046 332 HA ASP 46 HA ASP 46 -21.159 -6.599 -2.446 333 HB2 ASP 46 HB2 ASP 46 -20.885 -9.023 -1.952 334 HB3 ASP 46 HB3 ASP 46 -19.658 -8.622 -0.757 335 H THR 47 H THR 47 -17.903 -6.231 -1.799 336 HA THR 47 HA THR 47 -18.287 -4.503 0.524 337 HB THR 47 HB THR 47 -15.679 -4.512 0.316 338 HG1 THR 47 HG1 THR 47 -15.428 -6.954 -0.545 339 HG21 THR 47 HG21 THR 47 -16.910 -5.524 2.170 340 HG22 THR 47 HG22 THR 47 -15.567 -6.556 1.678 341 HG23 THR 47 HG23 THR 47 -17.214 -6.960 1.194 342 HA PRO 48 HA PRO 48 -17.609 -0.921 -2.072 343 HB2 PRO 48 HB2 PRO 48 -17.097 0.896 -0.152 344 HB3 PRO 48 HB3 PRO 48 -18.718 0.225 -0.393 345 HG2 PRO 48 HG2 PRO 48 -16.641 -0.511 1.635 346 HG3 PRO 48 HG3 PRO 48 -18.389 -0.296 1.850 347 HD2 PRO 48 HD2 PRO 48 -17.183 -2.735 1.573 348 HD3 PRO 48 HD3 PRO 48 -18.862 -2.412 1.098 349 H LEU 49 H LEU 49 -15.900 0.526 -2.697 350 HA LEU 49 HA LEU 49 -13.251 -0.532 -2.050 351 HB2 LEU 49 HB2 LEU 49 -14.242 1.311 -4.209 352 HB3 LEU 49 HB3 LEU 49 -12.538 1.066 -3.897 353 HG LEU 49 HG LEU 49 -14.473 -1.101 -4.712 354 HD11 LEU 49 HD11 LEU 49 -13.269 -1.027 -6.848 355 HD12 LEU 49 HD12 LEU 49 -12.340 0.358 -6.271 356 HD13 LEU 49 HD13 LEU 49 -14.083 0.497 -6.505 357 HD21 LEU 49 HD21 LEU 49 -12.461 -2.448 -5.008 358 HD22 LEU 49 HD22 LEU 49 -12.621 -1.915 -3.336 359 HD23 LEU 49 HD23 LEU 49 -11.471 -1.119 -4.409 360 H ILE 50 H ILE 50 -11.878 0.481 -0.755 361 HA ILE 50 HA ILE 50 -12.343 3.315 -0.155 362 HB ILE 50 HB ILE 50 -10.340 1.425 1.106 363 HG12 ILE 50 HG12 ILE 50 -12.906 2.499 2.291 364 HG13 ILE 50 HG13 ILE 50 -12.767 0.908 1.557 365 HG21 ILE 50 HG21 ILE 50 -10.089 3.213 2.788 366 HG22 ILE 50 HG22 ILE 50 -11.179 4.233 1.848 367 HG23 ILE 50 HG23 ILE 50 -9.622 3.753 1.174 368 HD11 ILE 50 HD11 ILE 50 -12.617 0.788 3.982 369 HD12 ILE 50 HD12 ILE 50 -11.233 1.881 3.958 370 HD13 ILE 50 HD13 ILE 50 -11.104 0.279 3.233 371 HA PRO 51 HA PRO 51 -9.067 4.105 -3.097 372 HB2 PRO 51 HB2 PRO 51 -9.111 6.801 -2.863 373 HB3 PRO 51 HB3 PRO 51 -10.316 5.908 -3.800 374 HG2 PRO 51 HG2 PRO 51 -10.519 7.056 -1.051 375 HG3 PRO 51 HG3 PRO 51 -11.723 7.014 -2.345 376 HD2 PRO 51 HD2 PRO 51 -11.715 5.288 -0.220 377 HD3 PRO 51 HD3 PRO 51 -12.419 4.909 -1.804 378 H LEU 52 H LEU 52 -6.928 4.228 -2.778 379 HA LEU 52 HA LEU 52 -5.927 5.577 -0.371 380 HB2 LEU 52 HB2 LEU 52 -5.118 2.840 -1.354 381 HB3 LEU 52 HB3 LEU 52 -4.172 3.767 -0.206 382 HG LEU 52 HG LEU 52 -6.509 3.774 1.100 383 HD11 LEU 52 HD11 LEU 52 -7.594 1.600 0.901 384 HD12 LEU 52 HD12 LEU 52 -6.547 1.201 -0.461 385 HD13 LEU 52 HD13 LEU 52 -7.709 2.521 -0.598 386 HD21 LEU 52 HD21 LEU 52 -4.404 3.019 2.019 387 HD22 LEU 52 HD22 LEU 52 -4.511 1.518 1.098 388 HD23 LEU 52 HD23 LEU 52 -5.676 1.852 2.379 389 H THR 53 H THR 53 -4.266 6.885 -0.730 390 HA THR 53 HA THR 53 -3.028 6.829 -3.409 391 HB THR 53 HB THR 53 -3.036 9.176 -1.504 392 HG1 THR 53 HG1 THR 53 -5.162 8.140 -2.626 393 HG21 THR 53 HG21 THR 53 -1.404 9.267 -3.320 394 HG22 THR 53 HG22 THR 53 -2.682 10.457 -3.580 395 HG23 THR 53 HG23 THR 53 -2.678 8.950 -4.498 396 H ILE 54 H ILE 54 -1.016 6.092 -3.438 397 HA ILE 54 HA ILE 54 0.489 6.116 -0.913 398 HB ILE 54 HB ILE 54 0.878 4.311 -3.302 399 HG12 ILE 54 HG12 ILE 54 -0.404 3.842 -0.605 400 HG13 ILE 54 HG13 ILE 54 -1.178 3.735 -2.182 401 HG21 ILE 54 HG21 ILE 54 2.956 4.732 -2.112 402 HG22 ILE 54 HG22 ILE 54 2.411 3.078 -1.832 403 HG23 ILE 54 HG23 ILE 54 2.188 4.303 -0.584 404 HD11 ILE 54 HD11 ILE 54 -0.727 1.537 -1.227 405 HD12 ILE 54 HD12 ILE 54 0.995 1.918 -1.172 406 HD13 ILE 54 HD13 ILE 54 0.169 1.795 -2.724 407 H PHE 55 H PHE 55 2.136 7.393 -0.762 408 HA PHE 55 HA PHE 55 3.372 8.464 -3.210 409 HB2 PHE 55 HB2 PHE 55 3.326 9.526 -0.375 410 HB3 PHE 55 HB3 PHE 55 4.287 10.224 -1.669 411 HD1 PHE 55 HD1 PHE 55 0.802 9.469 -0.668 412 HD2 PHE 55 HD2 PHE 55 3.392 11.826 -3.083 413 HE1 PHE 55 HE1 PHE 55 -1.096 10.909 -1.293 414 HE2 PHE 55 HE2 PHE 55 1.503 13.273 -3.710 415 HZ PHE 55 HZ PHE 55 -0.746 12.814 -2.816 416 H VAL 56 H VAL 56 5.508 8.116 -3.592 417 HA VAL 56 HA VAL 56 6.920 6.324 -1.811 418 HB VAL 56 HB VAL 56 7.364 7.318 -4.570 419 HG11 VAL 56 HG11 VAL 56 9.437 8.038 -3.378 420 HG12 VAL 56 HG12 VAL 56 9.724 6.799 -4.596 421 HG13 VAL 56 HG13 VAL 56 9.688 6.362 -2.888 422 HG21 VAL 56 HG21 VAL 56 7.877 4.721 -3.143 423 HG22 VAL 56 HG22 VAL 56 8.034 4.983 -4.884 424 HG23 VAL 56 HG23 VAL 56 6.453 5.116 -4.109 425 H GLY 57 H GLY 57 8.415 6.857 -0.387 426 HA2 GLY 57 HA2 GLY 57 8.872 9.641 0.124 427 HA3 GLY 57 HA3 GLY 57 9.486 8.290 1.059 428 H GLU 58 H GLU 58 10.436 10.805 -0.716 429 HA GLU 58 HA GLU 58 12.493 9.582 -2.290 430 HB2 GLU 58 HB2 GLU 58 13.316 11.991 -2.497 431 HB3 GLU 58 HB3 GLU 58 11.728 11.637 -3.154 432 HG2 GLU 58 HG2 GLU 58 10.655 12.637 -1.257 433 HG3 GLU 58 HG3 GLU 58 12.206 12.852 -0.447 434 H ASN 59 H ASN 59 13.668 8.349 -1.056 435 HA ASN 59 HA ASN 59 15.000 8.933 1.291 436 HB2 ASN 59 HB2 ASN 59 15.562 7.171 -1.054 437 HB3 ASN 59 HB3 ASN 59 16.805 7.394 0.158 438 HD21 ASN 59 HD21 ASN 59 15.395 4.980 -0.518 439 HD22 ASN 59 HD22 ASN 59 14.587 4.452 0.919 440 H THR 60 H THR 60 16.173 10.666 1.706 441 HA THR 60 HA THR 60 18.113 11.567 -0.290 442 HB THR 60 HB THR 60 16.031 12.929 -0.532 443 HG1 THR 60 HG1 THR 60 17.203 14.696 -0.874 444 HG21 THR 60 HG21 THR 60 15.284 12.903 1.791 445 HG22 THR 60 HG22 THR 60 15.476 14.560 1.220 446 HG23 THR 60 HG23 THR 60 16.698 13.841 2.268 447 H GLY 61 H GLY 61 19.610 13.211 0.672 448 HA2 GLY 61 HA2 GLY 61 20.249 13.948 3.093 449 HA3 GLY 61 HA3 GLY 61 20.428 12.210 3.300 450 H VAL 62 H VAL 62 21.536 14.963 1.398 451 HA VAL 62 HA VAL 62 23.690 13.572 0.163 452 HB VAL 62 HB VAL 62 23.438 16.559 0.561 453 HG11 VAL 62 HG11 VAL 62 24.943 14.916 -1.473 454 HG12 VAL 62 HG12 VAL 62 25.649 15.843 -0.150 455 HG13 VAL 62 HG13 VAL 62 24.822 16.675 -1.468 456 HG21 VAL 62 HG21 VAL 62 22.375 16.592 -1.656 457 HG22 VAL 62 HG22 VAL 62 21.413 15.703 -0.474 458 HG23 VAL 62 HG23 VAL 62 22.373 14.827 -1.668 459 H1 GLY 1 H1 GLY 1 -12.916 15.653 0.536 460 H2 GLY 1 H2 GLY 1 -12.794 14.884 -0.969 461 H3 GLY 1 H3 GLY 1 -13.785 16.245 -0.797 462 HA2 GLY 1 HA2 GLY 1 -11.652 16.711 -1.933 463 HA3 GLY 1 HA3 GLY 1 -11.938 17.674 -0.487 464 H ALA 2 H ALA 2 -10.062 17.974 0.474 465 HA ALA 2 HA ALA 2 -8.555 15.598 1.289 466 HB1 ALA 2 HB1 ALA 2 -7.324 16.594 -0.590 467 HB2 ALA 2 HB2 ALA 2 -6.429 16.749 0.923 468 HB3 ALA 2 HB3 ALA 2 -7.285 18.140 0.260 469 H MET 3 H MET 3 -10.120 16.190 3.073 470 HA MET 3 HA MET 3 -9.360 18.599 4.567 471 HB2 MET 3 HB2 MET 3 -11.737 16.754 4.864 472 HB3 MET 3 HB3 MET 3 -11.454 18.199 5.825 473 HG2 MET 3 HG2 MET 3 -11.849 18.146 2.842 474 HG3 MET 3 HG3 MET 3 -13.083 18.554 4.030 475 HE1 MET 3 HE1 MET 3 -11.674 21.856 5.579 476 HE2 MET 3 HE2 MET 3 -11.463 20.208 6.170 477 HE3 MET 3 HE3 MET 3 -13.028 20.727 5.544 478 H GLU 4 H GLU 4 -10.361 15.283 5.419 479 HA GLU 4 HA GLU 4 -8.275 15.276 7.492 480 HB2 GLU 4 HB2 GLU 4 -11.151 14.418 7.887 481 HB3 GLU 4 HB3 GLU 4 -9.863 14.234 9.070 482 HG2 GLU 4 HG2 GLU 4 -9.625 16.644 9.221 483 HG3 GLU 4 HG3 GLU 4 -10.867 16.857 7.989 484 H MET 5 H MET 5 -7.612 14.107 5.347 485 HA MET 5 HA MET 5 -8.519 11.354 5.257 486 HB2 MET 5 HB2 MET 5 -6.954 11.204 3.305 487 HB3 MET 5 HB3 MET 5 -8.220 12.410 3.128 488 HG2 MET 5 HG2 MET 5 -6.547 14.108 3.909 489 HG3 MET 5 HG3 MET 5 -5.319 12.860 3.750 490 HE1 MET 5 HE1 MET 5 -6.577 11.305 1.164 491 HE2 MET 5 HE2 MET 5 -4.852 11.590 1.392 492 HE3 MET 5 HE3 MET 5 -5.629 12.053 -0.123 493 HA PRO 6 HA PRO 6 -5.489 10.245 8.299 494 HB2 PRO 6 HB2 PRO 6 -5.903 7.535 8.019 495 HB3 PRO 6 HB3 PRO 6 -6.890 8.605 9.017 496 HG2 PRO 6 HG2 PRO 6 -7.412 7.583 6.259 497 HG3 PRO 6 HG3 PRO 6 -8.537 7.776 7.617 498 HD2 PRO 6 HD2 PRO 6 -8.456 9.543 5.597 499 HD3 PRO 6 HD3 PRO 6 -8.764 10.053 7.270 500 H THR 7 H THR 7 -3.408 9.641 8.268 501 HA THR 7 HA THR 7 -2.317 8.786 5.663 502 HB THR 7 HB THR 7 -0.872 10.414 7.746 503 HG1 THR 7 HG1 THR 7 -2.901 11.217 6.279 504 HG21 THR 7 HG21 THR 7 0.599 10.988 5.875 505 HG22 THR 7 HG22 THR 7 -0.362 9.965 4.807 506 HG23 THR 7 HG23 THR 7 0.547 9.245 6.137 507 H PHE 8 H PHE 8 -1.014 7.055 5.620 508 HA PHE 8 HA PHE 8 -0.029 5.966 8.181 509 HB2 PHE 8 HB2 PHE 8 -0.758 4.483 5.640 510 HB3 PHE 8 HB3 PHE 8 -0.055 3.750 7.073 511 HD1 PHE 8 HD1 PHE 8 -3.047 5.444 5.736 512 HD2 PHE 8 HD2 PHE 8 -1.403 3.173 8.936 513 HE1 PHE 8 HE1 PHE 8 -5.310 5.071 6.627 514 HE2 PHE 8 HE2 PHE 8 -3.662 2.802 9.839 515 HZ PHE 8 HZ PHE 8 -5.619 3.744 8.682 516 H TYR 9 H TYR 9 2.128 5.213 8.208 517 HA TYR 9 HA TYR 9 3.688 5.771 5.776 518 HB2 TYR 9 HB2 TYR 9 3.814 7.530 7.715 519 HB3 TYR 9 HB3 TYR 9 4.831 6.325 8.497 520 HD1 TYR 9 HD1 TYR 9 6.798 5.399 6.952 521 HD2 TYR 9 HD2 TYR 9 4.817 9.126 6.406 522 HE1 TYR 9 HE1 TYR 9 8.733 6.240 5.692 523 HE2 TYR 9 HE2 TYR 9 6.748 9.974 5.143 524 HH TYR 9 HH TYR 9 9.210 9.489 4.992 525 H LEU 10 H LEU 10 4.812 4.053 5.164 526 HA LEU 10 HA LEU 10 5.872 2.232 7.180 527 HB2 LEU 10 HB2 LEU 10 5.152 0.306 5.621 528 HB3 LEU 10 HB3 LEU 10 3.973 1.000 6.713 529 HG LEU 10 HG LEU 10 3.260 2.445 4.693 530 HD11 LEU 10 HD11 LEU 10 4.704 0.223 3.261 531 HD12 LEU 10 HD12 LEU 10 5.138 1.933 3.238 532 HD13 LEU 10 HD13 LEU 10 3.619 1.397 2.517 533 HD21 LEU 10 HD21 LEU 10 2.746 -0.520 4.788 534 HD22 LEU 10 HD22 LEU 10 1.766 0.661 3.917 535 HD23 LEU 10 HD23 LEU 10 1.875 0.731 5.676 536 H ALA 11 H ALA 11 7.588 0.861 6.366 537 HA ALA 11 HA ALA 11 8.777 1.858 3.858 538 HB1 ALA 11 HB1 ALA 11 10.036 2.671 5.784 539 HB2 ALA 11 HB2 ALA 11 10.987 1.532 4.833 540 HB3 ALA 11 HB3 ALA 11 10.251 1.015 6.350 541 H LEU 12 H LEU 12 9.291 0.394 2.390 542 HA LEU 12 HA LEU 12 8.914 -2.433 3.146 543 HB2 LEU 12 HB2 LEU 12 8.256 -1.156 0.493 544 HB3 LEU 12 HB3 LEU 12 7.929 -2.807 0.972 545 HG LEU 12 HG LEU 12 6.630 -0.348 2.145 546 HD11 LEU 12 HD11 LEU 12 4.629 -1.129 1.012 547 HD12 LEU 12 HD12 LEU 12 5.526 -2.489 0.334 548 HD13 LEU 12 HD13 LEU 12 5.928 -0.841 -0.147 549 HD21 LEU 12 HD21 LEU 12 6.103 -3.273 2.669 550 HD22 LEU 12 HD22 LEU 12 5.173 -1.921 3.313 551 HD23 LEU 12 HD23 LEU 12 6.856 -2.141 3.791 552 H HIS 13 H HIS 13 10.353 -3.914 2.378 553 HA HIS 13 HA HIS 13 12.851 -2.989 1.357 554 HB2 HIS 13 HB2 HIS 13 11.692 -5.735 1.806 555 HB3 HIS 13 HB3 HIS 13 13.259 -5.514 1.037 556 HD1 HIS 13 HD1 HIS 13 11.798 -6.037 4.271 557 HD2 HIS 13 HD2 HIS 13 15.032 -3.862 2.800 558 HE1 HIS 13 HE1 HIS 13 13.266 -5.569 6.253 559 HE2 HIS 13 HE2 HIS 13 15.065 -4.031 5.381 560 H GLY 14 H GLY 14 13.479 -2.698 -0.679 561 HA2 GLY 14 HA2 GLY 14 11.657 -2.750 -2.809 562 HA3 GLY 14 HA3 GLY 14 13.399 -2.589 -2.969 563 H GLY 15 H GLY 15 10.746 -4.497 -3.623 564 HA2 GLY 15 HA2 GLY 15 10.951 -6.303 -5.179 565 HA3 GLY 15 HA3 GLY 15 12.503 -6.701 -4.468 566 H GLN 16 H GLN 16 10.619 -6.070 -1.885 567 HA GLN 16 HA GLN 16 10.098 -8.891 -1.432 568 HB2 GLN 16 HB2 GLN 16 10.169 -6.456 0.275 569 HB3 GLN 16 HB3 GLN 16 9.150 -7.785 0.801 570 HG2 GLN 16 HG2 GLN 16 12.098 -7.953 0.225 571 HG3 GLN 16 HG3 GLN 16 11.358 -7.875 1.825 572 HE21 GLN 16 HE21 GLN 16 12.037 -9.842 -0.930 573 HE22 GLN 16 HE22 GLN 16 11.541 -11.352 -0.236 574 H THR 17 H THR 17 8.077 -9.739 -0.867 575 HA THR 17 HA THR 17 5.795 -8.245 -1.955 576 HB THR 17 HB THR 17 5.909 -11.169 -1.166 577 HG1 THR 17 HG1 THR 17 7.114 -9.979 -3.215 578 HG21 THR 17 HG21 THR 17 3.937 -11.370 -2.591 579 HG22 THR 17 HG22 THR 17 4.005 -9.644 -2.948 580 HG23 THR 17 HG23 THR 17 3.660 -10.194 -1.308 581 H TYR 18 H TYR 18 4.212 -7.559 -0.662 582 HA TYR 18 HA TYR 18 4.256 -8.396 2.157 583 HB2 TYR 18 HB2 TYR 18 3.839 -5.645 0.984 584 HB3 TYR 18 HB3 TYR 18 3.432 -6.053 2.648 585 HD1 TYR 18 HD1 TYR 18 5.169 -6.473 4.285 586 HD2 TYR 18 HD2 TYR 18 6.165 -5.464 0.277 587 HE1 TYR 18 HE1 TYR 18 7.473 -6.013 4.989 588 HE2 TYR 18 HE2 TYR 18 8.480 -4.996 0.963 589 HH TYR 18 HH TYR 18 9.698 -5.868 4.067 590 H HIS 19 H HIS 19 2.283 -8.478 3.222 591 HA HIS 19 HA HIS 19 -0.044 -8.754 1.470 592 HB2 HIS 19 HB2 HIS 19 0.779 -9.806 4.104 593 HB3 HIS 19 HB3 HIS 19 -0.921 -9.389 3.981 594 HD1 HIS 19 HD1 HIS 19 0.473 -12.327 4.166 595 HD2 HIS 19 HD2 HIS 19 -1.274 -10.522 0.847 596 HE1 HIS 19 HE1 HIS 19 -0.208 -14.209 2.646 597 HE2 HIS 19 HE2 HIS 19 -1.453 -13.103 0.752 598 H LEU 20 H LEU 20 -1.321 -7.107 1.225 599 HA LEU 20 HA LEU 20 -1.304 -4.938 3.201 600 HB2 LEU 20 HB2 LEU 20 -0.516 -4.084 1.163 601 HB3 LEU 20 HB3 LEU 20 -1.641 -5.042 0.222 602 HG LEU 20 HG LEU 20 -3.480 -3.590 0.894 603 HD11 LEU 20 HD11 LEU 20 -1.377 -2.060 2.413 604 HD12 LEU 20 HD12 LEU 20 -2.709 -2.985 3.108 605 HD13 LEU 20 HD13 LEU 20 -3.043 -1.539 2.154 606 HD21 LEU 20 HD21 LEU 20 -2.210 -3.030 -1.109 607 HD22 LEU 20 HD22 LEU 20 -1.095 -2.066 -0.143 608 HD23 LEU 20 HD23 LEU 20 -2.781 -1.572 -0.296 609 H ILE 21 H ILE 21 -3.051 -4.728 4.394 610 HA ILE 21 HA ILE 21 -5.652 -5.506 3.251 611 HB ILE 21 HB ILE 21 -4.805 -5.982 6.118 612 HG12 ILE 21 HG12 ILE 21 -5.377 -8.212 4.222 613 HG13 ILE 21 HG13 ILE 21 -3.812 -7.412 4.103 614 HG21 ILE 21 HG21 ILE 21 -6.890 -7.277 6.251 615 HG22 ILE 21 HG22 ILE 21 -7.276 -6.819 4.593 616 HG23 ILE 21 HG23 ILE 21 -7.194 -5.587 5.852 617 HD11 ILE 21 HD11 ILE 21 -4.942 -8.696 6.578 618 HD12 ILE 21 HD12 ILE 21 -3.357 -7.932 6.424 619 HD13 ILE 21 HD13 ILE 21 -3.724 -9.397 5.509 620 H VAL 22 H VAL 22 -7.044 -3.857 3.291 621 HA VAL 22 HA VAL 22 -6.746 -1.839 5.407 622 HB VAL 22 HB VAL 22 -6.511 -0.895 3.141 623 HG11 VAL 22 HG11 VAL 22 -7.911 -2.432 1.889 624 HG12 VAL 22 HG12 VAL 22 -8.445 -0.769 1.636 625 HG13 VAL 22 HG13 VAL 22 -9.344 -1.830 2.721 626 HG21 VAL 22 HG21 VAL 22 -8.132 0.923 3.384 627 HG22 VAL 22 HG22 VAL 22 -7.377 0.503 4.923 628 HG23 VAL 22 HG23 VAL 22 -9.020 -0.037 4.568 629 H ASP 23 H ASP 23 -8.399 -1.537 6.788 630 HA ASP 23 HA ASP 23 -10.984 -2.783 6.254 631 HB2 ASP 23 HB2 ASP 23 -9.722 -4.579 7.286 632 HB3 ASP 23 HB3 ASP 23 -9.186 -3.511 8.576 633 H THR 24 H THR 24 -12.658 -2.019 7.675 634 HA THR 24 HA THR 24 -11.933 0.566 8.883 635 HB THR 24 HB THR 24 -14.407 1.076 8.654 636 HG1 THR 24 HG1 THR 24 -14.279 -1.433 7.391 637 HG21 THR 24 HG21 THR 24 -12.835 0.578 6.124 638 HG22 THR 24 HG22 THR 24 -12.743 2.018 7.138 639 HG23 THR 24 HG23 THR 24 -14.236 1.643 6.274 640 H ASP 25 H ASP 25 -12.533 1.073 10.932 641 HA ASP 25 HA ASP 25 -13.189 -1.119 12.679 642 HB2 ASP 25 HB2 ASP 25 -12.466 0.216 14.393 643 HB3 ASP 25 HB3 ASP 25 -11.672 1.053 13.063 644 H SER 26 H SER 26 -14.832 -0.220 14.594 645 HA SER 26 HA SER 26 -17.391 -0.559 13.577 646 HB2 SER 26 HB2 SER 26 -18.145 0.291 15.819 647 HB3 SER 26 HB3 SER 26 -16.915 -0.970 15.901 648 HG SER 26 HG SER 26 -15.556 1.242 15.814 649 H LEU 27 H LEU 27 -15.561 2.420 14.003 650 HA LEU 27 HA LEU 27 -17.893 4.093 13.559 651 HB2 LEU 27 HB2 LEU 27 -14.985 4.877 13.725 652 HB3 LEU 27 HB3 LEU 27 -16.360 5.958 13.802 653 HG LEU 27 HG LEU 27 -15.746 3.838 15.856 654 HD11 LEU 27 HD11 LEU 27 -14.020 5.554 15.817 655 HD12 LEU 27 HD12 LEU 27 -15.016 5.688 17.269 656 HD13 LEU 27 HD13 LEU 27 -15.255 6.811 15.930 657 HD21 LEU 27 HD21 LEU 27 -18.112 4.428 15.698 658 HD22 LEU 27 HD22 LEU 27 -17.702 6.133 15.881 659 HD23 LEU 27 HD23 LEU 27 -17.403 5.007 17.205 660 H GLY 28 H GLY 28 -15.422 2.606 11.704 661 HA2 GLY 28 HA2 GLY 28 -15.663 2.480 9.313 662 HA3 GLY 28 HA3 GLY 28 -16.340 4.101 9.338 663 H ASN 29 H ASN 29 -13.635 3.660 11.374 664 HA ASN 29 HA ASN 29 -11.973 5.307 9.654 665 HB2 ASN 29 HB2 ASN 29 -11.387 4.040 12.345 666 HB3 ASN 29 HB3 ASN 29 -10.332 5.169 11.509 667 HD21 ASN 29 HD21 ASN 29 -13.237 4.765 13.321 668 HD22 ASN 29 HD22 ASN 29 -13.535 6.451 13.609 669 HA PRO 30 HA PRO 30 -10.144 1.794 7.748 670 HB2 PRO 30 HB2 PRO 30 -8.236 3.117 6.355 671 HB3 PRO 30 HB3 PRO 30 -9.940 3.124 5.890 672 HG2 PRO 30 HG2 PRO 30 -8.363 5.207 7.330 673 HG3 PRO 30 HG3 PRO 30 -9.607 5.401 6.084 674 HD2 PRO 30 HD2 PRO 30 -10.064 5.752 8.754 675 HD3 PRO 30 HD3 PRO 30 -11.317 5.267 7.593 676 H SER 31 H SER 31 -8.510 0.472 8.147 677 HA SER 31 HA SER 31 -6.236 1.436 9.733 678 HB2 SER 31 HB2 SER 31 -7.856 0.174 11.142 679 HB3 SER 31 HB3 SER 31 -7.688 -1.203 10.058 680 HG SER 31 HG SER 31 -6.249 -0.739 12.145 681 H LEU 32 H LEU 32 -4.263 0.342 9.295 682 HA LEU 32 HA LEU 32 -4.321 -1.046 6.703 683 HB2 LEU 32 HB2 LEU 32 -3.434 1.352 6.770 684 HB3 LEU 32 HB3 LEU 32 -2.067 0.699 7.653 685 HG LEU 32 HG LEU 32 -1.695 -0.862 5.696 686 HD11 LEU 32 HD11 LEU 32 -2.659 -0.174 3.556 687 HD12 LEU 32 HD12 LEU 32 -3.643 1.030 4.388 688 HD13 LEU 32 HD13 LEU 32 -3.903 -0.687 4.696 689 HD21 LEU 32 HD21 LEU 32 -1.474 2.096 5.179 690 HD22 LEU 32 HD22 LEU 32 -0.534 0.819 4.406 691 HD23 LEU 32 HD23 LEU 32 -0.343 1.132 6.130 692 H SER 33 H SER 33 -3.391 -2.961 6.629 693 HA SER 33 HA SER 33 -1.389 -3.641 8.677 694 HB2 SER 33 HB2 SER 33 -3.478 -5.516 7.532 695 HB3 SER 33 HB3 SER 33 -2.289 -5.903 8.778 696 HG SER 33 HG SER 33 -3.527 -3.788 9.652 697 H VAL 34 H VAL 34 0.507 -4.008 7.759 698 HA VAL 34 HA VAL 34 0.568 -5.302 5.120 699 HB VAL 34 HB VAL 34 2.341 -3.064 6.119 700 HG11 VAL 34 HG11 VAL 34 3.702 -4.747 4.978 701 HG12 VAL 34 HG12 VAL 34 3.570 -3.274 4.018 702 HG13 VAL 34 HG13 VAL 34 2.610 -4.692 3.594 703 HG21 VAL 34 HG21 VAL 34 0.214 -2.331 5.195 704 HG22 VAL 34 HG22 VAL 34 0.496 -3.290 3.740 705 HG23 VAL 34 HG23 VAL 34 1.532 -1.909 4.104 706 H ILE 35 H ILE 35 1.579 -7.171 5.123 707 HA ILE 35 HA ILE 35 3.495 -7.744 7.299 708 HB ILE 35 HB ILE 35 1.942 -9.957 6.041 709 HG12 ILE 35 HG12 ILE 35 0.854 -8.238 8.286 710 HG13 ILE 35 HG13 ILE 35 0.233 -8.250 6.642 711 HG21 ILE 35 HG21 ILE 35 2.973 -9.449 8.824 712 HG22 ILE 35 HG22 ILE 35 3.777 -10.408 7.582 713 HG23 ILE 35 HG23 ILE 35 2.236 -10.947 8.256 714 HD11 ILE 35 HD11 ILE 35 0.231 -10.579 8.547 715 HD12 ILE 35 HD12 ILE 35 -0.397 -10.592 6.897 716 HD13 ILE 35 HD13 ILE 35 -1.156 -9.576 8.122 717 HA PRO 36 HA PRO 36 6.263 -8.666 3.891 718 HB2 PRO 36 HB2 PRO 36 8.188 -9.905 5.374 719 HB3 PRO 36 HB3 PRO 36 8.005 -8.150 5.293 720 HG2 PRO 36 HG2 PRO 36 7.052 -10.058 7.394 721 HG3 PRO 36 HG3 PRO 36 7.831 -8.476 7.588 722 HD2 PRO 36 HD2 PRO 36 5.166 -8.794 7.839 723 HD3 PRO 36 HD3 PRO 36 5.875 -7.320 7.147 724 H SER 37 H SER 37 6.741 -10.418 2.615 725 HA SER 37 HA SER 37 5.331 -12.845 3.023 726 HB2 SER 37 HB2 SER 37 6.689 -13.609 1.016 727 HB3 SER 37 HB3 SER 37 5.726 -12.153 0.767 728 HG SER 37 HG SER 37 8.520 -12.374 1.176 729 H ASN 38 H ASN 38 8.525 -11.742 3.776 730 HA ASN 38 HA ASN 38 9.035 -14.296 5.129 731 HB2 ASN 38 HB2 ASN 38 10.375 -14.091 2.991 732 HB3 ASN 38 HB3 ASN 38 11.170 -12.694 3.705 733 HD21 ASN 38 HD21 ASN 38 12.346 -15.164 2.829 734 HD22 ASN 38 HD22 ASN 38 13.106 -15.884 4.213 735 HA PRO 39 HA PRO 39 9.203 -11.094 8.317 736 HB2 PRO 39 HB2 PRO 39 9.384 -12.902 10.381 737 HB3 PRO 39 HB3 PRO 39 7.866 -12.364 9.659 738 HG2 PRO 39 HG2 PRO 39 9.417 -14.869 9.171 739 HG3 PRO 39 HG3 PRO 39 7.662 -14.637 9.289 740 HD2 PRO 39 HD2 PRO 39 8.918 -14.920 6.916 741 HD3 PRO 39 HD3 PRO 39 7.487 -13.889 7.109 742 H TYR 40 H TYR 40 11.391 -13.752 7.750 743 HA TYR 40 HA TYR 40 13.412 -12.744 9.550 744 HB2 TYR 40 HB2 TYR 40 13.590 -14.912 7.444 745 HB3 TYR 40 HB3 TYR 40 14.796 -14.572 8.679 746 HD1 TYR 40 HD1 TYR 40 14.359 -15.131 11.036 747 HD2 TYR 40 HD2 TYR 40 11.565 -16.102 7.977 748 HE1 TYR 40 HE1 TYR 40 13.224 -16.684 12.568 749 HE2 TYR 40 HE2 TYR 40 10.426 -17.656 9.500 750 HH TYR 40 HH TYR 40 11.002 -18.993 11.519 751 H GLN 41 H GLN 41 12.507 -12.373 6.243 752 HA GLN 41 HA GLN 41 15.049 -11.519 5.264 753 HB2 GLN 41 HB2 GLN 41 13.116 -12.411 3.887 754 HB3 GLN 41 HB3 GLN 41 12.347 -10.845 4.104 755 HG2 GLN 41 HG2 GLN 41 13.365 -10.690 2.032 756 HG3 GLN 41 HG3 GLN 41 14.479 -9.860 3.114 757 HE21 GLN 41 HE21 GLN 41 15.495 -12.396 4.227 758 HE22 GLN 41 HE22 GLN 41 16.524 -13.063 3.005 759 H GLU 42 H GLU 42 12.394 -10.010 6.906 760 HA GLU 42 HA GLU 42 13.070 -7.311 6.418 761 HB2 GLU 42 HB2 GLU 42 11.689 -8.601 8.780 762 HB3 GLU 42 HB3 GLU 42 11.809 -6.864 8.535 763 HG2 GLU 42 HG2 GLU 42 10.444 -8.802 6.683 764 HG3 GLU 42 HG3 GLU 42 9.642 -7.740 7.839 765 H GLN 43 H GLN 43 14.246 -9.728 8.637 766 HA GLN 43 HA GLN 43 15.930 -7.907 10.115 767 HB2 GLN 43 HB2 GLN 43 16.108 -10.920 10.007 768 HB3 GLN 43 HB3 GLN 43 16.703 -9.858 11.274 769 HG2 GLN 43 HG2 GLN 43 14.476 -9.327 11.963 770 HG3 GLN 43 HG3 GLN 43 13.794 -10.197 10.589 771 HE21 GLN 43 HE21 GLN 43 15.278 -10.466 13.702 772 HE22 GLN 43 HE22 GLN 43 14.981 -12.156 13.933 773 H LEU 44 H LEU 44 16.283 -10.371 7.628 774 HA LEU 44 HA LEU 44 19.113 -9.877 7.273 775 HB2 LEU 44 HB2 LEU 44 17.215 -11.518 5.591 776 HB3 LEU 44 HB3 LEU 44 18.966 -11.579 5.545 777 HG LEU 44 HG LEU 44 17.330 -12.362 7.955 778 HD11 LEU 44 HD11 LEU 44 17.727 -14.666 7.292 779 HD12 LEU 44 HD12 LEU 44 18.546 -14.119 5.827 780 HD13 LEU 44 HD13 LEU 44 16.823 -13.807 6.043 781 HD21 LEU 44 HD21 LEU 44 20.219 -12.844 7.227 782 HD22 LEU 44 HD22 LEU 44 19.402 -13.429 8.678 783 HD23 LEU 44 HD23 LEU 44 19.632 -11.696 8.432 784 H SER 45 H SER 45 18.266 -7.501 6.919 785 HA SER 45 HA SER 45 17.072 -6.985 4.373 786 HB2 SER 45 HB2 SER 45 17.550 -4.563 5.066 787 HB3 SER 45 HB3 SER 45 16.425 -5.496 6.056 788 HG SER 45 HG SER 45 19.001 -4.594 6.641 789 H ASP 46 H ASP 46 18.825 -8.155 3.202 790 HA ASP 46 HA ASP 46 21.227 -6.715 2.622 791 HB2 ASP 46 HB2 ASP 46 20.957 -9.131 2.102 792 HB3 ASP 46 HB3 ASP 46 19.718 -8.726 0.917 793 H THR 47 H THR 47 17.971 -6.337 1.969 794 HA THR 47 HA THR 47 18.365 -4.587 -0.339 795 HB THR 47 HB THR 47 15.755 -4.588 -0.137 796 HG1 THR 47 HG1 THR 47 15.472 -7.017 0.720 797 HG21 THR 47 HG21 THR 47 16.983 -5.598 -1.999 798 HG22 THR 47 HG22 THR 47 15.634 -6.625 -1.512 799 HG23 THR 47 HG23 THR 47 17.277 -7.041 -1.028 800 HA PRO 48 HA PRO 48 17.699 -1.022 2.281 801 HB2 PRO 48 HB2 PRO 48 17.194 0.807 0.377 802 HB3 PRO 48 HB3 PRO 48 18.811 0.134 0.611 803 HG2 PRO 48 HG2 PRO 48 16.737 -0.579 -1.426 804 HG3 PRO 48 HG3 PRO 48 18.486 -0.372 -1.635 805 HD2 PRO 48 HD2 PRO 48 17.270 -2.809 -1.379 806 HD3 PRO 48 HD3 PRO 48 18.948 -2.493 -0.897 807 H LEU 49 H LEU 49 15.994 0.410 2.925 808 HA LEU 49 HA LEU 49 13.344 -0.615 2.259 809 HB2 LEU 49 HB2 LEU 49 14.342 1.211 4.431 810 HB3 LEU 49 HB3 LEU 49 12.637 0.978 4.114 811 HG LEU 49 HG LEU 49 14.559 -1.204 4.923 812 HD11 LEU 49 HD11 LEU 49 13.347 -1.137 7.057 813 HD12 LEU 49 HD12 LEU 49 12.426 0.255 6.482 814 HD13 LEU 49 HD13 LEU 49 14.169 0.388 6.725 815 HD21 LEU 49 HD21 LEU 49 12.542 -2.542 5.205 816 HD22 LEU 49 HD22 LEU 49 12.710 -1.998 3.535 817 HD23 LEU 49 HD23 LEU 49 11.558 -1.203 4.611 818 H ILE 50 H ILE 50 11.984 0.413 0.958 819 HA ILE 50 HA ILE 50 12.456 3.250 0.387 820 HB ILE 50 HB ILE 50 10.446 1.378 -0.886 821 HG12 ILE 50 HG12 ILE 50 13.018 2.447 -2.063 822 HG13 ILE 50 HG13 ILE 50 12.873 0.851 -1.339 823 HG21 ILE 50 HG21 ILE 50 10.203 3.177 -2.554 824 HG22 ILE 50 HG22 ILE 50 11.302 4.185 -1.611 825 HG23 ILE 50 HG23 ILE 50 9.745 3.709 -0.936 826 HD11 ILE 50 HD11 ILE 50 12.718 0.747 -3.764 827 HD12 ILE 50 HD12 ILE 50 11.341 1.847 -3.731 828 HD13 ILE 50 HD13 ILE 50 11.204 0.242 -3.013 829 HA PRO 51 HA PRO 51 9.179 4.037 3.330 830 HB2 PRO 51 HB2 PRO 51 9.237 6.737 3.116 831 HB3 PRO 51 HB3 PRO 51 10.435 5.829 4.045 832 HG2 PRO 51 HG2 PRO 51 10.650 6.996 1.307 833 HG3 PRO 51 HG3 PRO 51 11.851 6.936 2.604 834 HD2 PRO 51 HD2 PRO 51 11.840 5.226 0.469 835 HD3 PRO 51 HD3 PRO 51 12.535 4.830 2.053 836 H LEU 52 H LEU 52 7.040 4.171 3.011 837 HA LEU 52 HA LEU 52 6.051 5.548 0.614 838 HB2 LEU 52 HB2 LEU 52 5.233 2.807 1.580 839 HB3 LEU 52 HB3 LEU 52 4.285 3.742 0.441 840 HG LEU 52 HG LEU 52 6.621 3.756 -0.866 841 HD11 LEU 52 HD11 LEU 52 7.700 1.575 -0.683 842 HD12 LEU 52 HD12 LEU 52 6.650 1.173 0.678 843 HD13 LEU 52 HD13 LEU 52 7.815 2.488 0.823 844 HD21 LEU 52 HD21 LEU 52 4.514 3.008 -1.793 845 HD22 LEU 52 HD22 LEU 52 4.619 1.505 -0.880 846 HD23 LEU 52 HD23 LEU 52 5.785 1.839 -2.159 847 H THR 53 H THR 53 4.387 6.858 0.975 848 HA THR 53 HA THR 53 3.162 6.790 3.659 849 HB THR 53 HB THR 53 3.180 9.153 1.772 850 HG1 THR 53 HG1 THR 53 5.305 8.105 2.900 851 HG21 THR 53 HG21 THR 53 1.548 9.236 3.583 852 HG22 THR 53 HG22 THR 53 2.830 10.419 3.852 853 HG23 THR 53 HG23 THR 53 2.819 8.908 4.762 854 H ILE 54 H ILE 54 1.141 6.064 3.683 855 HA ILE 54 HA ILE 54 -0.356 6.110 1.155 856 HB ILE 54 HB ILE 54 -0.760 4.293 3.534 857 HG12 ILE 54 HG12 ILE 54 0.523 3.837 0.835 858 HG13 ILE 54 HG13 ILE 54 1.293 3.714 2.413 859 HG21 ILE 54 HG21 ILE 54 -2.831 4.734 2.347 860 HG22 ILE 54 HG22 ILE 54 -2.295 3.079 2.055 861 HG23 ILE 54 HG23 ILE 54 -2.064 4.314 0.816 862 HD11 ILE 54 HD11 ILE 54 0.828 1.526 1.442 863 HD12 ILE 54 HD12 ILE 54 -0.894 1.918 1.390 864 HD13 ILE 54 HD13 ILE 54 -0.065 1.782 2.941 865 H PHE 55 H PHE 55 -2.006 7.401 1.009 866 HA PHE 55 HA PHE 55 -3.231 8.463 3.466 867 HB2 PHE 55 HB2 PHE 55 -3.188 9.544 0.640 868 HB3 PHE 55 HB3 PHE 55 -4.146 10.238 1.940 869 HD1 PHE 55 HD1 PHE 55 -0.666 9.469 0.928 870 HD2 PHE 55 HD2 PHE 55 -3.240 11.821 3.363 871 HE1 PHE 55 HE1 PHE 55 1.243 10.895 1.569 872 HE2 PHE 55 HE2 PHE 55 -1.343 13.255 4.000 873 HZ PHE 55 HZ PHE 55 0.903 12.790 3.103 874 H VAL 56 H VAL 56 -5.367 8.110 3.853 875 HA VAL 56 HA VAL 56 -6.788 6.349 2.051 876 HB VAL 56 HB VAL 56 -7.235 7.327 4.816 877 HG11 VAL 56 HG11 VAL 56 -9.298 8.068 3.623 878 HG12 VAL 56 HG12 VAL 56 -9.594 6.821 4.833 879 HG13 VAL 56 HG13 VAL 56 -9.559 6.397 3.121 880 HG21 VAL 56 HG21 VAL 56 -7.757 4.747 3.366 881 HG22 VAL 56 HG22 VAL 56 -7.915 4.994 5.109 882 HG23 VAL 56 HG23 VAL 56 -6.333 5.128 4.335 883 H GLY 57 H GLY 57 -8.283 6.897 0.640 884 HA2 GLY 57 HA2 GLY 57 -8.722 9.684 0.130 885 HA3 GLY 57 HA3 GLY 57 -9.343 8.337 -0.806 886 H GLU 58 H GLU 58 -10.278 10.855 0.987 887 HA GLU 58 HA GLU 58 -12.348 9.637 2.549 888 HB2 GLU 58 HB2 GLU 58 -13.157 12.053 2.766 889 HB3 GLU 58 HB3 GLU 58 -11.571 11.684 3.424 890 HG2 GLU 58 HG2 GLU 58 -10.493 12.680 1.529 891 HG3 GLU 58 HG3 GLU 58 -12.040 12.922 0.724 892 H ASN 59 H ASN 59 -13.520 8.410 1.289 893 HA ASN 59 HA ASN 59 -14.850 9.020 -1.048 894 HB2 ASN 59 HB2 ASN 59 -15.429 7.243 1.286 895 HB3 ASN 59 HB3 ASN 59 -16.669 7.481 0.076 896 HD21 ASN 59 HD21 ASN 59 -15.270 5.049 0.745 897 HD22 ASN 59 HD22 ASN 59 -14.464 4.523 -0.693 898 H THR 60 H THR 60 -16.022 10.770 -1.444 899 HA THR 60 HA THR 60 -17.956 11.666 0.563 900 HB THR 60 HB THR 60 -15.869 13.021 0.810 901 HG1 THR 60 HG1 THR 60 -17.034 14.796 1.155 902 HG21 THR 60 HG21 THR 60 -15.125 12.994 -1.515 903 HG22 THR 60 HG22 THR 60 -15.300 14.649 -0.937 904 HG23 THR 60 HG23 THR 60 -16.529 13.945 -1.985 905 H GLY 61 H GLY 61 -19.453 13.325 -0.397 906 HA2 GLY 61 HA2 GLY 61 -20.077 14.084 -2.813 907 HA3 GLY 61 HA3 GLY 61 -20.265 12.347 -3.033 908 H VAL 62 H VAL 62 -21.383 15.102 -1.142 909 HA VAL 62 HA VAL 62 -23.521 13.692 0.107 910 HB VAL 62 HB VAL 62 -23.258 16.681 -0.263 911 HG11 VAL 62 HG11 VAL 62 -24.775 15.040 1.761 912 HG12 VAL 62 HG12 VAL 62 -25.469 15.984 0.441 913 HG13 VAL 62 HG13 VAL 62 -24.634 16.799 1.765 914 HG21 VAL 62 HG21 VAL 62 -22.190 16.703 1.947 915 HG22 VAL 62 HG22 VAL 62 -21.235 15.815 0.760 916 HG23 VAL 62 HG23 VAL 62 -22.191 14.939 1.956 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 17.475 12.698 -4.858 2 H2 GLY 1 H2 GLY 1 16.135 12.158 -5.745 3 H3 GLY 1 H3 GLY 1 16.199 11.910 -4.068 4 HA2 GLY 1 HA2 GLY 1 16.154 14.318 -3.709 5 HA3 GLY 1 HA3 GLY 1 15.991 14.528 -5.448 6 H ALA 2 H ALA 2 14.318 14.404 -2.614 7 HA ALA 2 HA ALA 2 11.929 13.143 -3.725 8 HB1 ALA 2 HB1 ALA 2 11.012 13.326 -1.474 9 HB2 ALA 2 HB2 ALA 2 12.427 14.245 -0.960 10 HB3 ALA 2 HB3 ALA 2 12.599 12.559 -1.446 11 H MET 3 H MET 3 12.490 15.371 -5.140 12 HA MET 3 HA MET 3 10.928 17.589 -4.080 13 HB2 MET 3 HB2 MET 3 12.374 17.215 -6.712 14 HB3 MET 3 HB3 MET 3 11.488 18.667 -6.273 15 HG2 MET 3 HG2 MET 3 12.993 19.055 -4.414 16 HG3 MET 3 HG3 MET 3 13.860 17.567 -4.789 17 HE1 MET 3 HE1 MET 3 12.905 21.159 -6.079 18 HE2 MET 3 HE2 MET 3 12.388 20.105 -7.396 19 HE3 MET 3 HE3 MET 3 13.748 21.204 -7.629 20 H GLU 4 H GLU 4 10.900 15.645 -7.047 21 HA GLU 4 HA GLU 4 7.988 16.008 -7.207 22 HB2 GLU 4 HB2 GLU 4 9.415 16.615 -9.178 23 HB3 GLU 4 HB3 GLU 4 9.893 14.929 -9.292 24 HG2 GLU 4 HG2 GLU 4 7.626 14.268 -9.762 25 HG3 GLU 4 HG3 GLU 4 7.066 15.924 -9.527 26 H MET 5 H MET 5 7.568 14.524 -5.550 27 HA MET 5 HA MET 5 8.643 11.867 -5.643 28 HB2 MET 5 HB2 MET 5 7.284 11.489 -3.622 29 HB3 MET 5 HB3 MET 5 8.278 12.935 -3.497 30 HG2 MET 5 HG2 MET 5 6.231 14.238 -4.194 31 HG3 MET 5 HG3 MET 5 5.314 12.754 -3.944 32 HE1 MET 5 HE1 MET 5 7.122 11.585 -1.481 33 HE2 MET 5 HE2 MET 5 5.366 11.443 -1.523 34 HE3 MET 5 HE3 MET 5 6.161 12.113 -0.098 35 HA PRO 6 HA PRO 6 5.626 10.155 -8.366 36 HB2 PRO 6 HB2 PRO 6 6.160 7.532 -7.792 37 HB3 PRO 6 HB3 PRO 6 7.152 8.526 -8.863 38 HG2 PRO 6 HG2 PRO 6 7.580 7.829 -5.988 39 HG3 PRO 6 HG3 PRO 6 8.757 7.898 -7.313 40 HD2 PRO 6 HD2 PRO 6 8.531 9.879 -5.502 41 HD3 PRO 6 HD3 PRO 6 8.941 10.196 -7.199 42 H THR 7 H THR 7 3.542 9.660 -8.179 43 HA THR 7 HA THR 7 2.561 8.842 -5.520 44 HB THR 7 HB THR 7 1.026 10.463 -7.545 45 HG1 THR 7 HG1 THR 7 3.113 11.313 -6.313 46 HG21 THR 7 HG21 THR 7 0.633 10.016 -4.588 47 HG22 THR 7 HG22 THR 7 -0.319 9.282 -5.878 48 HG23 THR 7 HG23 THR 7 -0.377 11.027 -5.623 49 H PHE 8 H PHE 8 1.272 7.098 -5.402 50 HA PHE 8 HA PHE 8 0.307 5.906 -7.923 51 HB2 PHE 8 HB2 PHE 8 1.018 4.556 -5.306 52 HB3 PHE 8 HB3 PHE 8 0.319 3.741 -6.693 53 HD1 PHE 8 HD1 PHE 8 3.295 5.606 -5.529 54 HD2 PHE 8 HD2 PHE 8 1.680 2.956 -8.441 55 HE1 PHE 8 HE1 PHE 8 5.562 5.179 -6.396 56 HE2 PHE 8 HE2 PHE 8 3.941 2.524 -9.312 57 HZ PHE 8 HZ PHE 8 5.885 3.634 -8.290 58 H TYR 9 H TYR 9 -1.852 5.354 -8.063 59 HA TYR 9 HA TYR 9 -3.486 5.842 -5.657 60 HB2 TYR 9 HB2 TYR 9 -3.569 7.564 -7.635 61 HB3 TYR 9 HB3 TYR 9 -4.543 6.331 -8.425 62 HD1 TYR 9 HD1 TYR 9 -6.749 5.688 -7.444 63 HD2 TYR 9 HD2 TYR 9 -4.445 8.909 -5.888 64 HE1 TYR 9 HE1 TYR 9 -8.741 6.547 -6.277 65 HE2 TYR 9 HE2 TYR 9 -6.429 9.775 -4.725 66 HH TYR 9 HH TYR 9 -9.370 7.978 -4.497 67 H LEU 10 H LEU 10 -4.586 4.095 -5.054 68 HA LEU 10 HA LEU 10 -5.586 2.260 -7.089 69 HB2 LEU 10 HB2 LEU 10 -4.861 0.329 -5.556 70 HB3 LEU 10 HB3 LEU 10 -3.665 1.067 -6.599 71 HG LEU 10 HG LEU 10 -3.040 2.477 -4.520 72 HD11 LEU 10 HD11 LEU 10 -4.461 0.176 -3.196 73 HD12 LEU 10 HD12 LEU 10 -4.954 1.869 -3.145 74 HD13 LEU 10 HD13 LEU 10 -3.441 1.366 -2.390 75 HD21 LEU 10 HD21 LEU 10 -2.451 -0.473 -4.669 76 HD22 LEU 10 HD22 LEU 10 -1.515 0.719 -3.765 77 HD23 LEU 10 HD23 LEU 10 -1.598 0.814 -5.523 78 H ALA 11 H ALA 11 -7.289 0.848 -6.307 79 HA ALA 11 HA ALA 11 -8.585 1.874 -3.861 80 HB1 ALA 11 HB1 ALA 11 -10.743 1.502 -4.905 81 HB2 ALA 11 HB2 ALA 11 -9.950 0.949 -6.380 82 HB3 ALA 11 HB3 ALA 11 -9.770 2.623 -5.854 83 H LEU 12 H LEU 12 -9.115 0.443 -2.377 84 HA LEU 12 HA LEU 12 -8.754 -2.410 -3.049 85 HB2 LEU 12 HB2 LEU 12 -8.089 -1.072 -0.429 86 HB3 LEU 12 HB3 LEU 12 -7.770 -2.736 -0.869 87 HG LEU 12 HG LEU 12 -6.449 -0.310 -2.088 88 HD11 LEU 12 HD11 LEU 12 -5.381 -2.424 -0.222 89 HD12 LEU 12 HD12 LEU 12 -5.738 -0.750 0.203 90 HD13 LEU 12 HD13 LEU 12 -4.450 -1.112 -0.945 91 HD21 LEU 12 HD21 LEU 12 -4.994 -1.929 -3.210 92 HD22 LEU 12 HD22 LEU 12 -6.675 -2.113 -3.711 93 HD23 LEU 12 HD23 LEU 12 -5.969 -3.250 -2.564 94 H HIS 13 H HIS 13 -10.217 -3.847 -2.224 95 HA HIS 13 HA HIS 13 -12.719 -2.835 -1.297 96 HB2 HIS 13 HB2 HIS 13 -11.623 -5.640 -1.564 97 HB3 HIS 13 HB3 HIS 13 -13.234 -5.312 -0.931 98 HD1 HIS 13 HD1 HIS 13 -11.572 -6.089 -3.997 99 HD2 HIS 13 HD2 HIS 13 -14.782 -3.666 -2.915 100 HE1 HIS 13 HE1 HIS 13 -12.830 -5.637 -6.121 101 HE2 HIS 13 HE2 HIS 13 -14.690 -4.062 -5.471 102 H GLY 14 H GLY 14 -13.482 -2.599 0.712 103 HA2 GLY 14 HA2 GLY 14 -11.756 -2.514 2.916 104 HA3 GLY 14 HA3 GLY 14 -13.510 -2.468 3.002 105 H GLY 15 H GLY 15 -10.759 -4.195 3.781 106 HA2 GLY 15 HA2 GLY 15 -10.835 -5.997 5.323 107 HA3 GLY 15 HA3 GLY 15 -12.411 -6.446 4.691 108 H GLN 16 H GLN 16 -10.571 -5.779 2.064 109 HA GLN 16 HA GLN 16 -10.162 -8.610 1.551 110 HB2 GLN 16 HB2 GLN 16 -10.905 -6.390 -0.009 111 HB3 GLN 16 HB3 GLN 16 -9.323 -6.884 -0.598 112 HG2 GLN 16 HG2 GLN 16 -11.535 -8.856 -0.201 113 HG3 GLN 16 HG3 GLN 16 -11.387 -7.913 -1.681 114 HE21 GLN 16 HE21 GLN 16 -9.827 -8.402 -3.146 115 HE22 GLN 16 HE22 GLN 16 -8.798 -9.787 -3.007 116 H THR 17 H THR 17 -8.212 -9.547 1.062 117 HA THR 17 HA THR 17 -5.859 -8.111 2.048 118 HB THR 17 HB THR 17 -6.030 -11.020 1.216 119 HG1 THR 17 HG1 THR 17 -7.180 -9.783 3.329 120 HG21 THR 17 HG21 THR 17 -3.772 -10.102 1.434 121 HG22 THR 17 HG22 THR 17 -4.105 -11.270 2.715 122 HG23 THR 17 HG23 THR 17 -4.147 -9.541 3.062 123 H TYR 18 H TYR 18 -4.184 -7.570 0.792 124 HA TYR 18 HA TYR 18 -4.202 -8.375 -2.036 125 HB2 TYR 18 HB2 TYR 18 -3.800 -5.617 -0.884 126 HB3 TYR 18 HB3 TYR 18 -3.324 -6.048 -2.524 127 HD1 TYR 18 HD1 TYR 18 -6.159 -5.443 -0.274 128 HD2 TYR 18 HD2 TYR 18 -4.985 -6.434 -4.241 129 HE1 TYR 18 HE1 TYR 18 -8.435 -4.948 -1.063 130 HE2 TYR 18 HE2 TYR 18 -7.249 -5.945 -5.050 131 HH TYR 18 HH TYR 18 -9.447 -5.640 -4.351 132 H HIS 19 H HIS 19 -2.211 -8.459 -3.043 133 HA HIS 19 HA HIS 19 0.103 -8.714 -1.288 134 HB2 HIS 19 HB2 HIS 19 -0.659 -9.645 -4.005 135 HB3 HIS 19 HB3 HIS 19 1.046 -9.335 -3.739 136 HD1 HIS 19 HD1 HIS 19 -0.871 -12.107 -3.988 137 HD2 HIS 19 HD2 HIS 19 1.464 -10.702 -0.836 138 HE1 HIS 19 HE1 HIS 19 -0.338 -14.124 -2.585 139 HE2 HIS 19 HE2 HIS 19 1.218 -13.286 -0.787 140 H LEU 20 H LEU 20 1.341 -7.043 -1.001 141 HA LEU 20 HA LEU 20 1.364 -4.880 -2.982 142 HB2 LEU 20 HB2 LEU 20 0.530 -4.004 -0.968 143 HB3 LEU 20 HB3 LEU 20 1.630 -4.958 0.007 144 HG LEU 20 HG LEU 20 3.490 -3.522 -0.644 145 HD11 LEU 20 HD11 LEU 20 1.424 -2.009 -2.224 146 HD12 LEU 20 HD12 LEU 20 2.791 -2.924 -2.870 147 HD13 LEU 20 HD13 LEU 20 3.073 -1.467 -1.912 148 HD21 LEU 20 HD21 LEU 20 2.179 -2.947 1.331 149 HD22 LEU 20 HD22 LEU 20 1.096 -1.971 0.336 150 HD23 LEU 20 HD23 LEU 20 2.786 -1.500 0.527 151 H ILE 21 H ILE 21 3.127 -4.663 -4.116 152 HA ILE 21 HA ILE 21 5.707 -5.462 -2.943 153 HB ILE 21 HB ILE 21 4.909 -5.899 -5.828 154 HG12 ILE 21 HG12 ILE 21 5.368 -8.148 -3.913 155 HG13 ILE 21 HG13 ILE 21 3.811 -7.327 -3.885 156 HG21 ILE 21 HG21 ILE 21 7.313 -6.826 -4.252 157 HG22 ILE 21 HG22 ILE 21 7.301 -5.557 -5.476 158 HG23 ILE 21 HG23 ILE 21 6.969 -7.227 -5.935 159 HD11 ILE 21 HD11 ILE 21 3.798 -9.328 -5.284 160 HD12 ILE 21 HD12 ILE 21 5.051 -8.613 -6.303 161 HD13 ILE 21 HD13 ILE 21 3.455 -7.865 -6.206 162 H VAL 22 H VAL 22 7.128 -3.824 -2.980 163 HA VAL 22 HA VAL 22 6.837 -1.796 -5.094 164 HB VAL 22 HB VAL 22 6.498 -0.872 -2.812 165 HG11 VAL 22 HG11 VAL 22 9.353 -1.732 -2.390 166 HG12 VAL 22 HG12 VAL 22 7.931 -2.291 -1.505 167 HG13 VAL 22 HG13 VAL 22 8.478 -0.622 -1.333 168 HG21 VAL 22 HG21 VAL 22 7.289 0.580 -4.570 169 HG22 VAL 22 HG22 VAL 22 8.954 0.102 -4.255 170 HG23 VAL 22 HG23 VAL 22 8.057 1.019 -3.044 171 H ASP 23 H ASP 23 8.516 -1.495 -6.417 172 HA ASP 23 HA ASP 23 11.153 -2.488 -5.652 173 HB2 ASP 23 HB2 ASP 23 11.452 -3.747 -7.676 174 HB3 ASP 23 HB3 ASP 23 9.983 -4.316 -6.897 175 H THR 24 H THR 24 12.789 -1.825 -7.403 176 HA THR 24 HA THR 24 12.010 0.806 -8.488 177 HB THR 24 HB THR 24 14.495 1.390 -8.119 178 HG1 THR 24 HG1 THR 24 14.881 -0.926 -7.458 179 HG21 THR 24 HG21 THR 24 14.054 2.145 -5.821 180 HG22 THR 24 HG22 THR 24 12.633 1.100 -5.760 181 HG23 THR 24 HG23 THR 24 12.688 2.454 -6.891 182 H ASP 25 H ASP 25 12.714 1.324 -10.502 183 HA ASP 25 HA ASP 25 13.767 -0.843 -12.112 184 HB2 ASP 25 HB2 ASP 25 13.050 0.341 -13.963 185 HB3 ASP 25 HB3 ASP 25 11.936 0.952 -12.744 186 H SER 26 H SER 26 15.410 0.272 -13.954 187 HA SER 26 HA SER 26 17.830 0.429 -12.494 188 HB2 SER 26 HB2 SER 26 17.539 -0.464 -14.843 189 HB3 SER 26 HB3 SER 26 17.458 1.211 -15.388 190 HG SER 26 HG SER 26 19.600 0.575 -13.735 191 H LEU 27 H LEU 27 15.651 2.858 -13.757 192 HA LEU 27 HA LEU 27 17.545 5.014 -13.614 193 HB2 LEU 27 HB2 LEU 27 14.538 5.130 -13.744 194 HB3 LEU 27 HB3 LEU 27 15.636 6.457 -14.059 195 HG LEU 27 HG LEU 27 15.466 3.945 -15.721 196 HD11 LEU 27 HD11 LEU 27 14.358 6.700 -16.240 197 HD12 LEU 27 HD12 LEU 27 13.416 5.259 -15.864 198 HD13 LEU 27 HD13 LEU 27 14.335 5.344 -17.368 199 HD21 LEU 27 HD21 LEU 27 16.812 5.210 -17.322 200 HD22 LEU 27 HD22 LEU 27 17.660 5.010 -15.791 201 HD23 LEU 27 HD23 LEU 27 16.907 6.554 -16.185 202 H GLY 28 H GLY 28 15.388 3.479 -11.393 203 HA2 GLY 28 HA2 GLY 28 15.758 3.801 -9.029 204 HA3 GLY 28 HA3 GLY 28 16.159 5.478 -9.368 205 H ASN 29 H ASN 29 13.473 4.153 -11.043 206 HA ASN 29 HA ASN 29 11.636 5.778 -9.425 207 HB2 ASN 29 HB2 ASN 29 11.169 4.323 -12.047 208 HB3 ASN 29 HB3 ASN 29 10.031 5.402 -11.255 209 HD21 ASN 29 HD21 ASN 29 12.855 5.125 -13.168 210 HD22 ASN 29 HD22 ASN 29 13.028 6.808 -13.549 211 HA PRO 30 HA PRO 30 10.165 2.140 -7.436 212 HB2 PRO 30 HB2 PRO 30 8.035 3.222 -6.210 213 HB3 PRO 30 HB3 PRO 30 9.688 3.592 -5.702 214 HG2 PRO 30 HG2 PRO 30 7.840 5.189 -7.432 215 HG3 PRO 30 HG3 PRO 30 8.887 5.740 -6.113 216 HD2 PRO 30 HD2 PRO 30 9.557 5.972 -8.738 217 HD3 PRO 30 HD3 PRO 30 10.754 5.778 -7.442 218 H SER 31 H SER 31 8.660 0.606 -7.753 219 HA SER 31 HA SER 31 6.411 1.197 -9.547 220 HB2 SER 31 HB2 SER 31 8.066 -0.056 -10.816 221 HB3 SER 31 HB3 SER 31 8.213 -1.236 -9.520 222 HG SER 31 HG SER 31 6.665 -2.273 -10.446 223 H LEU 32 H LEU 32 4.474 0.238 -8.940 224 HA LEU 32 HA LEU 32 4.578 -1.141 -6.348 225 HB2 LEU 32 HB2 LEU 32 3.757 1.304 -6.390 226 HB3 LEU 32 HB3 LEU 32 2.313 0.657 -7.146 227 HG LEU 32 HG LEU 32 2.169 -0.920 -5.135 228 HD11 LEU 32 HD11 LEU 32 4.086 1.131 -4.034 229 HD12 LEU 32 HD12 LEU 32 4.434 -0.577 -4.311 230 HD13 LEU 32 HD13 LEU 32 3.247 -0.104 -3.095 231 HD21 LEU 32 HD21 LEU 32 1.022 0.754 -3.807 232 HD22 LEU 32 HD22 LEU 32 0.666 0.965 -5.521 233 HD23 LEU 32 HD23 LEU 32 1.810 2.042 -4.718 234 H SER 33 H SER 33 3.737 -3.066 -6.385 235 HA SER 33 HA SER 33 1.740 -3.707 -8.456 236 HB2 SER 33 HB2 SER 33 3.713 -5.597 -7.145 237 HB3 SER 33 HB3 SER 33 2.622 -5.971 -8.481 238 HG SER 33 HG SER 33 4.317 -3.808 -8.854 239 H VAL 34 H VAL 34 -0.221 -4.009 -7.624 240 HA VAL 34 HA VAL 34 -0.414 -5.296 -4.989 241 HB VAL 34 HB VAL 34 -2.161 -3.093 -6.103 242 HG11 VAL 34 HG11 VAL 34 -3.492 -3.300 -4.063 243 HG12 VAL 34 HG12 VAL 34 -2.545 -4.707 -3.579 244 HG13 VAL 34 HG13 VAL 34 -3.562 -4.779 -5.020 245 HG21 VAL 34 HG21 VAL 34 -1.467 -1.901 -4.075 246 HG22 VAL 34 HG22 VAL 34 -0.084 -2.339 -5.081 247 HG23 VAL 34 HG23 VAL 34 -0.447 -3.269 -3.626 248 H ILE 35 H ILE 35 -1.374 -7.176 -5.030 249 HA ILE 35 HA ILE 35 -3.279 -7.779 -7.208 250 HB ILE 35 HB ILE 35 -1.659 -9.990 -6.038 251 HG12 ILE 35 HG12 ILE 35 -0.619 -8.079 -8.139 252 HG13 ILE 35 HG13 ILE 35 0.057 -8.323 -6.538 253 HG21 ILE 35 HG21 ILE 35 -2.673 -9.408 -8.815 254 HG22 ILE 35 HG22 ILE 35 -3.503 -10.387 -7.606 255 HG23 ILE 35 HG23 ILE 35 -1.954 -10.923 -8.264 256 HD11 ILE 35 HD11 ILE 35 0.661 -10.605 -7.127 257 HD12 ILE 35 HD12 ILE 35 1.375 -9.443 -8.245 258 HD13 ILE 35 HD13 ILE 35 -0.037 -10.381 -8.731 259 HA PRO 36 HA PRO 36 -5.967 -8.739 -3.777 260 HB2 PRO 36 HB2 PRO 36 -7.739 -10.297 -5.194 261 HB3 PRO 36 HB3 PRO 36 -7.786 -8.534 -5.134 262 HG2 PRO 36 HG2 PRO 36 -6.653 -10.328 -7.239 263 HG3 PRO 36 HG3 PRO 36 -7.576 -8.825 -7.423 264 HD2 PRO 36 HD2 PRO 36 -4.907 -8.899 -7.717 265 HD3 PRO 36 HD3 PRO 36 -5.728 -7.494 -7.002 266 H SER 37 H SER 37 -5.798 -10.269 -2.275 267 HA SER 37 HA SER 37 -4.399 -12.704 -2.748 268 HB2 SER 37 HB2 SER 37 -4.488 -11.404 -0.559 269 HB3 SER 37 HB3 SER 37 -6.110 -12.061 -0.341 270 HG SER 37 HG SER 37 -5.300 -13.955 0.129 271 H ASN 38 H ASN 38 -7.778 -11.796 -2.289 272 HA ASN 38 HA ASN 38 -8.549 -14.403 -3.413 273 HB2 ASN 38 HB2 ASN 38 -10.299 -12.293 -2.116 274 HB3 ASN 38 HB3 ASN 38 -10.836 -13.867 -2.691 275 HD21 ASN 38 HD21 ASN 38 -10.368 -15.697 -1.490 276 HD22 ASN 38 HD22 ASN 38 -9.803 -15.610 0.144 277 HA PRO 39 HA PRO 39 -8.706 -11.722 -7.062 278 HB2 PRO 39 HB2 PRO 39 -8.861 -13.766 -8.861 279 HB3 PRO 39 HB3 PRO 39 -7.343 -13.202 -8.156 280 HG2 PRO 39 HG2 PRO 39 -9.011 -15.567 -7.414 281 HG3 PRO 39 HG3 PRO 39 -7.246 -15.422 -7.518 282 HD2 PRO 39 HD2 PRO 39 -8.594 -15.342 -5.160 283 HD3 PRO 39 HD3 PRO 39 -7.074 -14.467 -5.435 284 H TYR 40 H TYR 40 -10.839 -14.349 -6.187 285 HA TYR 40 HA TYR 40 -12.860 -13.702 -8.102 286 HB2 TYR 40 HB2 TYR 40 -13.036 -15.418 -5.614 287 HB3 TYR 40 HB3 TYR 40 -14.215 -15.373 -6.923 288 HD1 TYR 40 HD1 TYR 40 -13.490 -16.135 -9.223 289 HD2 TYR 40 HD2 TYR 40 -11.140 -16.815 -5.744 290 HE1 TYR 40 HE1 TYR 40 -12.239 -17.879 -10.418 291 HE2 TYR 40 HE2 TYR 40 -9.879 -18.563 -6.932 292 HH TYR 40 HH TYR 40 -10.203 -20.081 -8.860 293 H GLN 41 H GLN 41 -12.036 -12.600 -4.944 294 HA GLN 41 HA GLN 41 -14.603 -11.664 -4.160 295 HB2 GLN 41 HB2 GLN 41 -12.708 -12.055 -2.585 296 HB3 GLN 41 HB3 GLN 41 -11.898 -10.649 -3.270 297 HG2 GLN 41 HG2 GLN 41 -12.932 -9.931 -1.280 298 HG3 GLN 41 HG3 GLN 41 -13.902 -9.299 -2.610 299 HE21 GLN 41 HE21 GLN 41 -13.754 -11.515 0.032 300 HE22 GLN 41 HE22 GLN 41 -15.442 -11.923 0.049 301 H GLU 42 H GLU 42 -12.019 -10.393 -6.111 302 HA GLU 42 HA GLU 42 -12.941 -7.708 -6.238 303 HB2 GLU 42 HB2 GLU 42 -11.305 -9.216 -8.288 304 HB3 GLU 42 HB3 GLU 42 -11.423 -7.470 -8.120 305 HG2 GLU 42 HG2 GLU 42 -10.204 -9.374 -6.132 306 HG3 GLU 42 HG3 GLU 42 -9.329 -8.299 -7.221 307 H GLN 43 H GLN 43 -13.882 -10.651 -7.768 308 HA GLN 43 HA GLN 43 -15.567 -9.291 -9.703 309 HB2 GLN 43 HB2 GLN 43 -14.436 -11.529 -10.128 310 HB3 GLN 43 HB3 GLN 43 -15.588 -12.226 -8.998 311 HG2 GLN 43 HG2 GLN 43 -16.273 -12.527 -11.326 312 HG3 GLN 43 HG3 GLN 43 -17.435 -11.563 -10.413 313 HE21 GLN 43 HE21 GLN 43 -17.687 -9.391 -10.893 314 HE22 GLN 43 HE22 GLN 43 -17.028 -8.668 -12.320 315 H LEU 44 H LEU 44 -15.855 -11.115 -6.711 316 HA LEU 44 HA LEU 44 -18.740 -10.777 -6.570 317 HB2 LEU 44 HB2 LEU 44 -16.877 -11.880 -4.471 318 HB3 LEU 44 HB3 LEU 44 -18.608 -12.122 -4.584 319 HG LEU 44 HG LEU 44 -16.714 -13.156 -6.677 320 HD11 LEU 44 HD11 LEU 44 -16.054 -14.044 -4.493 321 HD12 LEU 44 HD12 LEU 44 -16.763 -15.295 -5.515 322 HD13 LEU 44 HD13 LEU 44 -17.710 -14.580 -4.209 323 HD21 LEU 44 HD21 LEU 44 -19.527 -13.891 -5.873 324 HD22 LEU 44 HD22 LEU 44 -18.574 -14.707 -7.112 325 HD23 LEU 44 HD23 LEU 44 -19.047 -13.022 -7.331 326 H SER 45 H SER 45 -17.549 -8.283 -6.601 327 HA SER 45 HA SER 45 -16.754 -7.458 -3.986 328 HB2 SER 45 HB2 SER 45 -17.426 -5.671 -6.322 329 HB3 SER 45 HB3 SER 45 -16.410 -5.296 -4.928 330 HG SER 45 HG SER 45 -15.396 -7.462 -5.939 331 H ASP 46 H ASP 46 -18.560 -8.015 -2.732 332 HA ASP 46 HA ASP 46 -20.859 -6.218 -2.910 333 HB2 ASP 46 HB2 ASP 46 -21.186 -8.603 -2.265 334 HB3 ASP 46 HB3 ASP 46 -20.175 -8.340 -0.850 335 H THR 47 H THR 47 -17.788 -6.121 -1.975 336 HA THR 47 HA THR 47 -18.151 -4.413 0.367 337 HB THR 47 HB THR 47 -15.527 -4.583 0.238 338 HG1 THR 47 HG1 THR 47 -16.165 -7.072 -0.961 339 HG21 THR 47 HG21 THR 47 -17.241 -6.926 1.078 340 HG22 THR 47 HG22 THR 47 -16.889 -5.501 2.057 341 HG23 THR 47 HG23 THR 47 -15.591 -6.610 1.615 342 HA PRO 48 HA PRO 48 -17.402 -0.829 -2.142 343 HB2 PRO 48 HB2 PRO 48 -16.707 0.920 -0.206 344 HB3 PRO 48 HB3 PRO 48 -18.367 0.354 -0.413 345 HG2 PRO 48 HG2 PRO 48 -16.278 -0.570 1.527 346 HG3 PRO 48 HG3 PRO 48 -17.997 -0.238 1.811 347 HD2 PRO 48 HD2 PRO 48 -17.025 -2.747 1.462 348 HD3 PRO 48 HD3 PRO 48 -18.660 -2.272 0.960 349 H LEU 49 H LEU 49 -15.702 0.364 -3.015 350 HA LEU 49 HA LEU 49 -13.027 -0.589 -2.348 351 HB2 LEU 49 HB2 LEU 49 -14.138 0.996 -4.641 352 HB3 LEU 49 HB3 LEU 49 -12.417 0.929 -4.335 353 HG LEU 49 HG LEU 49 -14.168 -1.455 -4.924 354 HD11 LEU 49 HD11 LEU 49 -13.866 0.011 -6.853 355 HD12 LEU 49 HD12 LEU 49 -12.969 -1.494 -7.052 356 HD13 LEU 49 HD13 LEU 49 -12.119 -0.011 -6.598 357 HD21 LEU 49 HD21 LEU 49 -11.180 -1.202 -4.599 358 HD22 LEU 49 HD22 LEU 49 -12.044 -2.656 -5.099 359 HD23 LEU 49 HD23 LEU 49 -12.279 -2.004 -3.476 360 H ILE 50 H ILE 50 -11.844 0.473 -0.943 361 HA ILE 50 HA ILE 50 -12.278 3.335 -0.552 362 HB ILE 50 HB ILE 50 -10.372 1.465 0.875 363 HG12 ILE 50 HG12 ILE 50 -12.965 2.667 1.865 364 HG13 ILE 50 HG13 ILE 50 -12.821 1.032 1.234 365 HG21 ILE 50 HG21 ILE 50 -9.559 3.744 0.903 366 HG22 ILE 50 HG22 ILE 50 -10.175 3.327 2.503 367 HG23 ILE 50 HG23 ILE 50 -11.138 4.335 1.419 368 HD11 ILE 50 HD11 ILE 50 -12.804 1.067 3.666 369 HD12 ILE 50 HD12 ILE 50 -11.387 2.117 3.644 370 HD13 ILE 50 HD13 ILE 50 -11.275 0.469 3.023 371 HA PRO 51 HA PRO 51 -8.868 4.002 -3.376 372 HB2 PRO 51 HB2 PRO 51 -8.976 6.688 -3.377 373 HB3 PRO 51 HB3 PRO 51 -10.182 5.713 -4.226 374 HG2 PRO 51 HG2 PRO 51 -10.360 7.028 -1.542 375 HG3 PRO 51 HG3 PRO 51 -11.563 6.970 -2.840 376 HD2 PRO 51 HD2 PRO 51 -11.633 5.324 -0.667 377 HD3 PRO 51 HD3 PRO 51 -12.285 4.871 -2.253 378 H LEU 52 H LEU 52 -6.768 4.185 -2.974 379 HA LEU 52 HA LEU 52 -5.900 5.606 -0.556 380 HB2 LEU 52 HB2 LEU 52 -5.002 2.901 -1.532 381 HB3 LEU 52 HB3 LEU 52 -4.102 3.836 -0.350 382 HG LEU 52 HG LEU 52 -6.491 3.800 0.870 383 HD11 LEU 52 HD11 LEU 52 -7.587 2.513 -0.863 384 HD12 LEU 52 HD12 LEU 52 -7.498 1.590 0.638 385 HD13 LEU 52 HD13 LEU 52 -6.391 1.229 -0.687 386 HD21 LEU 52 HD21 LEU 52 -4.437 1.599 0.957 387 HD22 LEU 52 HD22 LEU 52 -5.654 1.915 2.195 388 HD23 LEU 52 HD23 LEU 52 -4.397 3.108 1.869 389 H THR 53 H THR 53 -4.239 6.941 -0.826 390 HA THR 53 HA THR 53 -2.925 6.967 -3.470 391 HB THR 53 HB THR 53 -3.019 9.256 -1.500 392 HG1 THR 53 HG1 THR 53 -5.081 8.218 -2.769 393 HG21 THR 53 HG21 THR 53 -2.563 9.134 -4.486 394 HG22 THR 53 HG22 THR 53 -1.328 9.414 -3.257 395 HG23 THR 53 HG23 THR 53 -2.604 10.605 -3.514 396 H ILE 54 H ILE 54 -0.917 6.207 -3.455 397 HA ILE 54 HA ILE 54 0.544 6.240 -0.902 398 HB ILE 54 HB ILE 54 0.968 4.410 -3.269 399 HG12 ILE 54 HG12 ILE 54 -0.378 3.975 -0.594 400 HG13 ILE 54 HG13 ILE 54 -1.130 3.892 -2.182 401 HG21 ILE 54 HG21 ILE 54 3.013 4.830 -2.007 402 HG22 ILE 54 HG22 ILE 54 2.450 3.176 -1.760 403 HG23 ILE 54 HG23 ILE 54 2.190 4.392 -0.510 404 HD11 ILE 54 HD11 ILE 54 -0.739 1.684 -1.205 405 HD12 ILE 54 HD12 ILE 54 0.992 2.020 -1.172 406 HD13 ILE 54 HD13 ILE 54 0.142 1.913 -2.713 407 H PHE 55 H PHE 55 2.243 7.465 -0.736 408 HA PHE 55 HA PHE 55 3.494 8.534 -3.180 409 HB2 PHE 55 HB2 PHE 55 3.418 9.618 -0.357 410 HB3 PHE 55 HB3 PHE 55 4.386 10.310 -1.649 411 HD1 PHE 55 HD1 PHE 55 0.917 9.605 -0.586 412 HD2 PHE 55 HD2 PHE 55 3.470 11.820 -3.170 413 HE1 PHE 55 HE1 PHE 55 -0.982 11.028 -1.242 414 HE2 PHE 55 HE2 PHE 55 1.575 13.243 -3.829 415 HZ PHE 55 HZ PHE 55 -0.653 12.846 -2.867 416 H VAL 56 H VAL 56 5.572 8.033 -3.601 417 HA VAL 56 HA VAL 56 7.005 6.375 -1.708 418 HB VAL 56 HB VAL 56 7.422 7.092 -4.564 419 HG11 VAL 56 HG11 VAL 56 9.747 6.238 -4.505 420 HG12 VAL 56 HG12 VAL 56 9.683 6.233 -2.742 421 HG13 VAL 56 HG13 VAL 56 9.576 7.756 -3.627 422 HG21 VAL 56 HG21 VAL 56 7.920 4.689 -4.676 423 HG22 VAL 56 HG22 VAL 56 6.354 5.016 -3.926 424 HG23 VAL 56 HG23 VAL 56 7.741 4.597 -2.920 425 H GLY 57 H GLY 57 8.663 6.933 -0.488 426 HA2 GLY 57 HA2 GLY 57 9.660 9.694 -0.746 427 HA3 GLY 57 HA3 GLY 57 9.373 8.908 0.797 428 H GLU 58 H GLU 58 11.824 9.991 0.215 429 HA GLU 58 HA GLU 58 13.406 7.546 0.431 430 HB2 GLU 58 HB2 GLU 58 15.292 8.742 -0.768 431 HB3 GLU 58 HB3 GLU 58 13.945 8.235 -1.777 432 HG2 GLU 58 HG2 GLU 58 13.057 10.525 -1.701 433 HG3 GLU 58 HG3 GLU 58 14.457 11.016 -0.746 434 H ASN 59 H ASN 59 12.290 8.920 2.444 435 HA ASN 59 HA ASN 59 14.567 10.248 3.738 436 HB2 ASN 59 HB2 ASN 59 12.866 11.905 3.072 437 HB3 ASN 59 HB3 ASN 59 11.639 10.996 3.939 438 HD21 ASN 59 HD21 ASN 59 12.652 13.768 4.207 439 HD22 ASN 59 HD22 ASN 59 13.108 13.935 5.866 440 H THR 60 H THR 60 15.186 9.176 5.472 441 HA THR 60 HA THR 60 13.205 8.025 7.270 442 HB THR 60 HB THR 60 15.534 6.357 6.280 443 HG1 THR 60 HG1 THR 60 13.035 6.749 5.254 444 HG21 THR 60 HG21 THR 60 14.842 5.870 8.582 445 HG22 THR 60 HG22 THR 60 14.412 4.544 7.504 446 HG23 THR 60 HG23 THR 60 13.173 5.676 8.046 447 H GLY 61 H GLY 61 13.845 9.772 8.572 448 HA2 GLY 61 HA2 GLY 61 15.080 10.024 10.655 449 HA3 GLY 61 HA3 GLY 61 16.498 9.418 9.810 450 H VAL 62 H VAL 62 16.706 10.835 7.588 451 HA VAL 62 HA VAL 62 16.761 13.625 8.506 452 HB VAL 62 HB VAL 62 19.025 12.799 8.501 453 HG11 VAL 62 HG11 VAL 62 20.120 11.957 6.480 454 HG12 VAL 62 HG12 VAL 62 18.583 12.030 5.620 455 HG13 VAL 62 HG13 VAL 62 18.780 10.921 6.977 456 HG21 VAL 62 HG21 VAL 62 20.069 14.374 6.939 457 HG22 VAL 62 HG22 VAL 62 18.699 15.099 7.779 458 HG23 VAL 62 HG23 VAL 62 18.524 14.567 6.109 459 H1 GLY 1 H1 GLY 1 -17.328 12.749 5.096 460 H2 GLY 1 H2 GLY 1 -16.000 12.195 5.990 461 H3 GLY 1 H3 GLY 1 -16.047 11.958 4.312 462 HA2 GLY 1 HA2 GLY 1 -15.992 14.369 3.974 463 HA3 GLY 1 HA3 GLY 1 -15.838 14.564 5.714 464 H ALA 2 H ALA 2 -14.150 14.455 2.886 465 HA ALA 2 HA ALA 2 -11.774 13.166 3.993 466 HB1 ALA 2 HB1 ALA 2 -10.852 13.358 1.744 467 HB2 ALA 2 HB2 ALA 2 -12.263 14.287 1.236 468 HB3 ALA 2 HB3 ALA 2 -12.442 12.597 1.710 469 H MET 3 H MET 3 -12.332 15.395 5.404 470 HA MET 3 HA MET 3 -10.747 17.608 4.379 471 HB2 MET 3 HB2 MET 3 -12.198 17.212 7.002 472 HB3 MET 3 HB3 MET 3 -11.303 18.666 6.581 473 HG2 MET 3 HG2 MET 3 -12.808 19.079 4.725 474 HG3 MET 3 HG3 MET 3 -13.684 17.590 5.087 475 HE1 MET 3 HE1 MET 3 -12.716 21.166 6.395 476 HE2 MET 3 HE2 MET 3 -12.192 20.109 7.705 477 HE3 MET 3 HE3 MET 3 -13.549 21.209 7.949 478 H GLU 4 H GLU 4 -10.736 15.646 7.339 479 HA GLU 4 HA GLU 4 -7.829 15.989 7.493 480 HB2 GLU 4 HB2 GLU 4 -9.240 16.598 9.474 481 HB3 GLU 4 HB3 GLU 4 -9.736 14.915 9.582 482 HG2 GLU 4 HG2 GLU 4 -7.457 14.238 10.028 483 HG3 GLU 4 HG3 GLU 4 -6.905 15.903 9.832 484 H MET 5 H MET 5 -7.385 14.517 5.843 485 HA MET 5 HA MET 5 -8.489 11.867 5.908 486 HB2 MET 5 HB2 MET 5 -7.132 11.493 3.886 487 HB3 MET 5 HB3 MET 5 -8.117 12.946 3.771 488 HG2 MET 5 HG2 MET 5 -6.066 14.232 4.480 489 HG3 MET 5 HG3 MET 5 -5.158 12.746 4.214 490 HE1 MET 5 HE1 MET 5 -6.969 11.603 1.742 491 HE2 MET 5 HE2 MET 5 -5.212 11.455 1.788 492 HE3 MET 5 HE3 MET 5 -6.004 12.140 0.368 493 HA PRO 6 HA PRO 6 -5.487 10.124 8.622 494 HB2 PRO 6 HB2 PRO 6 -6.036 7.505 8.043 495 HB3 PRO 6 HB3 PRO 6 -7.023 8.506 9.114 496 HG2 PRO 6 HG2 PRO 6 -7.450 7.820 6.233 497 HG3 PRO 6 HG3 PRO 6 -8.631 7.888 7.557 498 HD2 PRO 6 HD2 PRO 6 -8.389 9.875 5.755 499 HD3 PRO 6 HD3 PRO 6 -8.802 10.191 7.452 500 H THR 7 H THR 7 -3.398 9.636 8.423 501 HA THR 7 HA THR 7 -2.429 8.810 5.768 502 HB THR 7 HB THR 7 -0.884 10.410 7.801 503 HG1 THR 7 HG1 THR 7 -2.967 11.290 6.571 504 HG21 THR 7 HG21 THR 7 -0.497 9.980 4.842 505 HG22 THR 7 HG22 THR 7 0.453 9.237 6.128 506 HG23 THR 7 HG23 THR 7 0.518 10.982 5.881 507 H PHE 8 H PHE 8 -1.143 7.064 5.645 508 HA PHE 8 HA PHE 8 -0.189 5.854 8.163 509 HB2 PHE 8 HB2 PHE 8 -0.904 4.519 5.538 510 HB3 PHE 8 HB3 PHE 8 -0.208 3.697 6.924 511 HD1 PHE 8 HD1 PHE 8 -3.174 5.572 5.762 512 HD2 PHE 8 HD2 PHE 8 -1.566 2.913 8.667 513 HE1 PHE 8 HE1 PHE 8 -5.443 5.152 6.622 514 HE2 PHE 8 HE2 PHE 8 -3.834 2.484 9.535 515 HZ PHE 8 HZ PHE 8 -5.773 3.604 8.511 516 H TYR 9 H TYR 9 1.969 5.282 8.292 517 HA TYR 9 HA TYR 9 3.609 5.775 5.892 518 HB2 TYR 9 HB2 TYR 9 3.696 7.493 7.874 519 HB3 TYR 9 HB3 TYR 9 4.659 6.254 8.665 520 HD1 TYR 9 HD1 TYR 9 6.868 5.595 7.681 521 HD2 TYR 9 HD2 TYR 9 4.586 8.839 6.141 522 HE1 TYR 9 HE1 TYR 9 8.868 6.454 6.523 523 HE2 TYR 9 HE2 TYR 9 6.575 9.708 4.991 524 HH TYR 9 HH TYR 9 9.497 7.899 4.734 525 H LEU 10 H LEU 10 4.702 4.030 5.286 526 HA LEU 10 HA LEU 10 5.686 2.175 7.311 527 HB2 LEU 10 HB2 LEU 10 4.953 0.258 5.764 528 HB3 LEU 10 HB3 LEU 10 3.760 0.995 6.811 529 HG LEU 10 HG LEU 10 3.149 2.425 4.743 530 HD11 LEU 10 HD11 LEU 10 4.556 0.124 3.401 531 HD12 LEU 10 HD12 LEU 10 5.059 1.815 3.363 532 HD13 LEU 10 HD13 LEU 10 3.544 1.328 2.604 533 HD21 LEU 10 HD21 LEU 10 2.536 -0.524 4.875 534 HD22 LEU 10 HD22 LEU 10 1.610 0.677 3.974 535 HD23 LEU 10 HD23 LEU 10 1.690 0.763 5.735 536 H ALA 11 H ALA 11 7.379 0.740 6.509 537 HA ALA 11 HA ALA 11 8.679 1.793 4.084 538 HB1 ALA 11 HB1 ALA 11 10.841 1.408 5.120 539 HB2 ALA 11 HB2 ALA 11 10.046 0.849 6.592 540 HB3 ALA 11 HB3 ALA 11 9.870 2.527 6.076 541 H LEU 12 H LEU 12 9.215 0.373 2.583 542 HA LEU 12 HA LEU 12 8.838 -2.481 3.239 543 HB2 LEU 12 HB2 LEU 12 8.177 -1.123 0.628 544 HB3 LEU 12 HB3 LEU 12 7.853 -2.786 1.056 545 HG LEU 12 HG LEU 12 6.540 -0.367 2.292 546 HD11 LEU 12 HD11 LEU 12 5.466 -2.463 0.411 547 HD12 LEU 12 HD12 LEU 12 5.830 -0.787 -0.004 548 HD13 LEU 12 HD13 LEU 12 4.540 -1.153 1.142 549 HD21 LEU 12 HD21 LEU 12 5.078 -1.987 3.402 550 HD22 LEU 12 HD22 LEU 12 6.757 -2.182 3.905 551 HD23 LEU 12 HD23 LEU 12 6.047 -3.310 2.749 552 H HIS 13 H HIS 13 10.292 -3.919 2.406 553 HA HIS 13 HA HIS 13 12.800 -2.920 1.485 554 HB2 HIS 13 HB2 HIS 13 11.681 -5.714 1.734 555 HB3 HIS 13 HB3 HIS 13 13.295 -5.398 1.102 556 HD1 HIS 13 HD1 HIS 13 11.637 -6.186 4.173 557 HD2 HIS 13 HD2 HIS 13 14.847 -3.765 3.093 558 HE1 HIS 13 HE1 HIS 13 12.904 -5.742 6.300 559 HE2 HIS 13 HE2 HIS 13 14.771 -4.177 5.640 560 H GLY 14 H GLY 14 13.563 -2.672 -0.516 561 HA2 GLY 14 HA2 GLY 14 11.845 -2.556 -2.723 562 HA3 GLY 14 HA3 GLY 14 13.600 -2.530 -2.803 563 H GLY 15 H GLY 15 10.829 -4.230 -3.607 564 HA2 GLY 15 HA2 GLY 15 10.898 -6.034 -5.150 565 HA3 GLY 15 HA3 GLY 15 12.473 -6.484 -4.520 566 H GLN 16 H GLN 16 10.636 -5.827 -1.888 567 HA GLN 16 HA GLN 16 10.218 -8.659 -1.393 568 HB2 GLN 16 HB2 GLN 16 10.972 -6.456 0.183 569 HB3 GLN 16 HB3 GLN 16 9.386 -6.942 0.769 570 HG2 GLN 16 HG2 GLN 16 11.577 -8.932 0.355 571 HG3 GLN 16 HG3 GLN 16 11.443 -7.996 1.843 572 HE21 GLN 16 HE21 GLN 16 9.884 -8.477 3.303 573 HE22 GLN 16 HE22 GLN 16 8.839 -9.850 3.160 574 H THR 17 H THR 17 8.257 -9.592 -0.904 575 HA THR 17 HA THR 17 5.915 -8.138 -1.891 576 HB THR 17 HB THR 17 6.071 -11.058 -1.085 577 HG1 THR 17 HG1 THR 17 7.238 -9.820 -3.174 578 HG21 THR 17 HG21 THR 17 3.812 -10.129 -1.286 579 HG22 THR 17 HG22 THR 17 4.139 -11.287 -2.575 580 HG23 THR 17 HG23 THR 17 4.185 -9.555 -2.912 581 H TYR 18 H TYR 18 4.237 -7.601 -0.633 582 HA TYR 18 HA TYR 18 4.257 -8.423 2.189 583 HB2 TYR 18 HB2 TYR 18 3.871 -5.651 1.057 584 HB3 TYR 18 HB3 TYR 18 3.393 -6.090 2.691 585 HD1 TYR 18 HD1 TYR 18 6.231 -5.483 0.447 586 HD2 TYR 18 HD2 TYR 18 5.050 -6.492 4.406 587 HE1 TYR 18 HE1 TYR 18 8.508 -5.007 1.242 588 HE2 TYR 18 HE2 TYR 18 7.315 -6.018 5.219 589 HH TYR 18 HH TYR 18 9.514 -5.737 4.513 590 H HIS 19 H HIS 19 2.264 -8.503 3.195 591 HA HIS 19 HA HIS 19 -0.052 -8.737 1.436 592 HB2 HIS 19 HB2 HIS 19 0.698 -9.688 4.150 593 HB3 HIS 19 HB3 HIS 19 -1.003 -9.364 3.879 594 HD1 HIS 19 HD1 HIS 19 0.864 -12.155 4.142 595 HD2 HIS 19 HD2 HIS 19 -1.411 -10.715 0.963 596 HE1 HIS 19 HE1 HIS 19 0.364 -14.153 2.704 597 HE2 HIS 19 HE2 HIS 19 -1.195 -13.301 0.925 598 H LEU 20 H LEU 20 -1.280 -7.056 1.159 599 HA LEU 20 HA LEU 20 -1.289 -4.902 3.153 600 HB2 LEU 20 HB2 LEU 20 -0.455 -4.016 1.147 601 HB3 LEU 20 HB3 LEU 20 -1.552 -4.960 0.162 602 HG LEU 20 HG LEU 20 -3.413 -3.524 0.823 603 HD11 LEU 20 HD11 LEU 20 -1.335 -2.031 2.413 604 HD12 LEU 20 HD12 LEU 20 -2.710 -2.939 3.052 605 HD13 LEU 20 HD13 LEU 20 -2.983 -1.474 2.105 606 HD21 LEU 20 HD21 LEU 20 -2.096 -2.941 -1.150 607 HD22 LEU 20 HD22 LEU 20 -1.014 -1.974 -0.148 608 HD23 LEU 20 HD23 LEU 20 -2.700 -1.496 -0.336 609 H ILE 21 H ILE 21 -3.057 -4.678 4.292 610 HA ILE 21 HA ILE 21 -5.639 -5.463 3.112 611 HB ILE 21 HB ILE 21 -4.846 -5.924 5.993 612 HG12 ILE 21 HG12 ILE 21 -5.317 -8.157 4.062 613 HG13 ILE 21 HG13 ILE 21 -3.755 -7.342 4.043 614 HG21 ILE 21 HG21 ILE 21 -7.252 -6.828 4.412 615 HG22 ILE 21 HG22 ILE 21 -7.235 -5.565 5.642 616 HG23 ILE 21 HG23 ILE 21 -6.909 -7.240 6.092 617 HD11 ILE 21 HD11 ILE 21 -3.752 -9.350 5.431 618 HD12 ILE 21 HD12 ILE 21 -5.004 -8.636 6.451 619 HD13 ILE 21 HD13 ILE 21 -3.405 -7.891 6.360 620 H VAL 22 H VAL 22 -7.052 -3.818 3.156 621 HA VAL 22 HA VAL 22 -6.750 -1.804 5.283 622 HB VAL 22 HB VAL 22 -6.406 -0.871 3.010 623 HG11 VAL 22 HG11 VAL 22 -9.264 -1.716 2.579 624 HG12 VAL 22 HG12 VAL 22 -7.841 -2.273 1.694 625 HG13 VAL 22 HG13 VAL 22 -8.382 -0.599 1.530 626 HG21 VAL 22 HG21 VAL 22 -7.191 0.583 4.767 627 HG22 VAL 22 HG22 VAL 22 -8.861 0.111 4.453 628 HG23 VAL 22 HG23 VAL 22 -7.961 1.023 3.243 629 H ASP 23 H ASP 23 -8.427 -1.503 6.611 630 HA ASP 23 HA ASP 23 -11.068 -2.472 5.830 631 HB2 ASP 23 HB2 ASP 23 -11.378 -3.746 7.843 632 HB3 ASP 23 HB3 ASP 23 -9.914 -4.315 7.060 633 H THR 24 H THR 24 -12.697 -1.813 7.599 634 HA THR 24 HA THR 24 -11.912 0.806 8.687 635 HB THR 24 HB THR 24 -14.402 1.393 8.317 636 HG1 THR 24 HG1 THR 24 -14.812 -0.901 7.649 637 HG21 THR 24 HG21 THR 24 -13.954 2.169 6.027 638 HG22 THR 24 HG22 THR 24 -12.534 1.124 5.959 639 HG23 THR 24 HG23 THR 24 -12.586 2.471 7.099 640 H ASP 25 H ASP 25 -12.616 1.313 10.709 641 HA ASP 25 HA ASP 25 -13.681 -0.861 12.301 642 HB2 ASP 25 HB2 ASP 25 -12.957 0.304 14.163 643 HB3 ASP 25 HB3 ASP 25 -11.842 0.924 12.950 644 H SER 26 H SER 26 -15.322 0.268 14.143 645 HA SER 26 HA SER 26 -17.741 0.434 12.682 646 HB2 SER 26 HB2 SER 26 -17.473 -0.475 15.028 647 HB3 SER 26 HB3 SER 26 -17.356 1.193 15.582 648 HG SER 26 HG SER 26 -19.521 0.549 13.940 649 H LEU 27 H LEU 27 -15.553 2.844 13.974 650 HA LEU 27 HA LEU 27 -17.432 5.013 13.845 651 HB2 LEU 27 HB2 LEU 27 -14.422 5.108 13.968 652 HB3 LEU 27 HB3 LEU 27 -15.514 6.440 14.293 653 HG LEU 27 HG LEU 27 -15.358 3.915 15.938 654 HD11 LEU 27 HD11 LEU 27 -14.242 6.662 16.479 655 HD12 LEU 27 HD12 LEU 27 -13.302 5.221 16.090 656 HD13 LEU 27 HD13 LEU 27 -14.222 5.297 17.594 657 HD21 LEU 27 HD21 LEU 27 -16.699 5.181 17.543 658 HD22 LEU 27 HD22 LEU 27 -17.544 4.997 16.008 659 HD23 LEU 27 HD23 LEU 27 -16.779 6.532 16.414 660 H GLY 28 H GLY 28 -15.283 3.478 11.610 661 HA2 GLY 28 HA2 GLY 28 -15.655 3.810 9.250 662 HA3 GLY 28 HA3 GLY 28 -16.043 5.490 9.594 663 H ASN 29 H ASN 29 -13.367 4.140 11.265 664 HA ASN 29 HA ASN 29 -11.522 5.766 9.659 665 HB2 ASN 29 HB2 ASN 29 -11.059 4.297 12.275 666 HB3 ASN 29 HB3 ASN 29 -9.919 5.380 11.486 667 HD21 ASN 29 HD21 ASN 29 -12.739 5.108 13.415 668 HD22 ASN 29 HD22 ASN 29 -12.907 6.796 13.794 669 HA PRO 30 HA PRO 30 -10.060 2.138 7.649 670 HB2 PRO 30 HB2 PRO 30 -7.929 3.217 6.428 671 HB3 PRO 30 HB3 PRO 30 -9.582 3.597 5.924 672 HG2 PRO 30 HG2 PRO 30 -7.723 5.173 7.665 673 HG3 PRO 30 HG3 PRO 30 -8.764 5.738 6.348 674 HD2 PRO 30 HD2 PRO 30 -9.438 5.955 8.974 675 HD3 PRO 30 HD3 PRO 30 -10.635 5.779 7.674 676 H SER 31 H SER 31 -8.564 0.595 7.952 677 HA SER 31 HA SER 31 -6.312 1.162 9.751 678 HB2 SER 31 HB2 SER 31 -7.983 -0.088 11.005 679 HB3 SER 31 HB3 SER 31 -8.121 -1.265 9.705 680 HG SER 31 HG SER 31 -6.570 -2.299 10.634 681 H LEU 32 H LEU 32 -4.380 0.203 9.135 682 HA LEU 32 HA LEU 32 -4.490 -1.167 6.536 683 HB2 LEU 32 HB2 LEU 32 -3.658 1.271 6.593 684 HB3 LEU 32 HB3 LEU 32 -2.217 0.614 7.347 685 HG LEU 32 HG LEU 32 -2.082 -0.952 5.328 686 HD11 LEU 32 HD11 LEU 32 -3.983 1.116 4.235 687 HD12 LEU 32 HD12 LEU 32 -4.345 -0.587 4.513 688 HD13 LEU 32 HD13 LEU 32 -3.155 -0.126 3.296 689 HD21 LEU 32 HD21 LEU 32 -0.922 0.721 4.014 690 HD22 LEU 32 HD22 LEU 32 -0.569 0.922 5.730 691 HD23 LEU 32 HD23 LEU 32 -1.706 2.008 4.929 692 H SER 33 H SER 33 -3.658 -3.097 6.556 693 HA SER 33 HA SER 33 -1.673 -3.757 8.631 694 HB2 SER 33 HB2 SER 33 -3.646 -5.641 7.307 695 HB3 SER 33 HB3 SER 33 -2.565 -6.014 8.654 696 HG SER 33 HG SER 33 -4.208 -3.837 9.062 697 H VAL 34 H VAL 34 0.287 -4.066 7.805 698 HA VAL 34 HA VAL 34 0.487 -5.340 5.161 699 HB VAL 34 HB VAL 34 2.236 -3.147 6.287 700 HG11 VAL 34 HG11 VAL 34 3.570 -3.344 4.248 701 HG12 VAL 34 HG12 VAL 34 2.618 -4.747 3.759 702 HG13 VAL 34 HG13 VAL 34 3.635 -4.830 5.197 703 HG21 VAL 34 HG21 VAL 34 1.546 -1.942 4.265 704 HG22 VAL 34 HG22 VAL 34 0.164 -2.380 5.267 705 HG23 VAL 34 HG23 VAL 34 0.526 -3.304 3.807 706 H ILE 35 H ILE 35 1.434 -7.222 5.193 707 HA ILE 35 HA ILE 35 3.334 -7.850 7.365 708 HB ILE 35 HB ILE 35 1.702 -10.042 6.179 709 HG12 ILE 35 HG12 ILE 35 0.666 -8.138 8.289 710 HG13 ILE 35 HG13 ILE 35 -0.008 -8.372 6.687 711 HG21 ILE 35 HG21 ILE 35 2.725 -9.485 8.959 712 HG22 ILE 35 HG22 ILE 35 3.544 -10.461 7.740 713 HG23 ILE 35 HG23 ILE 35 1.994 -10.992 8.399 714 HD11 ILE 35 HD11 ILE 35 -0.617 -10.653 7.262 715 HD12 ILE 35 HD12 ILE 35 -1.329 -9.499 8.389 716 HD13 ILE 35 HD13 ILE 35 0.081 -10.443 8.866 717 HA PRO 36 HA PRO 36 6.017 -8.802 3.928 718 HB2 PRO 36 HB2 PRO 36 7.784 -10.377 5.338 719 HB3 PRO 36 HB3 PRO 36 7.839 -8.611 5.288 720 HG2 PRO 36 HG2 PRO 36 6.695 -10.415 7.380 721 HG3 PRO 36 HG3 PRO 36 7.623 -8.917 7.578 722 HD2 PRO 36 HD2 PRO 36 4.952 -8.979 7.868 723 HD3 PRO 36 HD3 PRO 36 5.779 -7.576 7.163 724 H SER 37 H SER 37 5.836 -10.321 2.416 725 HA SER 37 HA SER 37 4.439 -12.759 2.872 726 HB2 SER 37 HB2 SER 37 4.530 -11.451 0.690 727 HB3 SER 37 HB3 SER 37 6.153 -12.104 0.472 728 HG SER 37 HG SER 37 5.341 -13.980 -0.043 729 H ASN 38 H ASN 38 7.817 -11.857 2.428 730 HA ASN 38 HA ASN 38 8.573 -14.476 3.535 731 HB2 ASN 38 HB2 ASN 38 10.329 -12.367 2.244 732 HB3 ASN 38 HB3 ASN 38 10.860 -13.943 2.812 733 HD21 ASN 38 HD21 ASN 38 10.397 -15.761 1.608 734 HD22 ASN 38 HD22 ASN 38 9.828 -15.675 -0.021 735 HA PRO 39 HA PRO 39 8.743 -11.818 7.201 736 HB2 PRO 39 HB2 PRO 39 8.889 -13.876 8.989 737 HB3 PRO 39 HB3 PRO 39 7.374 -13.295 8.290 738 HG2 PRO 39 HG2 PRO 39 9.025 -15.670 7.532 739 HG3 PRO 39 HG3 PRO 39 7.261 -15.515 7.637 740 HD2 PRO 39 HD2 PRO 39 8.606 -15.431 5.280 741 HD3 PRO 39 HD3 PRO 39 7.094 -14.544 5.561 742 H TYR 40 H TYR 40 10.859 -14.444 6.316 743 HA TYR 40 HA TYR 40 12.887 -13.823 8.229 744 HB2 TYR 40 HB2 TYR 40 13.040 -15.525 5.732 745 HB3 TYR 40 HB3 TYR 40 14.227 -15.493 7.035 746 HD1 TYR 40 HD1 TYR 40 13.499 -16.260 9.339 747 HD2 TYR 40 HD2 TYR 40 11.150 -16.912 5.851 748 HE1 TYR 40 HE1 TYR 40 12.240 -18.009 10.520 749 HE2 TYR 40 HE2 TYR 40 9.882 -18.659 7.027 750 HH TYR 40 HH TYR 40 10.187 -20.189 8.939 751 H GLN 41 H GLN 41 12.059 -12.688 5.079 752 HA GLN 41 HA GLN 41 14.639 -11.771 4.304 753 HB2 GLN 41 HB2 GLN 41 12.744 -12.139 2.721 754 HB3 GLN 41 HB3 GLN 41 11.943 -10.734 3.411 755 HG2 GLN 41 HG2 GLN 41 12.985 -10.016 1.425 756 HG3 GLN 41 HG3 GLN 41 13.957 -9.394 2.758 757 HE21 GLN 41 HE21 GLN 41 13.815 -11.571 0.083 758 HE22 GLN 41 HE22 GLN 41 15.494 -12.011 0.085 759 H GLU 42 H GLU 42 12.061 -10.498 6.255 760 HA GLU 42 HA GLU 42 12.994 -7.817 6.403 761 HB2 GLU 42 HB2 GLU 42 11.352 -9.334 8.441 762 HB3 GLU 42 HB3 GLU 42 11.478 -7.586 8.285 763 HG2 GLU 42 HG2 GLU 42 10.252 -9.465 6.280 764 HG3 GLU 42 HG3 GLU 42 9.383 -8.398 7.379 765 H GLN 43 H GLN 43 13.922 -10.775 7.920 766 HA GLN 43 HA GLN 43 15.615 -9.439 9.859 767 HB2 GLN 43 HB2 GLN 43 14.468 -11.673 10.268 768 HB3 GLN 43 HB3 GLN 43 15.618 -12.369 9.137 769 HG2 GLN 43 HG2 GLN 43 16.299 -12.687 11.460 770 HG3 GLN 43 HG3 GLN 43 17.462 -11.720 10.556 771 HE21 GLN 43 HE21 GLN 43 17.730 -9.553 11.058 772 HE22 GLN 43 HE22 GLN 43 17.066 -8.843 12.488 773 H LEU 44 H LEU 44 15.897 -11.253 6.859 774 HA LEU 44 HA LEU 44 18.783 -10.927 6.718 775 HB2 LEU 44 HB2 LEU 44 16.901 -11.995 4.616 776 HB3 LEU 44 HB3 LEU 44 18.630 -12.244 4.714 777 HG LEU 44 HG LEU 44 16.744 -13.293 6.809 778 HD11 LEU 44 HD11 LEU 44 16.073 -14.163 4.626 779 HD12 LEU 44 HD12 LEU 44 16.781 -15.421 5.642 780 HD13 LEU 44 HD13 LEU 44 17.727 -14.705 4.337 781 HD21 LEU 44 HD21 LEU 44 19.551 -14.033 5.989 782 HD22 LEU 44 HD22 LEU 44 18.595 -14.852 7.224 783 HD23 LEU 44 HD23 LEU 44 19.081 -13.173 7.454 784 H SER 45 H SER 45 17.597 -8.425 6.766 785 HA SER 45 HA SER 45 16.811 -7.575 4.157 786 HB2 SER 45 HB2 SER 45 17.500 -5.799 6.495 787 HB3 SER 45 HB3 SER 45 16.467 -5.426 5.111 788 HG SER 45 HG SER 45 15.446 -7.580 6.108 789 H ASP 46 H ASP 46 18.605 -8.127 2.890 790 HA ASP 46 HA ASP 46 20.917 -6.344 3.085 791 HB2 ASP 46 HB2 ASP 46 21.249 -8.724 2.425 792 HB3 ASP 46 HB3 ASP 46 20.235 -8.452 1.012 793 H THR 47 H THR 47 17.845 -6.238 2.152 794 HA THR 47 HA THR 47 18.221 -4.514 -0.180 795 HB THR 47 HB THR 47 15.598 -4.669 -0.057 796 HG1 THR 47 HG1 THR 47 16.216 -7.167 1.128 797 HG21 THR 47 HG21 THR 47 17.306 -7.013 -0.903 798 HG22 THR 47 HG22 THR 47 16.963 -5.582 -1.874 799 HG23 THR 47 HG23 THR 47 15.659 -6.692 -1.446 800 HA PRO 48 HA PRO 48 17.489 -0.941 2.348 801 HB2 PRO 48 HB2 PRO 48 16.807 0.825 0.421 802 HB3 PRO 48 HB3 PRO 48 18.465 0.244 0.625 803 HG2 PRO 48 HG2 PRO 48 16.370 -0.657 -1.319 804 HG3 PRO 48 HG3 PRO 48 18.091 -0.331 -1.602 805 HD2 PRO 48 HD2 PRO 48 17.109 -2.835 -1.270 806 HD3 PRO 48 HD3 PRO 48 18.745 -2.370 -0.760 807 H LEU 49 H LEU 49 15.797 0.252 3.232 808 HA LEU 49 HA LEU 49 13.116 -0.679 2.550 809 HB2 LEU 49 HB2 LEU 49 14.235 0.886 4.851 810 HB3 LEU 49 HB3 LEU 49 12.515 0.829 4.547 811 HG LEU 49 HG LEU 49 14.255 -1.569 5.122 812 HD11 LEU 49 HD11 LEU 49 13.965 -0.108 7.060 813 HD12 LEU 49 HD12 LEU 49 13.058 -1.611 7.253 814 HD13 LEU 49 HD13 LEU 49 12.218 -0.120 6.809 815 HD21 LEU 49 HD21 LEU 49 11.267 -1.294 4.801 816 HD22 LEU 49 HD22 LEU 49 12.124 -2.758 5.289 817 HD23 LEU 49 HD23 LEU 49 12.361 -2.092 3.673 818 H ILE 50 H ILE 50 11.942 0.401 1.157 819 HA ILE 50 HA ILE 50 12.393 3.264 0.787 820 HB ILE 50 HB ILE 50 10.477 1.411 -0.653 821 HG12 ILE 50 HG12 ILE 50 13.080 2.598 -1.632 822 HG13 ILE 50 HG13 ILE 50 12.918 0.960 -1.018 823 HG21 ILE 50 HG21 ILE 50 9.678 3.695 -0.680 824 HG22 ILE 50 HG22 ILE 50 10.295 3.275 -2.279 825 HG23 ILE 50 HG23 ILE 50 11.262 4.278 -1.193 826 HD11 ILE 50 HD11 ILE 50 12.908 1.022 -3.453 827 HD12 ILE 50 HD12 ILE 50 11.494 2.077 -3.422 828 HD13 ILE 50 HD13 ILE 50 11.376 0.424 -2.818 829 HA PRO 51 HA PRO 51 8.981 3.933 3.603 830 HB2 PRO 51 HB2 PRO 51 9.104 6.615 3.621 831 HB3 PRO 51 HB3 PRO 51 10.303 5.626 4.463 832 HG2 PRO 51 HG2 PRO 51 10.488 6.960 1.788 833 HG3 PRO 51 HG3 PRO 51 11.691 6.883 3.088 834 HD2 PRO 51 HD2 PRO 51 11.751 5.252 0.902 835 HD3 PRO 51 HD3 PRO 51 12.403 4.787 2.487 836 H LEU 52 H LEU 52 6.883 4.120 3.196 837 HA LEU 52 HA LEU 52 6.020 5.561 0.785 838 HB2 LEU 52 HB2 LEU 52 5.113 2.853 1.755 839 HB3 LEU 52 HB3 LEU 52 4.212 3.796 0.578 840 HG LEU 52 HG LEU 52 6.601 3.757 -0.647 841 HD11 LEU 52 HD11 LEU 52 7.693 2.458 1.083 842 HD12 LEU 52 HD12 LEU 52 7.605 1.547 -0.425 843 HD13 LEU 52 HD13 LEU 52 6.496 1.176 0.896 844 HD21 LEU 52 HD21 LEU 52 4.541 1.558 -0.744 845 HD22 LEU 52 HD22 LEU 52 5.757 1.881 -1.981 846 HD23 LEU 52 HD23 LEU 52 4.501 3.073 -1.648 847 H THR 53 H THR 53 4.366 6.907 1.071 848 HA THR 53 HA THR 53 3.052 6.921 3.714 849 HB THR 53 HB THR 53 3.158 9.223 1.755 850 HG1 THR 53 HG1 THR 53 5.212 8.168 3.029 851 HG21 THR 53 HG21 THR 53 2.703 9.085 4.739 852 HG22 THR 53 HG22 THR 53 1.466 9.376 3.513 853 HG23 THR 53 HG23 THR 53 2.746 10.561 3.775 854 H ILE 54 H ILE 54 1.042 6.165 3.688 855 HA ILE 54 HA ILE 54 -0.420 6.224 1.137 856 HB ILE 54 HB ILE 54 -0.850 4.388 3.494 857 HG12 ILE 54 HG12 ILE 54 0.502 3.954 0.823 858 HG13 ILE 54 HG13 ILE 54 1.246 3.858 2.414 859 HG21 ILE 54 HG21 ILE 54 -2.893 4.824 2.239 860 HG22 ILE 54 HG22 ILE 54 -2.341 3.170 1.977 861 HG23 ILE 54 HG23 ILE 54 -2.076 4.394 0.736 862 HD11 ILE 54 HD11 ILE 54 0.841 1.658 1.418 863 HD12 ILE 54 HD12 ILE 54 -0.888 2.008 1.388 864 HD13 ILE 54 HD13 ILE 54 -0.039 1.887 2.928 865 H PHE 55 H PHE 55 -2.109 7.464 0.983 866 HA PHE 55 HA PHE 55 -3.360 8.522 3.432 867 HB2 PHE 55 HB2 PHE 55 -3.279 9.622 0.614 868 HB3 PHE 55 HB3 PHE 55 -4.244 10.313 1.910 869 HD1 PHE 55 HD1 PHE 55 -0.778 9.603 0.842 870 HD2 PHE 55 HD2 PHE 55 -3.320 11.811 3.440 871 HE1 PHE 55 HE1 PHE 55 1.128 11.006 1.509 872 HE2 PHE 55 HE2 PHE 55 -1.419 13.218 4.114 873 HZ PHE 55 HZ PHE 55 0.809 12.817 3.146 874 H VAL 56 H VAL 56 -5.443 8.027 3.845 875 HA VAL 56 HA VAL 56 -6.877 6.381 1.942 876 HB VAL 56 HB VAL 56 -7.294 7.090 4.802 877 HG11 VAL 56 HG11 VAL 56 -9.623 6.253 4.737 878 HG12 VAL 56 HG12 VAL 56 -9.557 6.255 2.976 879 HG13 VAL 56 HG13 VAL 56 -9.440 7.773 3.863 880 HG21 VAL 56 HG21 VAL 56 -7.799 4.687 4.899 881 HG22 VAL 56 HG22 VAL 56 -6.231 5.019 4.151 882 HG23 VAL 56 HG23 VAL 56 -7.620 4.608 3.142 883 H GLY 57 H GLY 57 -8.535 6.962 0.722 884 HA2 GLY 57 HA2 GLY 57 -9.518 9.724 1.007 885 HA3 GLY 57 HA3 GLY 57 -9.235 8.953 -0.543 886 H GLU 58 H GLU 58 -11.681 10.042 0.043 887 HA GLU 58 HA GLU 58 -13.272 7.604 -0.198 888 HB2 GLU 58 HB2 GLU 58 -15.149 8.796 1.012 889 HB3 GLU 58 HB3 GLU 58 -13.805 8.280 2.018 890 HG2 GLU 58 HG2 GLU 58 -12.907 10.566 1.949 891 HG3 GLU 58 HG3 GLU 58 -14.310 11.065 1.003 892 H ASN 59 H ASN 59 -12.150 8.991 -2.193 893 HA ASN 59 HA ASN 59 -14.421 10.333 -3.486 894 HB2 ASN 59 HB2 ASN 59 -12.705 11.980 -2.815 895 HB3 ASN 59 HB3 ASN 59 -11.487 11.066 -3.691 896 HD21 ASN 59 HD21 ASN 59 -12.479 13.844 -3.945 897 HD22 ASN 59 HD22 ASN 59 -12.944 14.015 -5.603 898 H THR 60 H THR 60 -15.042 9.281 -5.231 899 HA THR 60 HA THR 60 -13.068 8.126 -7.029 900 HB THR 60 HB THR 60 -15.401 6.462 -6.047 901 HG1 THR 60 HG1 THR 60 -12.892 6.835 -5.034 902 HG21 THR 60 HG21 THR 60 -14.718 5.979 -8.354 903 HG22 THR 60 HG22 THR 60 -14.295 4.646 -7.280 904 HG23 THR 60 HG23 THR 60 -13.048 5.771 -7.821 905 H GLY 61 H GLY 61 -13.708 9.900 -8.316 906 HA2 GLY 61 HA2 GLY 61 -14.937 10.153 -10.409 907 HA3 GLY 61 HA3 GLY 61 -16.361 9.550 -9.569 908 H VAL 62 H VAL 62 -16.539 10.948 -7.330 909 HA VAL 62 HA VAL 62 -16.576 13.749 -8.215 910 HB VAL 62 HB VAL 62 -18.847 12.930 -8.230 911 HG11 VAL 62 HG11 VAL 62 -19.960 12.089 -6.222 912 HG12 VAL 62 HG12 VAL 62 -18.425 12.142 -5.353 913 HG13 VAL 62 HG13 VAL 62 -18.626 11.046 -6.719 914 HG21 VAL 62 HG21 VAL 62 -19.891 14.505 -6.671 915 HG22 VAL 62 HG22 VAL 62 -18.514 15.224 -7.504 916 HG23 VAL 62 HG23 VAL 62 -18.353 14.689 -5.831 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 9.861 16.220 1.720 2 H2 GLY 1 H2 GLY 1 9.445 17.265 2.995 3 H3 GLY 1 H3 GLY 1 10.461 15.941 3.284 4 HA2 GLY 1 HA2 GLY 1 11.736 17.985 3.197 5 HA3 GLY 1 HA3 GLY 1 12.177 16.892 1.895 6 H ALA 2 H ALA 2 11.872 17.512 -0.206 7 HA ALA 2 HA ALA 2 10.314 19.811 -0.910 8 HB1 ALA 2 HB1 ALA 2 12.207 20.922 0.197 9 HB2 ALA 2 HB2 ALA 2 12.113 21.314 -1.520 10 HB3 ALA 2 HB3 ALA 2 13.308 20.154 -0.945 11 H MET 3 H MET 3 9.775 17.756 -2.186 12 HA MET 3 HA MET 3 10.587 18.256 -4.856 13 HB2 MET 3 HB2 MET 3 11.631 16.160 -5.420 14 HB3 MET 3 HB3 MET 3 12.531 16.890 -4.100 15 HG2 MET 3 HG2 MET 3 11.519 15.386 -2.517 16 HG3 MET 3 HG3 MET 3 10.473 14.722 -3.769 17 HE1 MET 3 HE1 MET 3 15.057 14.182 -3.697 18 HE2 MET 3 HE2 MET 3 14.156 15.030 -2.439 19 HE3 MET 3 HE3 MET 3 14.269 15.717 -4.060 20 H GLU 4 H GLU 4 9.326 17.072 -6.396 21 HA GLU 4 HA GLU 4 6.787 16.216 -5.317 22 HB2 GLU 4 HB2 GLU 4 7.787 16.416 -8.161 23 HB3 GLU 4 HB3 GLU 4 6.153 15.944 -7.717 24 HG2 GLU 4 HG2 GLU 4 5.856 18.119 -6.600 25 HG3 GLU 4 HG3 GLU 4 7.465 18.589 -7.148 26 H MET 5 H MET 5 6.971 14.335 -4.314 27 HA MET 5 HA MET 5 8.552 12.156 -5.280 28 HB2 MET 5 HB2 MET 5 7.557 10.921 -3.386 29 HB3 MET 5 HB3 MET 5 8.221 12.473 -2.893 30 HG2 MET 5 HG2 MET 5 5.936 13.420 -2.945 31 HG3 MET 5 HG3 MET 5 5.316 11.814 -3.323 32 HE1 MET 5 HE1 MET 5 8.299 12.686 -0.921 33 HE2 MET 5 HE2 MET 5 7.471 12.841 0.626 34 HE3 MET 5 HE3 MET 5 7.179 14.020 -0.651 35 HA PRO 6 HA PRO 6 5.794 10.278 -8.121 36 HB2 PRO 6 HB2 PRO 6 6.496 7.647 -7.704 37 HB3 PRO 6 HB3 PRO 6 7.417 8.785 -8.693 38 HG2 PRO 6 HG2 PRO 6 7.875 7.937 -5.864 39 HG3 PRO 6 HG3 PRO 6 9.054 8.186 -7.167 40 HD2 PRO 6 HD2 PRO 6 8.681 10.019 -5.247 41 HD3 PRO 6 HD3 PRO 6 9.020 10.491 -6.925 42 H THR 7 H THR 7 3.731 9.685 -8.048 43 HA THR 7 HA THR 7 2.689 8.751 -5.454 44 HB THR 7 HB THR 7 1.158 10.337 -7.505 45 HG1 THR 7 HG1 THR 7 3.234 11.227 -6.206 46 HG21 THR 7 HG21 THR 7 -0.158 9.155 -5.809 47 HG22 THR 7 HG22 THR 7 -0.257 10.902 -5.600 48 HG23 THR 7 HG23 THR 7 0.776 9.946 -4.539 49 H PHE 8 H PHE 8 1.271 7.089 -5.390 50 HA PHE 8 HA PHE 8 0.383 5.903 -7.944 51 HB2 PHE 8 HB2 PHE 8 1.039 4.493 -5.344 52 HB3 PHE 8 HB3 PHE 8 0.378 3.718 -6.771 53 HD1 PHE 8 HD1 PHE 8 3.336 5.452 -5.406 54 HD2 PHE 8 HD2 PHE 8 1.793 3.053 -8.565 55 HE1 PHE 8 HE1 PHE 8 5.624 5.041 -6.204 56 HE2 PHE 8 HE2 PHE 8 4.087 2.639 -9.370 57 HZ PHE 8 HZ PHE 8 6.003 3.634 -8.189 58 H TYR 9 H TYR 9 -1.765 5.099 -7.990 59 HA TYR 9 HA TYR 9 -3.392 5.670 -5.606 60 HB2 TYR 9 HB2 TYR 9 -3.475 7.439 -7.574 61 HB3 TYR 9 HB3 TYR 9 -4.547 6.249 -8.307 62 HD1 TYR 9 HD1 TYR 9 -6.332 5.299 -6.434 63 HD2 TYR 9 HD2 TYR 9 -4.540 9.156 -6.493 64 HE1 TYR 9 HE1 TYR 9 -8.191 6.178 -5.090 65 HE2 TYR 9 HE2 TYR 9 -6.396 10.044 -5.146 66 HH TYR 9 HH TYR 9 -8.891 9.361 -4.745 67 H LEU 10 H LEU 10 -4.577 3.985 -5.040 68 HA LEU 10 HA LEU 10 -5.573 2.159 -7.086 69 HB2 LEU 10 HB2 LEU 10 -4.899 0.236 -5.493 70 HB3 LEU 10 HB3 LEU 10 -3.701 0.919 -6.572 71 HG LEU 10 HG LEU 10 -3.054 2.395 -4.533 72 HD11 LEU 10 HD11 LEU 10 -3.418 1.311 -2.376 73 HD12 LEU 10 HD12 LEU 10 -4.463 0.121 -3.151 74 HD13 LEU 10 HD13 LEU 10 -4.937 1.819 -3.116 75 HD21 LEU 10 HD21 LEU 10 -1.600 0.731 -5.509 76 HD22 LEU 10 HD22 LEU 10 -2.444 -0.554 -4.641 77 HD23 LEU 10 HD23 LEU 10 -1.517 0.653 -3.749 78 H ALA 11 H ALA 11 -7.307 0.768 -6.337 79 HA ALA 11 HA ALA 11 -8.683 1.810 -3.945 80 HB1 ALA 11 HB1 ALA 11 -9.945 0.792 -6.480 81 HB2 ALA 11 HB2 ALA 11 -9.822 2.484 -5.995 82 HB3 ALA 11 HB3 ALA 11 -10.798 1.362 -5.047 83 H LEU 12 H LEU 12 -9.172 0.400 -2.423 84 HA LEU 12 HA LEU 12 -8.856 -2.469 -3.052 85 HB2 LEU 12 HB2 LEU 12 -8.120 -1.121 -0.459 86 HB3 LEU 12 HB3 LEU 12 -7.820 -2.784 -0.905 87 HG LEU 12 HG LEU 12 -6.502 -0.372 -2.149 88 HD11 LEU 12 HD11 LEU 12 -5.778 -0.816 0.151 89 HD12 LEU 12 HD12 LEU 12 -4.499 -1.152 -1.015 90 HD13 LEU 12 HD13 LEU 12 -5.405 -2.480 -0.295 91 HD21 LEU 12 HD21 LEU 12 -5.081 -1.986 -3.296 92 HD22 LEU 12 HD22 LEU 12 -6.774 -2.210 -3.741 93 HD23 LEU 12 HD23 LEU 12 -6.009 -3.314 -2.598 94 H HIS 13 H HIS 13 -10.365 -3.850 -2.195 95 HA HIS 13 HA HIS 13 -12.791 -2.746 -1.146 96 HB2 HIS 13 HB2 HIS 13 -11.819 -5.583 -1.488 97 HB3 HIS 13 HB3 HIS 13 -13.386 -5.198 -0.783 98 HD1 HIS 13 HD1 HIS 13 -11.952 -6.141 -3.867 99 HD2 HIS 13 HD2 HIS 13 -14.913 -3.441 -2.733 100 HE1 HIS 13 HE1 HIS 13 -13.276 -5.665 -5.953 101 HE2 HIS 13 HE2 HIS 13 -14.990 -3.937 -5.275 102 H GLY 14 H GLY 14 -13.448 -2.522 0.903 103 HA2 GLY 14 HA2 GLY 14 -11.603 -2.545 3.017 104 HA3 GLY 14 HA3 GLY 14 -13.345 -2.406 3.188 105 H GLY 15 H GLY 15 -10.649 -4.293 3.793 106 HA2 GLY 15 HA2 GLY 15 -10.813 -6.047 5.418 107 HA3 GLY 15 HA3 GLY 15 -12.394 -6.456 4.775 108 H GLN 16 H GLN 16 -10.481 -5.903 2.162 109 HA GLN 16 HA GLN 16 -10.155 -8.783 1.782 110 HB2 GLN 16 HB2 GLN 16 -10.087 -6.480 -0.173 111 HB3 GLN 16 HB3 GLN 16 -9.805 -8.159 -0.616 112 HG2 GLN 16 HG2 GLN 16 -12.331 -7.121 0.649 113 HG3 GLN 16 HG3 GLN 16 -12.102 -7.382 -1.080 114 HE21 GLN 16 HE21 GLN 16 -10.533 -9.769 -0.748 115 HE22 GLN 16 HE22 GLN 16 -11.624 -11.021 -0.262 116 H THR 17 H THR 17 -8.239 -9.745 1.254 117 HA THR 17 HA THR 17 -5.848 -8.318 2.094 118 HB THR 17 HB THR 17 -5.969 -11.185 1.137 119 HG1 THR 17 HG1 THR 17 -6.179 -11.447 3.622 120 HG21 THR 17 HG21 THR 17 -4.243 -9.777 3.181 121 HG22 THR 17 HG22 THR 17 -3.757 -10.197 1.538 122 HG23 THR 17 HG23 THR 17 -4.118 -11.470 2.704 123 H TYR 18 H TYR 18 -4.242 -7.704 0.810 124 HA TYR 18 HA TYR 18 -4.286 -8.455 -2.032 125 HB2 TYR 18 HB2 TYR 18 -3.853 -5.722 -0.821 126 HB3 TYR 18 HB3 TYR 18 -3.417 -6.120 -2.479 127 HD1 TYR 18 HD1 TYR 18 -6.194 -5.507 -0.161 128 HD2 TYR 18 HD2 TYR 18 -5.121 -6.465 -4.160 129 HE1 TYR 18 HE1 TYR 18 -8.474 -4.959 -0.897 130 HE2 TYR 18 HE2 TYR 18 -7.391 -5.923 -4.914 131 HH TYR 18 HH TYR 18 -9.634 -5.709 -4.048 132 H HIS 19 H HIS 19 -2.290 -8.541 -3.047 133 HA HIS 19 HA HIS 19 0.020 -8.798 -1.287 134 HB2 HIS 19 HB2 HIS 19 -0.751 -9.802 -3.960 135 HB3 HIS 19 HB3 HIS 19 0.948 -9.399 -3.768 136 HD1 HIS 19 HD1 HIS 19 -1.002 -12.237 -3.702 137 HD2 HIS 19 HD2 HIS 19 1.706 -10.653 -0.962 138 HE1 HIS 19 HE1 HIS 19 -0.245 -14.177 -2.287 139 HE2 HIS 19 HE2 HIS 19 1.546 -13.233 -0.793 140 H LEU 20 H LEU 20 1.282 -7.152 -1.002 141 HA LEU 20 HA LEU 20 1.312 -4.980 -2.975 142 HB2 LEU 20 HB2 LEU 20 0.513 -4.086 -0.963 143 HB3 LEU 20 HB3 LEU 20 1.576 -5.081 0.011 144 HG LEU 20 HG LEU 20 3.480 -3.692 -0.590 145 HD11 LEU 20 HD11 LEU 20 2.860 -3.078 -2.836 146 HD12 LEU 20 HD12 LEU 20 3.153 -1.626 -1.878 147 HD13 LEU 20 HD13 LEU 20 1.500 -2.128 -2.234 148 HD21 LEU 20 HD21 LEU 20 2.157 -3.056 1.348 149 HD22 LEU 20 HD22 LEU 20 1.100 -2.082 0.325 150 HD23 LEU 20 HD23 LEU 20 2.791 -1.627 0.533 151 H ILE 21 H ILE 21 3.066 -4.811 -4.141 152 HA ILE 21 HA ILE 21 5.655 -5.581 -2.956 153 HB ILE 21 HB ILE 21 4.877 -6.002 -5.847 154 HG12 ILE 21 HG12 ILE 21 5.350 -8.281 -3.981 155 HG13 ILE 21 HG13 ILE 21 3.798 -7.453 -3.895 156 HG21 ILE 21 HG21 ILE 21 6.946 -7.317 -5.952 157 HG22 ILE 21 HG22 ILE 21 7.282 -6.923 -4.266 158 HG23 ILE 21 HG23 ILE 21 7.267 -5.647 -5.483 159 HD11 ILE 21 HD11 ILE 21 3.392 -7.921 -6.229 160 HD12 ILE 21 HD12 ILE 21 3.730 -9.411 -5.350 161 HD13 ILE 21 HD13 ILE 21 4.974 -8.689 -6.372 162 H VAL 22 H VAL 22 7.049 -3.927 -2.966 163 HA VAL 22 HA VAL 22 6.788 -1.916 -5.099 164 HB VAL 22 HB VAL 22 6.355 -0.988 -2.822 165 HG11 VAL 22 HG11 VAL 22 7.850 -2.356 -1.497 166 HG12 VAL 22 HG12 VAL 22 8.265 -0.652 -1.292 167 HG13 VAL 22 HG13 VAL 22 9.246 -1.685 -2.338 168 HG21 VAL 22 HG21 VAL 22 7.834 0.960 -3.063 169 HG22 VAL 22 HG22 VAL 22 7.121 0.463 -4.597 170 HG23 VAL 22 HG23 VAL 22 8.798 0.059 -4.234 171 H ASP 23 H ASP 23 8.524 -1.616 -6.367 172 HA ASP 23 HA ASP 23 11.127 -2.558 -5.439 173 HB2 ASP 23 HB2 ASP 23 11.582 -3.743 -7.511 174 HB3 ASP 23 HB3 ASP 23 10.175 -4.434 -6.719 175 H THR 24 H THR 24 12.848 -1.884 -7.114 176 HA THR 24 HA THR 24 12.137 0.781 -8.122 177 HB THR 24 HB THR 24 14.675 1.233 -7.610 178 HG1 THR 24 HG1 THR 24 15.318 -0.717 -6.804 179 HG21 THR 24 HG21 THR 24 12.812 2.477 -6.643 180 HG22 THR 24 HG22 THR 24 14.044 2.147 -5.423 181 HG23 THR 24 HG23 THR 24 12.559 1.195 -5.456 182 H ASP 25 H ASP 25 12.768 1.291 -10.100 183 HA ASP 25 HA ASP 25 14.046 -0.679 -11.768 184 HB2 ASP 25 HB2 ASP 25 12.252 0.697 -12.690 185 HB3 ASP 25 HB3 ASP 25 13.147 2.166 -12.313 186 H SER 26 H SER 26 15.924 0.070 -13.204 187 HA SER 26 HA SER 26 18.189 0.611 -11.712 188 HB2 SER 26 HB2 SER 26 19.136 1.267 -14.046 189 HB3 SER 26 HB3 SER 26 18.557 -0.381 -13.794 190 HG SER 26 HG SER 26 16.646 1.448 -14.645 191 H LEU 27 H LEU 27 15.945 2.848 -13.232 192 HA LEU 27 HA LEU 27 17.631 5.156 -13.042 193 HB2 LEU 27 HB2 LEU 27 14.627 4.994 -13.244 194 HB3 LEU 27 HB3 LEU 27 15.607 6.412 -13.559 195 HG LEU 27 HG LEU 27 15.711 3.863 -15.168 196 HD11 LEU 27 HD11 LEU 27 13.573 5.023 -15.384 197 HD12 LEU 27 HD12 LEU 27 14.517 5.121 -16.871 198 HD13 LEU 27 HD13 LEU 27 14.420 6.514 -15.794 199 HD21 LEU 27 HD21 LEU 27 17.026 5.187 -16.742 200 HD22 LEU 27 HD22 LEU 27 17.817 5.111 -15.167 201 HD23 LEU 27 HD23 LEU 27 16.956 6.572 -15.651 202 H GLY 28 H GLY 28 15.908 3.379 -10.755 203 HA2 GLY 28 HA2 GLY 28 15.957 3.828 -8.431 204 HA3 GLY 28 HA3 GLY 28 16.211 5.532 -8.790 205 H ASN 29 H ASN 29 13.883 4.509 -10.839 206 HA ASN 29 HA ASN 29 11.786 5.829 -9.380 207 HB2 ASN 29 HB2 ASN 29 11.876 4.417 -12.050 208 HB3 ASN 29 HB3 ASN 29 10.376 5.031 -11.372 209 HD21 ASN 29 HD21 ASN 29 13.501 6.618 -11.058 210 HD22 ASN 29 HD22 ASN 29 13.104 7.993 -12.033 211 HA PRO 30 HA PRO 30 10.316 2.157 -7.416 212 HB2 PRO 30 HB2 PRO 30 8.175 3.216 -6.213 213 HB3 PRO 30 HB3 PRO 30 9.818 3.640 -5.710 214 HG2 PRO 30 HG2 PRO 30 7.918 5.163 -7.451 215 HG3 PRO 30 HG3 PRO 30 8.973 5.762 -6.160 216 HD2 PRO 30 HD2 PRO 30 9.579 5.912 -8.835 217 HD3 PRO 30 HD3 PRO 30 10.792 5.881 -7.540 218 H SER 31 H SER 31 8.694 0.642 -7.627 219 HA SER 31 HA SER 31 6.522 1.227 -9.506 220 HB2 SER 31 HB2 SER 31 8.349 0.022 -10.705 221 HB3 SER 31 HB3 SER 31 8.219 -1.280 -9.535 222 HG SER 31 HG SER 31 6.569 -2.030 -10.577 223 H LEU 32 H LEU 32 4.597 0.186 -8.998 224 HA LEU 32 HA LEU 32 4.627 -1.218 -6.412 225 HB2 LEU 32 HB2 LEU 32 3.876 1.221 -6.375 226 HB3 LEU 32 HB3 LEU 32 2.465 0.691 -7.270 227 HG LEU 32 HG LEU 32 2.072 -0.956 -5.352 228 HD11 LEU 32 HD11 LEU 32 4.280 -0.786 -4.344 229 HD12 LEU 32 HD12 LEU 32 3.029 -0.291 -3.204 230 HD13 LEU 32 HD13 LEU 32 4.011 0.926 -4.017 231 HD21 LEU 32 HD21 LEU 32 0.925 0.738 -4.039 232 HD22 LEU 32 HD22 LEU 32 0.716 1.032 -5.764 233 HD23 LEU 32 HD23 LEU 32 1.857 2.004 -4.836 234 H SER 33 H SER 33 3.662 -3.111 -6.441 235 HA SER 33 HA SER 33 1.617 -3.638 -8.497 236 HB2 SER 33 HB2 SER 33 3.617 -5.639 -7.409 237 HB3 SER 33 HB3 SER 33 2.456 -5.906 -8.710 238 HG SER 33 HG SER 33 3.592 -4.139 -9.828 239 H VAL 34 H VAL 34 -0.310 -4.052 -7.621 240 HA VAL 34 HA VAL 34 -0.391 -5.373 -4.986 241 HB VAL 34 HB VAL 34 -2.169 -3.129 -5.961 242 HG11 VAL 34 HG11 VAL 34 -2.392 -4.758 -3.432 243 HG12 VAL 34 HG12 VAL 34 -3.513 -4.795 -4.791 244 HG13 VAL 34 HG13 VAL 34 -3.348 -3.329 -3.826 245 HG21 VAL 34 HG21 VAL 34 -0.012 -2.408 -5.081 246 HG22 VAL 34 HG22 VAL 34 -0.299 -3.327 -3.602 247 HG23 VAL 34 HG23 VAL 34 -1.323 -1.945 -3.994 248 H ILE 35 H ILE 35 -1.435 -7.241 -5.003 249 HA ILE 35 HA ILE 35 -3.419 -7.749 -7.134 250 HB ILE 35 HB ILE 35 -1.845 -10.039 -6.093 251 HG12 ILE 35 HG12 ILE 35 -0.742 -8.070 -8.104 252 HG13 ILE 35 HG13 ILE 35 -0.074 -8.409 -6.517 253 HG21 ILE 35 HG21 ILE 35 -2.879 -9.292 -8.821 254 HG22 ILE 35 HG22 ILE 35 -3.704 -10.319 -7.649 255 HG23 ILE 35 HG23 ILE 35 -2.179 -10.846 -8.368 256 HD11 ILE 35 HD11 ILE 35 0.437 -10.684 -7.209 257 HD12 ILE 35 HD12 ILE 35 1.203 -9.501 -8.270 258 HD13 ILE 35 HD13 ILE 35 -0.245 -10.356 -8.802 259 HA PRO 36 HA PRO 36 -6.021 -8.793 -3.650 260 HB2 PRO 36 HB2 PRO 36 -7.935 -10.112 -5.121 261 HB3 PRO 36 HB3 PRO 36 -7.866 -8.360 -4.911 262 HG2 PRO 36 HG2 PRO 36 -6.945 -10.032 -7.206 263 HG3 PRO 36 HG3 PRO 36 -7.752 -8.455 -7.220 264 HD2 PRO 36 HD2 PRO 36 -5.099 -8.719 -7.630 265 HD3 PRO 36 HD3 PRO 36 -5.789 -7.308 -6.803 266 H SER 37 H SER 37 -6.006 -10.485 -2.292 267 HA SER 37 HA SER 37 -4.679 -12.899 -2.974 268 HB2 SER 37 HB2 SER 37 -6.284 -12.133 -0.533 269 HB3 SER 37 HB3 SER 37 -5.349 -13.623 -0.678 270 HG SER 37 HG SER 37 -3.523 -12.524 -0.550 271 H ASN 38 H ASN 38 -7.991 -11.906 -2.990 272 HA ASN 38 HA ASN 38 -8.715 -14.545 -4.043 273 HB2 ASN 38 HB2 ASN 38 -9.503 -14.359 -1.678 274 HB3 ASN 38 HB3 ASN 38 -10.449 -12.948 -2.136 275 HD21 ASN 38 HD21 ASN 38 -11.285 -15.527 -1.045 276 HD22 ASN 38 HD22 ASN 38 -12.439 -16.165 -2.168 277 HA PRO 39 HA PRO 39 -9.864 -11.493 -7.154 278 HB2 PRO 39 HB2 PRO 39 -10.093 -13.270 -9.189 279 HB3 PRO 39 HB3 PRO 39 -8.536 -12.656 -8.623 280 HG2 PRO 39 HG2 PRO 39 -9.891 -15.250 -7.998 281 HG3 PRO 39 HG3 PRO 39 -8.185 -14.941 -8.375 282 HD2 PRO 39 HD2 PRO 39 -9.083 -15.295 -5.845 283 HD3 PRO 39 HD3 PRO 39 -7.710 -14.245 -6.235 284 H TYR 40 H TYR 40 -11.603 -14.301 -6.082 285 HA TYR 40 HA TYR 40 -13.896 -13.879 -7.760 286 HB2 TYR 40 HB2 TYR 40 -13.620 -15.566 -5.263 287 HB3 TYR 40 HB3 TYR 40 -14.950 -15.638 -6.415 288 HD1 TYR 40 HD1 TYR 40 -14.346 -16.243 -8.852 289 HD2 TYR 40 HD2 TYR 40 -11.753 -16.938 -5.548 290 HE1 TYR 40 HE1 TYR 40 -13.108 -17.902 -10.177 291 HE2 TYR 40 HE2 TYR 40 -10.509 -18.599 -6.866 292 HH TYR 40 HH TYR 40 -10.939 -20.092 -8.824 293 H GLN 41 H GLN 41 -12.958 -13.061 -4.476 294 HA GLN 41 HA GLN 41 -15.481 -11.921 -3.768 295 HB2 GLN 41 HB2 GLN 41 -12.720 -11.670 -2.572 296 HB3 GLN 41 HB3 GLN 41 -14.133 -10.867 -1.896 297 HG2 GLN 41 HG2 GLN 41 -15.192 -12.965 -1.453 298 HG3 GLN 41 HG3 GLN 41 -13.918 -13.840 -2.300 299 HE21 GLN 41 HE21 GLN 41 -14.882 -14.045 0.466 300 HE22 GLN 41 HE22 GLN 41 -13.491 -13.794 1.465 301 H GLU 42 H GLU 42 -12.679 -10.842 -5.463 302 HA GLU 42 HA GLU 42 -13.211 -8.059 -5.353 303 HB2 GLU 42 HB2 GLU 42 -11.702 -9.723 -7.371 304 HB3 GLU 42 HB3 GLU 42 -11.753 -7.965 -7.390 305 HG2 GLU 42 HG2 GLU 42 -10.672 -9.668 -5.159 306 HG3 GLU 42 HG3 GLU 42 -9.713 -8.811 -6.364 307 H GLN 43 H GLN 43 -14.152 -10.642 -7.586 308 HA GLN 43 HA GLN 43 -15.523 -8.888 -9.380 309 HB2 GLN 43 HB2 GLN 43 -14.608 -11.219 -9.912 310 HB3 GLN 43 HB3 GLN 43 -16.024 -11.849 -9.080 311 HG2 GLN 43 HG2 GLN 43 -16.416 -11.811 -11.457 312 HG3 GLN 43 HG3 GLN 43 -17.465 -10.639 -10.656 313 HE21 GLN 43 HE21 GLN 43 -14.043 -10.171 -11.247 314 HE22 GLN 43 HE22 GLN 43 -14.224 -8.893 -12.406 315 H LEU 44 H LEU 44 -16.484 -11.059 -6.777 316 HA LEU 44 HA LEU 44 -19.189 -9.918 -6.787 317 HB2 LEU 44 HB2 LEU 44 -18.084 -12.194 -5.129 318 HB3 LEU 44 HB3 LEU 44 -19.769 -11.743 -5.301 319 HG LEU 44 HG LEU 44 -18.072 -12.755 -7.580 320 HD11 LEU 44 HD11 LEU 44 -19.228 -14.881 -7.284 321 HD12 LEU 44 HD12 LEU 44 -20.015 -14.253 -5.835 322 HD13 LEU 44 HD13 LEU 44 -18.263 -14.466 -5.866 323 HD21 LEU 44 HD21 LEU 44 -21.054 -12.415 -7.276 324 HD22 LEU 44 HD22 LEU 44 -20.231 -13.108 -8.672 325 HD23 LEU 44 HD23 LEU 44 -19.988 -11.412 -8.262 326 H SER 45 H SER 45 -18.243 -7.875 -6.050 327 HA SER 45 HA SER 45 -16.509 -7.793 -3.820 328 HB2 SER 45 HB2 SER 45 -18.033 -5.385 -4.758 329 HB3 SER 45 HB3 SER 45 -16.363 -5.516 -4.219 330 HG SER 45 HG SER 45 -16.095 -6.863 -6.206 331 H ASP 46 H ASP 46 -19.813 -6.428 -4.122 332 HA ASP 46 HA ASP 46 -21.149 -5.484 -2.547 333 HB2 ASP 46 HB2 ASP 46 -22.135 -7.021 -0.977 334 HB3 ASP 46 HB3 ASP 46 -21.865 -7.841 -2.502 335 H THR 47 H THR 47 -18.311 -5.025 -2.177 336 HA THR 47 HA THR 47 -18.399 -4.035 0.571 337 HB THR 47 HB THR 47 -15.820 -4.440 0.458 338 HG1 THR 47 HG1 THR 47 -16.617 -6.644 -1.128 339 HG21 THR 47 HG21 THR 47 -17.729 -6.731 0.920 340 HG22 THR 47 HG22 THR 47 -17.266 -5.509 2.105 341 HG23 THR 47 HG23 THR 47 -16.065 -6.652 1.503 342 HA PRO 48 HA PRO 48 -17.469 -0.304 -1.606 343 HB2 PRO 48 HB2 PRO 48 -16.485 1.180 0.457 344 HB3 PRO 48 HB3 PRO 48 -18.208 0.856 0.233 345 HG2 PRO 48 HG2 PRO 48 -16.246 -0.483 2.053 346 HG3 PRO 48 HG3 PRO 48 -17.923 0.001 2.372 347 HD2 PRO 48 HD2 PRO 48 -17.225 -2.552 1.804 348 HD3 PRO 48 HD3 PRO 48 -18.790 -1.863 1.329 349 H LEU 49 H LEU 49 -15.770 0.569 -2.671 350 HA LEU 49 HA LEU 49 -13.119 -0.505 -2.107 351 HB2 LEU 49 HB2 LEU 49 -14.311 1.050 -4.372 352 HB3 LEU 49 HB3 LEU 49 -12.573 0.986 -4.167 353 HG LEU 49 HG LEU 49 -14.335 -1.439 -4.516 354 HD11 LEU 49 HD11 LEU 49 -12.519 -0.032 -6.462 355 HD12 LEU 49 HD12 LEU 49 -14.287 -0.035 -6.515 356 HD13 LEU 49 HD13 LEU 49 -13.396 -1.540 -6.755 357 HD21 LEU 49 HD21 LEU 49 -12.279 -1.867 -3.270 358 HD22 LEU 49 HD22 LEU 49 -11.341 -1.093 -4.548 359 HD23 LEU 49 HD23 LEU 49 -12.214 -2.589 -4.879 360 H ILE 50 H ILE 50 -11.813 0.520 -0.787 361 HA ILE 50 HA ILE 50 -12.177 3.361 -0.287 362 HB ILE 50 HB ILE 50 -10.073 1.496 0.830 363 HG12 ILE 50 HG12 ILE 50 -12.592 2.494 2.173 364 HG13 ILE 50 HG13 ILE 50 -12.459 0.913 1.413 365 HG21 ILE 50 HG21 ILE 50 -10.937 4.266 1.670 366 HG22 ILE 50 HG22 ILE 50 -9.416 3.844 0.890 367 HG23 ILE 50 HG23 ILE 50 -9.762 3.259 2.520 368 HD11 ILE 50 HD11 ILE 50 -10.832 1.912 3.739 369 HD12 ILE 50 HD12 ILE 50 -10.667 0.331 2.976 370 HD13 ILE 50 HD13 ILE 50 -12.161 0.756 3.810 371 HA PRO 51 HA PRO 51 -9.040 4.272 -3.330 372 HB2 PRO 51 HB2 PRO 51 -9.092 6.962 -2.948 373 HB3 PRO 51 HB3 PRO 51 -10.279 6.107 -3.937 374 HG2 PRO 51 HG2 PRO 51 -10.527 7.156 -1.159 375 HG3 PRO 51 HG3 PRO 51 -11.731 7.087 -2.451 376 HD2 PRO 51 HD2 PRO 51 -11.618 5.326 -0.344 377 HD3 PRO 51 HD3 PRO 51 -12.371 4.971 -1.911 378 H LEU 52 H LEU 52 -6.888 4.374 -3.033 379 HA LEU 52 HA LEU 52 -5.881 5.604 -0.570 380 HB2 LEU 52 HB2 LEU 52 -5.108 2.892 -1.645 381 HB3 LEU 52 HB3 LEU 52 -4.162 3.760 -0.449 382 HG LEU 52 HG LEU 52 -6.583 3.760 0.763 383 HD11 LEU 52 HD11 LEU 52 -6.432 1.166 -0.756 384 HD12 LEU 52 HD12 LEU 52 -7.632 2.437 -0.985 385 HD13 LEU 52 HD13 LEU 52 -7.568 1.548 0.537 386 HD21 LEU 52 HD21 LEU 52 -5.736 1.929 2.127 387 HD22 LEU 52 HD22 LEU 52 -4.466 3.097 1.762 388 HD23 LEU 52 HD23 LEU 52 -4.530 1.561 0.895 389 H THR 53 H THR 53 -4.195 6.898 -0.852 390 HA THR 53 HA THR 53 -2.893 6.899 -3.504 391 HB THR 53 HB THR 53 -2.939 9.208 -1.553 392 HG1 THR 53 HG1 THR 53 -5.047 8.200 -2.771 393 HG21 THR 53 HG21 THR 53 -2.514 9.025 -4.539 394 HG22 THR 53 HG22 THR 53 -1.278 9.350 -3.320 395 HG23 THR 53 HG23 THR 53 -2.566 10.524 -3.608 396 H ILE 54 H ILE 54 -0.874 6.154 -3.486 397 HA ILE 54 HA ILE 54 0.565 6.156 -0.920 398 HB ILE 54 HB ILE 54 0.970 4.356 -3.313 399 HG12 ILE 54 HG12 ILE 54 -0.249 3.889 -0.586 400 HG13 ILE 54 HG13 ILE 54 -1.053 3.764 -2.148 401 HG21 ILE 54 HG21 ILE 54 2.335 4.365 -0.623 402 HG22 ILE 54 HG22 ILE 54 3.068 4.805 -2.167 403 HG23 ILE 54 HG23 ILE 54 2.547 3.145 -1.880 404 HD11 ILE 54 HD11 ILE 54 -0.557 1.575 -1.192 405 HD12 ILE 54 HD12 ILE 54 1.162 1.979 -1.171 406 HD13 ILE 54 HD13 ILE 54 0.307 1.835 -2.707 407 H PHE 55 H PHE 55 2.214 7.432 -0.721 408 HA PHE 55 HA PHE 55 3.523 8.504 -3.130 409 HB2 PHE 55 HB2 PHE 55 3.385 9.571 -0.302 410 HB3 PHE 55 HB3 PHE 55 4.379 10.272 -1.568 411 HD1 PHE 55 HD1 PHE 55 0.888 9.551 -0.597 412 HD2 PHE 55 HD2 PHE 55 3.494 11.801 -3.096 413 HE1 PHE 55 HE1 PHE 55 -1.004 10.967 -1.296 414 HE2 PHE 55 HE2 PHE 55 1.612 13.221 -3.795 415 HZ PHE 55 HZ PHE 55 -0.641 12.801 -2.896 416 H VAL 56 H VAL 56 5.680 8.172 -3.441 417 HA VAL 56 HA VAL 56 7.040 6.388 -1.612 418 HB VAL 56 HB VAL 56 7.546 7.323 -4.376 419 HG11 VAL 56 HG11 VAL 56 9.601 8.114 -3.276 420 HG12 VAL 56 HG12 VAL 56 9.922 6.728 -4.316 421 HG13 VAL 56 HG13 VAL 56 9.834 6.516 -2.569 422 HG21 VAL 56 HG21 VAL 56 8.239 4.984 -4.604 423 HG22 VAL 56 HG22 VAL 56 6.641 5.136 -3.862 424 HG23 VAL 56 HG23 VAL 56 8.048 4.778 -2.859 425 H GLY 57 H GLY 57 8.512 6.908 -0.168 426 HA2 GLY 57 HA2 GLY 57 8.583 9.611 0.659 427 HA3 GLY 57 HA3 GLY 57 9.437 8.279 1.405 428 H GLU 58 H GLU 58 9.884 11.150 0.088 429 HA GLU 58 HA GLU 58 11.990 10.814 -1.759 430 HB2 GLU 58 HB2 GLU 58 12.401 13.224 -1.398 431 HB3 GLU 58 HB3 GLU 58 10.701 12.874 -1.684 432 HG2 GLU 58 HG2 GLU 58 10.237 13.055 0.687 433 HG3 GLU 58 HG3 GLU 58 11.946 13.322 1.019 434 H ASN 59 H ASN 59 11.897 11.331 1.703 435 HA ASN 59 HA ASN 59 14.442 10.182 2.151 436 HB2 ASN 59 HB2 ASN 59 15.222 12.303 1.197 437 HB3 ASN 59 HB3 ASN 59 14.251 13.198 2.351 438 HD21 ASN 59 HD21 ASN 59 17.117 13.287 1.856 439 HD22 ASN 59 HD22 ASN 59 17.884 12.906 3.362 440 H THR 60 H THR 60 14.063 9.195 3.991 441 HA THR 60 HA THR 60 13.163 10.718 6.283 442 HB THR 60 HB THR 60 11.733 8.163 5.492 443 HG1 THR 60 HG1 THR 60 11.279 10.785 4.888 444 HG21 THR 60 HG21 THR 60 10.270 8.679 7.405 445 HG22 THR 60 HG22 THR 60 11.286 10.063 7.803 446 HG23 THR 60 HG23 THR 60 11.939 8.428 7.916 447 H GLY 61 H GLY 61 15.349 10.415 6.849 448 HA2 GLY 61 HA2 GLY 61 16.414 7.738 7.085 449 HA3 GLY 61 HA3 GLY 61 17.245 9.234 7.485 450 H VAL 62 H VAL 62 16.719 6.575 8.886 451 HA VAL 62 HA VAL 62 15.654 7.696 11.383 452 HB VAL 62 HB VAL 62 14.269 5.863 10.689 453 HG11 VAL 62 HG11 VAL 62 15.135 3.600 10.316 454 HG12 VAL 62 HG12 VAL 62 16.782 4.208 10.493 455 HG13 VAL 62 HG13 VAL 62 15.782 4.755 9.148 456 HG21 VAL 62 HG21 VAL 62 14.510 4.329 12.579 457 HG22 VAL 62 HG22 VAL 62 14.726 6.007 13.073 458 HG23 VAL 62 HG23 VAL 62 16.129 4.956 12.881 459 H1 GLY 1 H1 GLY 1 -9.650 16.286 -1.446 460 H2 GLY 1 H2 GLY 1 -9.205 17.371 -2.668 461 H3 GLY 1 H3 GLY 1 -10.219 16.070 -3.030 462 HA2 GLY 1 HA2 GLY 1 -11.498 18.099 -2.897 463 HA3 GLY 1 HA3 GLY 1 -11.947 16.987 -1.612 464 H ALA 2 H ALA 2 -11.660 17.584 0.499 465 HA ALA 2 HA ALA 2 -10.086 19.859 1.241 466 HB1 ALA 2 HB1 ALA 2 -11.961 21.000 0.136 467 HB2 ALA 2 HB2 ALA 2 -11.874 21.372 1.855 468 HB3 ALA 2 HB3 ALA 2 -13.077 20.228 1.263 469 H MET 3 H MET 3 -9.561 17.809 2.498 470 HA MET 3 HA MET 3 -10.392 18.278 5.165 471 HB2 MET 3 HB2 MET 3 -11.455 16.182 5.706 472 HB3 MET 3 HB3 MET 3 -12.343 16.929 4.386 473 HG2 MET 3 HG2 MET 3 -11.333 15.432 2.797 474 HG3 MET 3 HG3 MET 3 -10.298 14.750 4.051 475 HE1 MET 3 HE1 MET 3 -14.884 14.237 3.948 476 HE2 MET 3 HE2 MET 3 -13.972 15.091 2.702 477 HE3 MET 3 HE3 MET 3 -14.085 15.764 4.329 478 H GLU 4 H GLU 4 -9.142 17.077 6.698 479 HA GLU 4 HA GLU 4 -6.605 16.212 5.618 480 HB2 GLU 4 HB2 GLU 4 -7.613 16.385 8.462 481 HB3 GLU 4 HB3 GLU 4 -5.977 15.915 8.015 482 HG2 GLU 4 HG2 GLU 4 -5.665 18.103 6.939 483 HG3 GLU 4 HG3 GLU 4 -7.283 18.569 7.459 484 H MET 5 H MET 5 -6.771 14.333 4.614 485 HA MET 5 HA MET 5 -8.388 12.165 5.547 486 HB2 MET 5 HB2 MET 5 -7.401 10.937 3.642 487 HB3 MET 5 HB3 MET 5 -8.048 12.499 3.167 488 HG2 MET 5 HG2 MET 5 -5.759 13.426 3.232 489 HG3 MET 5 HG3 MET 5 -5.150 11.816 3.599 490 HE1 MET 5 HE1 MET 5 -8.116 12.725 1.185 491 HE2 MET 5 HE2 MET 5 -7.275 12.889 -0.356 492 HE3 MET 5 HE3 MET 5 -6.984 14.054 0.935 493 HA PRO 6 HA PRO 6 -5.669 10.240 8.383 494 HB2 PRO 6 HB2 PRO 6 -6.380 7.617 7.936 495 HB3 PRO 6 HB3 PRO 6 -7.305 8.750 8.928 496 HG2 PRO 6 HG2 PRO 6 -7.740 7.932 6.087 497 HG3 PRO 6 HG3 PRO 6 -8.930 8.175 7.382 498 HD2 PRO 6 HD2 PRO 6 -8.532 10.027 5.487 499 HD3 PRO 6 HD3 PRO 6 -8.880 10.482 7.167 500 H THR 7 H THR 7 -3.597 9.633 8.313 501 HA THR 7 HA THR 7 -2.563 8.719 5.713 502 HB THR 7 HB THR 7 -1.035 10.291 7.779 503 HG1 THR 7 HG1 THR 7 -3.096 11.191 6.493 504 HG21 THR 7 HG21 THR 7 0.292 9.104 6.093 505 HG22 THR 7 HG22 THR 7 0.401 10.853 5.892 506 HG23 THR 7 HG23 THR 7 -0.624 9.905 4.817 507 H PHE 8 H PHE 8 -1.141 7.053 5.640 508 HA PHE 8 HA PHE 8 -0.274 5.839 8.190 509 HB2 PHE 8 HB2 PHE 8 -0.924 4.454 5.573 510 HB3 PHE 8 HB3 PHE 8 -0.272 3.666 6.999 511 HD1 PHE 8 HD1 PHE 8 -3.214 5.430 5.632 512 HD2 PHE 8 HD2 PHE 8 -1.704 2.993 8.782 513 HE1 PHE 8 HE1 PHE 8 -5.512 5.023 6.417 514 HE2 PHE 8 HE2 PHE 8 -4.001 2.583 9.571 515 HZ PHE 8 HZ PHE 8 -5.907 3.596 8.386 516 H TYR 9 H TYR 9 1.869 5.014 8.239 517 HA TYR 9 HA TYR 9 3.507 5.606 5.871 518 HB2 TYR 9 HB2 TYR 9 3.594 7.358 7.852 519 HB3 TYR 9 HB3 TYR 9 4.652 6.154 8.582 520 HD1 TYR 9 HD1 TYR 9 6.447 5.209 6.709 521 HD2 TYR 9 HD2 TYR 9 4.675 9.072 6.796 522 HE1 TYR 9 HE1 TYR 9 8.317 6.091 5.387 523 HE2 TYR 9 HE2 TYR 9 6.540 9.964 5.466 524 HH TYR 9 HH TYR 9 9.019 9.290 5.057 525 H LEU 10 H LEU 10 4.685 3.917 5.294 526 HA LEU 10 HA LEU 10 5.662 2.070 7.327 527 HB2 LEU 10 HB2 LEU 10 4.983 0.163 5.719 528 HB3 LEU 10 HB3 LEU 10 3.782 0.853 6.792 529 HG LEU 10 HG LEU 10 3.159 2.342 4.764 530 HD11 LEU 10 HD11 LEU 10 3.527 1.286 2.600 531 HD12 LEU 10 HD12 LEU 10 4.565 0.080 3.363 532 HD13 LEU 10 HD13 LEU 10 5.045 1.777 3.352 533 HD21 LEU 10 HD21 LEU 10 1.697 0.678 5.718 534 HD22 LEU 10 HD22 LEU 10 2.540 -0.602 4.848 535 HD23 LEU 10 HD23 LEU 10 1.620 0.612 3.958 536 H ALA 11 H ALA 11 7.400 0.682 6.585 537 HA ALA 11 HA ALA 11 8.789 1.728 4.197 538 HB1 ALA 11 HB1 ALA 11 10.033 0.685 6.730 539 HB2 ALA 11 HB2 ALA 11 9.919 2.382 6.258 540 HB3 ALA 11 HB3 ALA 11 10.897 1.265 5.307 541 H LEU 12 H LEU 12 9.288 0.333 2.669 542 HA LEU 12 HA LEU 12 8.947 -2.540 3.268 543 HB2 LEU 12 HB2 LEU 12 8.226 -1.164 0.678 544 HB3 LEU 12 HB3 LEU 12 7.917 -2.829 1.113 545 HG LEU 12 HG LEU 12 6.607 -0.418 2.369 546 HD11 LEU 12 HD11 LEU 12 5.892 -0.843 0.061 547 HD12 LEU 12 HD12 LEU 12 4.605 -1.178 1.218 548 HD13 LEU 12 HD13 LEU 12 5.506 -2.509 0.491 549 HD21 LEU 12 HD21 LEU 12 5.172 -2.037 3.497 550 HD22 LEU 12 HD22 LEU 12 6.860 -2.273 3.947 551 HD23 LEU 12 HD23 LEU 12 6.096 -3.362 2.789 552 H HIS 13 H HIS 13 10.447 -3.919 2.408 553 HA HIS 13 HA HIS 13 12.884 -2.821 1.385 554 HB2 HIS 13 HB2 HIS 13 11.900 -5.656 1.694 555 HB3 HIS 13 HB3 HIS 13 13.472 -5.275 1.002 556 HD1 HIS 13 HD1 HIS 13 12.013 -6.230 4.075 557 HD2 HIS 13 HD2 HIS 13 14.992 -3.539 2.974 558 HE1 HIS 13 HE1 HIS 13 13.339 -5.783 6.170 559 HE2 HIS 13 HE2 HIS 13 15.065 -4.058 5.509 560 H GLY 14 H GLY 14 13.557 -2.580 -0.659 561 HA2 GLY 14 HA2 GLY 14 11.727 -2.566 -2.783 562 HA3 GLY 14 HA3 GLY 14 13.470 -2.442 -2.944 563 H GLY 15 H GLY 15 10.758 -4.298 -3.584 564 HA2 GLY 15 HA2 GLY 15 10.912 -6.038 -5.213 565 HA3 GLY 15 HA3 GLY 15 12.491 -6.459 -4.579 566 H GLN 16 H GLN 16 10.579 -5.929 -1.958 567 HA GLN 16 HA GLN 16 10.233 -8.814 -1.610 568 HB2 GLN 16 HB2 GLN 16 10.167 -6.523 0.356 569 HB3 GLN 16 HB3 GLN 16 9.870 -8.202 0.791 570 HG2 GLN 16 HG2 GLN 16 12.408 -7.177 -0.454 571 HG3 GLN 16 HG3 GLN 16 12.169 -7.454 1.270 572 HE21 GLN 16 HE21 GLN 16 10.596 -9.838 0.919 573 HE22 GLN 16 HE22 GLN 16 11.683 -11.087 0.408 574 H THR 17 H THR 17 8.312 -9.766 -1.101 575 HA THR 17 HA THR 17 5.935 -8.323 -1.944 576 HB THR 17 HB THR 17 6.035 -11.198 -1.009 577 HG1 THR 17 HG1 THR 17 6.276 -11.466 -3.477 578 HG21 THR 17 HG21 THR 17 4.326 -9.761 -3.052 579 HG22 THR 17 HG22 THR 17 3.829 -10.200 -1.417 580 HG23 THR 17 HG23 THR 17 4.189 -11.459 -2.597 581 H TYR 18 H TYR 18 4.327 -7.709 -0.660 582 HA TYR 18 HA TYR 18 4.351 -8.489 2.172 583 HB2 TYR 18 HB2 TYR 18 3.937 -5.742 0.984 584 HB3 TYR 18 HB3 TYR 18 3.490 -6.151 2.635 585 HD1 TYR 18 HD1 TYR 18 6.278 -5.536 0.335 586 HD2 TYR 18 HD2 TYR 18 5.182 -6.523 4.323 587 HE1 TYR 18 HE1 TYR 18 8.558 -5.007 1.086 588 HE2 TYR 18 HE2 TYR 18 7.452 -6.004 5.095 589 HH TYR 18 HH TYR 18 9.694 -5.781 4.262 590 H HIS 19 H HIS 19 2.344 -8.569 3.179 591 HA HIS 19 HA HIS 19 0.045 -8.806 1.402 592 HB2 HIS 19 HB2 HIS 19 0.786 -9.839 4.073 593 HB3 HIS 19 HB3 HIS 19 -0.907 -9.424 3.867 594 HD1 HIS 19 HD1 HIS 19 1.039 -12.276 3.781 595 HD2 HIS 19 HD2 HIS 19 -1.656 -10.650 1.050 596 HE1 HIS 19 HE1 HIS 19 0.272 -14.199 2.349 597 HE2 HIS 19 HE2 HIS 19 -1.521 -13.230 0.863 598 H LEU 20 H LEU 20 -1.213 -7.147 1.126 599 HA LEU 20 HA LEU 20 -1.238 -4.992 3.119 600 HB2 LEU 20 HB2 LEU 20 -0.425 -4.086 1.122 601 HB3 LEU 20 HB3 LEU 20 -1.490 -5.064 0.133 602 HG LEU 20 HG LEU 20 -3.387 -3.670 0.734 603 HD11 LEU 20 HD11 LEU 20 -2.772 -3.083 2.989 604 HD12 LEU 20 HD12 LEU 20 -3.051 -1.617 2.046 605 HD13 LEU 20 HD13 LEU 20 -1.404 -2.136 2.404 606 HD21 LEU 20 HD21 LEU 20 -2.046 -3.031 -1.192 607 HD22 LEU 20 HD22 LEU 20 -0.988 -2.075 -0.156 608 HD23 LEU 20 HD23 LEU 20 -2.673 -1.601 -0.370 609 H ILE 21 H ILE 21 -3.000 -4.817 4.280 610 HA ILE 21 HA ILE 21 -5.582 -5.567 3.072 611 HB ILE 21 HB ILE 21 -4.825 -6.022 5.966 612 HG12 ILE 21 HG12 ILE 21 -5.303 -8.277 4.074 613 HG13 ILE 21 HG13 ILE 21 -3.744 -7.459 4.005 614 HG21 ILE 21 HG21 ILE 21 -6.898 -7.326 6.042 615 HG22 ILE 21 HG22 ILE 21 -7.220 -6.912 4.358 616 HG23 ILE 21 HG23 ILE 21 -7.206 -5.649 5.589 617 HD11 ILE 21 HD11 ILE 21 -3.353 -7.957 6.333 618 HD12 ILE 21 HD12 ILE 21 -3.703 -9.436 5.436 619 HD13 ILE 21 HD13 ILE 21 -4.942 -8.713 6.463 620 H VAL 22 H VAL 22 -6.966 -3.900 3.088 621 HA VAL 22 HA VAL 22 -6.709 -1.915 5.249 622 HB VAL 22 HB VAL 22 -6.254 -0.971 2.981 623 HG11 VAL 22 HG11 VAL 22 -7.747 -2.323 1.642 624 HG12 VAL 22 HG12 VAL 22 -8.149 -0.617 1.444 625 HG13 VAL 22 HG13 VAL 22 -9.146 -1.646 2.477 626 HG21 VAL 22 HG21 VAL 22 -7.729 0.983 3.226 627 HG22 VAL 22 HG22 VAL 22 -7.025 0.475 4.763 628 HG23 VAL 22 HG23 VAL 22 -8.702 0.079 4.386 629 H ASP 23 H ASP 23 -8.452 -1.616 6.503 630 HA ASP 23 HA ASP 23 -11.051 -2.543 5.549 631 HB2 ASP 23 HB2 ASP 23 -11.521 -3.739 7.614 632 HB3 ASP 23 HB3 ASP 23 -10.117 -4.432 6.823 633 H THR 24 H THR 24 -12.785 -1.868 7.205 634 HA THR 24 HA THR 24 -12.064 0.781 8.254 635 HB THR 24 HB THR 24 -14.601 1.242 7.732 636 HG1 THR 24 HG1 THR 24 -15.222 -0.721 6.896 637 HG21 THR 24 HG21 THR 24 -12.726 2.492 6.796 638 HG22 THR 24 HG22 THR 24 -13.948 2.182 5.562 639 HG23 THR 24 HG23 THR 24 -12.466 1.225 5.595 640 H ASP 25 H ASP 25 -12.700 1.275 10.241 641 HA ASP 25 HA ASP 25 -13.998 -0.702 11.887 642 HB2 ASP 25 HB2 ASP 25 -12.209 0.654 12.832 643 HB3 ASP 25 HB3 ASP 25 -13.081 2.134 12.452 644 H SER 26 H SER 26 -15.880 0.053 13.320 645 HA SER 26 HA SER 26 -18.134 0.615 11.814 646 HB2 SER 26 HB2 SER 26 -19.085 1.263 14.155 647 HB3 SER 26 HB3 SER 26 -18.523 -0.388 13.886 648 HG SER 26 HG SER 26 -16.585 1.401 14.757 649 H LEU 27 H LEU 27 -15.889 2.825 13.362 650 HA LEU 27 HA LEU 27 -17.555 5.145 13.187 651 HB2 LEU 27 HB2 LEU 27 -14.554 4.955 13.403 652 HB3 LEU 27 HB3 LEU 27 -15.522 6.381 13.720 653 HG LEU 27 HG LEU 27 -15.658 3.820 15.310 654 HD11 LEU 27 HD11 LEU 27 -13.515 4.964 15.553 655 HD12 LEU 27 HD12 LEU 27 -14.469 5.047 17.034 656 HD13 LEU 27 HD13 LEU 27 -14.357 6.457 15.975 657 HD21 LEU 27 HD21 LEU 27 -16.970 5.143 16.886 658 HD22 LEU 27 HD22 LEU 27 -17.751 5.086 15.306 659 HD23 LEU 27 HD23 LEU 27 -16.880 6.536 15.807 660 H GLY 28 H GLY 28 -15.815 3.376 10.897 661 HA2 GLY 28 HA2 GLY 28 -15.857 3.841 8.578 662 HA3 GLY 28 HA3 GLY 28 -16.108 5.543 8.945 663 H ASN 29 H ASN 29 -13.798 4.489 10.997 664 HA ASN 29 HA ASN 29 -11.685 5.815 9.566 665 HB2 ASN 29 HB2 ASN 29 -11.796 4.380 12.220 666 HB3 ASN 29 HB3 ASN 29 -10.291 4.990 11.553 667 HD21 ASN 29 HD21 ASN 29 -13.408 6.601 11.241 668 HD22 ASN 29 HD22 ASN 29 -12.997 7.967 12.223 669 HA PRO 30 HA PRO 30 -10.231 2.154 7.574 670 HB2 PRO 30 HB2 PRO 30 -8.078 3.215 6.392 671 HB3 PRO 30 HB3 PRO 30 -9.716 3.653 5.886 672 HG2 PRO 30 HG2 PRO 30 -7.815 5.146 7.649 673 HG3 PRO 30 HG3 PRO 30 -8.862 5.762 6.357 674 HD2 PRO 30 HD2 PRO 30 -9.482 5.894 9.029 675 HD3 PRO 30 HD3 PRO 30 -10.688 5.876 7.727 676 H SER 31 H SER 31 -8.615 0.630 7.775 677 HA SER 31 HA SER 31 -6.452 1.185 9.678 678 HB2 SER 31 HB2 SER 31 -8.307 -0.023 10.842 679 HB3 SER 31 HB3 SER 31 -8.156 -1.320 9.665 680 HG SER 31 HG SER 31 -6.484 -2.061 10.698 681 H LEU 32 H LEU 32 -4.527 0.133 9.167 682 HA LEU 32 HA LEU 32 -4.551 -1.247 6.569 683 HB2 LEU 32 HB2 LEU 32 -3.791 1.188 6.562 684 HB3 LEU 32 HB3 LEU 32 -2.387 0.643 7.459 685 HG LEU 32 HG LEU 32 -1.991 -0.988 5.529 686 HD11 LEU 32 HD11 LEU 32 -4.192 -0.797 4.513 687 HD12 LEU 32 HD12 LEU 32 -2.933 -0.303 3.382 688 HD13 LEU 32 HD13 LEU 32 -3.911 0.915 4.199 689 HD21 LEU 32 HD21 LEU 32 -0.827 0.709 4.237 690 HD22 LEU 32 HD22 LEU 32 -0.622 0.985 5.967 691 HD23 LEU 32 HD23 LEU 32 -1.752 1.974 5.043 692 H SER 33 H SER 33 -3.592 -3.147 6.588 693 HA SER 33 HA SER 33 -1.563 -3.702 8.652 694 HB2 SER 33 HB2 SER 33 -3.563 -5.684 7.533 695 HB3 SER 33 HB3 SER 33 -2.401 -5.972 8.829 696 HG SER 33 HG SER 33 -3.554 -4.165 9.933 697 H VAL 34 H VAL 34 0.369 -4.115 7.778 698 HA VAL 34 HA VAL 34 0.457 -5.413 5.135 699 HB VAL 34 HB VAL 34 2.239 -3.185 6.134 700 HG11 VAL 34 HG11 VAL 34 2.461 -4.795 3.593 701 HG12 VAL 34 HG12 VAL 34 3.578 -4.847 4.957 702 HG13 VAL 34 HG13 VAL 34 3.422 -3.373 4.001 703 HG21 VAL 34 HG21 VAL 34 0.086 -2.447 5.255 704 HG22 VAL 34 HG22 VAL 34 0.373 -3.356 3.771 705 HG23 VAL 34 HG23 VAL 34 1.402 -1.980 4.176 706 H ILE 35 H ILE 35 1.483 -7.280 5.136 707 HA ILE 35 HA ILE 35 3.452 -7.822 7.271 708 HB ILE 35 HB ILE 35 1.869 -10.097 6.199 709 HG12 ILE 35 HG12 ILE 35 0.769 -8.139 8.228 710 HG13 ILE 35 HG13 ILE 35 0.111 -8.458 6.635 711 HG21 ILE 35 HG21 ILE 35 2.894 -9.378 8.942 712 HG22 ILE 35 HG22 ILE 35 3.721 -10.395 7.763 713 HG23 ILE 35 HG23 ILE 35 2.190 -10.925 8.467 714 HD11 ILE 35 HD11 ILE 35 -0.420 -10.736 7.293 715 HD12 ILE 35 HD12 ILE 35 -1.184 -9.562 8.365 716 HD13 ILE 35 HD13 ILE 35 0.255 -10.435 8.895 717 HA PRO 36 HA PRO 36 6.076 -8.851 3.798 718 HB2 PRO 36 HB2 PRO 36 7.974 -10.189 5.267 719 HB3 PRO 36 HB3 PRO 36 7.912 -8.437 5.077 720 HG2 PRO 36 HG2 PRO 36 6.966 -10.133 7.347 721 HG3 PRO 36 HG3 PRO 36 7.781 -8.558 7.385 722 HD2 PRO 36 HD2 PRO 36 5.126 -8.815 7.771 723 HD3 PRO 36 HD3 PRO 36 5.827 -7.397 6.966 724 H SER 37 H SER 37 6.053 -10.530 2.425 725 HA SER 37 HA SER 37 4.711 -12.947 3.079 726 HB2 SER 37 HB2 SER 37 6.332 -12.165 0.654 727 HB3 SER 37 HB3 SER 37 5.383 -13.647 0.781 728 HG SER 37 HG SER 37 3.564 -12.529 0.678 729 H ASN 38 H ASN 38 8.029 -11.966 3.123 730 HA ASN 38 HA ASN 38 8.733 -14.622 4.148 731 HB2 ASN 38 HB2 ASN 38 9.532 -14.418 1.791 732 HB3 ASN 38 HB3 ASN 38 10.481 -13.014 2.265 733 HD21 ASN 38 HD21 ASN 38 11.309 -15.596 1.155 734 HD22 ASN 38 HD22 ASN 38 12.457 -16.241 2.284 735 HA PRO 39 HA PRO 39 9.887 -11.608 7.296 736 HB2 PRO 39 HB2 PRO 39 10.092 -13.401 9.318 737 HB3 PRO 39 HB3 PRO 39 8.541 -12.773 8.745 738 HG2 PRO 39 HG2 PRO 39 9.884 -15.375 8.105 739 HG3 PRO 39 HG3 PRO 39 8.176 -15.059 8.478 740 HD2 PRO 39 HD2 PRO 39 9.086 -15.392 5.946 741 HD3 PRO 39 HD3 PRO 39 7.715 -14.336 6.339 742 H TYR 40 H TYR 40 11.615 -14.414 6.206 743 HA TYR 40 HA TYR 40 13.902 -14.019 7.900 744 HB2 TYR 40 HB2 TYR 40 13.627 -15.686 5.389 745 HB3 TYR 40 HB3 TYR 40 14.950 -15.777 6.550 746 HD1 TYR 40 HD1 TYR 40 14.320 -16.397 8.983 747 HD2 TYR 40 HD2 TYR 40 11.753 -17.038 5.649 748 HE1 TYR 40 HE1 TYR 40 13.057 -18.059 10.282 749 HE2 TYR 40 HE2 TYR 40 10.484 -18.702 6.941 750 HH TYR 40 HH TYR 40 10.966 -20.249 8.914 751 H GLN 41 H GLN 41 12.988 -13.173 4.615 752 HA GLN 41 HA GLN 41 15.520 -12.029 3.932 753 HB2 GLN 41 HB2 GLN 41 12.765 -11.749 2.724 754 HB3 GLN 41 HB3 GLN 41 14.187 -10.954 2.064 755 HG2 GLN 41 HG2 GLN 41 15.232 -13.056 1.606 756 HG3 GLN 41 HG3 GLN 41 13.949 -13.927 2.442 757 HE21 GLN 41 HE21 GLN 41 14.929 -14.103 -0.331 758 HE22 GLN 41 HE22 GLN 41 13.537 -13.853 -1.330 759 H GLU 42 H GLU 42 12.709 -10.957 5.626 760 HA GLU 42 HA GLU 42 13.257 -8.172 5.548 761 HB2 GLU 42 HB2 GLU 42 11.725 -9.845 7.545 762 HB3 GLU 42 HB3 GLU 42 11.784 -8.087 7.573 763 HG2 GLU 42 HG2 GLU 42 10.711 -9.766 5.319 764 HG3 GLU 42 HG3 GLU 42 9.743 -8.917 6.526 765 H GLN 43 H GLN 43 14.173 -10.784 7.750 766 HA GLN 43 HA GLN 43 15.544 -9.052 9.569 767 HB2 GLN 43 HB2 GLN 43 14.608 -11.379 10.077 768 HB3 GLN 43 HB3 GLN 43 16.029 -12.010 9.254 769 HG2 GLN 43 HG2 GLN 43 16.411 -11.992 11.625 770 HG3 GLN 43 HG3 GLN 43 17.465 -10.812 10.845 771 HE21 GLN 43 HE21 GLN 43 14.041 -10.337 11.428 772 HE22 GLN 43 HE22 GLN 43 14.222 -9.066 12.595 773 H LEU 44 H LEU 44 16.505 -11.209 6.951 774 HA LEU 44 HA LEU 44 19.215 -10.082 6.990 775 HB2 LEU 44 HB2 LEU 44 18.109 -12.337 5.307 776 HB3 LEU 44 HB3 LEU 44 19.797 -11.898 5.492 777 HG LEU 44 HG LEU 44 18.077 -12.917 7.752 778 HD11 LEU 44 HD11 LEU 44 19.230 -15.047 7.444 779 HD12 LEU 44 HD12 LEU 44 20.029 -14.408 6.009 780 HD13 LEU 44 HD13 LEU 44 18.277 -14.615 6.025 781 HD21 LEU 44 HD21 LEU 44 21.061 -12.587 7.471 782 HD22 LEU 44 HD22 LEU 44 20.230 -13.293 8.855 783 HD23 LEU 44 HD23 LEU 44 19.995 -11.589 8.461 784 H SER 45 H SER 45 18.280 -8.033 6.271 785 HA SER 45 HA SER 45 16.561 -7.911 4.034 786 HB2 SER 45 HB2 SER 45 18.099 -5.521 5.005 787 HB3 SER 45 HB3 SER 45 16.430 -5.636 4.455 788 HG SER 45 HG SER 45 16.152 -7.008 6.425 789 H ASP 46 H ASP 46 19.855 -6.548 4.368 790 HA ASP 46 HA ASP 46 21.216 -5.613 2.814 791 HB2 ASP 46 HB2 ASP 46 22.208 -7.138 1.229 792 HB3 ASP 46 HB3 ASP 46 21.933 -7.967 2.752 793 H THR 47 H THR 47 18.385 -5.142 2.429 794 HA THR 47 HA THR 47 18.497 -4.127 -0.308 795 HB THR 47 HB THR 47 15.913 -4.518 -0.215 796 HG1 THR 47 HG1 THR 47 16.701 -6.736 1.360 797 HG21 THR 47 HG21 THR 47 17.821 -6.808 -0.683 798 HG22 THR 47 HG22 THR 47 17.372 -5.573 -1.861 799 HG23 THR 47 HG23 THR 47 16.163 -6.719 -1.280 800 HA PRO 48 HA PRO 48 17.573 -0.411 1.892 801 HB2 PRO 48 HB2 PRO 48 16.608 1.098 -0.162 802 HB3 PRO 48 HB3 PRO 48 18.328 0.765 0.068 803 HG2 PRO 48 HG2 PRO 48 16.375 -0.546 -1.780 804 HG3 PRO 48 HG3 PRO 48 18.057 -0.069 -2.080 805 HD2 PRO 48 HD2 PRO 48 17.342 -2.624 -1.543 806 HD3 PRO 48 HD3 PRO 48 18.907 -1.947 -1.052 807 H LEU 49 H LEU 49 15.873 0.461 2.949 808 HA LEU 49 HA LEU 49 13.219 -0.592 2.366 809 HB2 LEU 49 HB2 LEU 49 14.413 0.934 4.649 810 HB3 LEU 49 HB3 LEU 49 12.675 0.886 4.437 811 HG LEU 49 HG LEU 49 14.420 -1.553 4.773 812 HD11 LEU 49 HD11 LEU 49 12.599 -0.152 6.719 813 HD12 LEU 49 HD12 LEU 49 14.367 -0.162 6.785 814 HD13 LEU 49 HD13 LEU 49 13.470 -1.667 7.006 815 HD21 LEU 49 HD21 LEU 49 12.368 -1.963 3.514 816 HD22 LEU 49 HD22 LEU 49 11.426 -1.189 4.789 817 HD23 LEU 49 HD23 LEU 49 12.287 -2.692 5.116 818 H ILE 50 H ILE 50 11.923 0.450 1.050 819 HA ILE 50 HA ILE 50 12.312 3.295 0.573 820 HB ILE 50 HB ILE 50 10.200 1.452 -0.571 821 HG12 ILE 50 HG12 ILE 50 12.733 2.452 -1.885 822 HG13 ILE 50 HG13 ILE 50 12.585 0.863 -1.146 823 HG21 ILE 50 HG21 ILE 50 11.088 4.224 -1.381 824 HG22 ILE 50 HG22 ILE 50 9.559 3.807 -0.607 825 HG23 ILE 50 HG23 ILE 50 9.906 3.236 -2.241 826 HD11 ILE 50 HD11 ILE 50 10.982 1.895 -3.472 827 HD12 ILE 50 HD12 ILE 50 10.800 0.308 -2.729 828 HD13 ILE 50 HD13 ILE 50 12.305 0.732 -3.547 829 HA PRO 51 HA PRO 51 9.158 4.201 3.612 830 HB2 PRO 51 HB2 PRO 51 9.234 6.895 3.252 831 HB3 PRO 51 HB3 PRO 51 10.405 6.023 4.242 832 HG2 PRO 51 HG2 PRO 51 10.687 7.093 1.475 833 HG3 PRO 51 HG3 PRO 51 11.876 7.004 2.777 834 HD2 PRO 51 HD2 PRO 51 11.770 5.262 0.656 835 HD3 PRO 51 HD3 PRO 51 12.504 4.888 2.226 836 H LEU 52 H LEU 52 7.018 4.308 3.301 837 HA LEU 52 HA LEU 52 6.022 5.572 0.849 838 HB2 LEU 52 HB2 LEU 52 5.236 2.853 1.893 839 HB3 LEU 52 HB3 LEU 52 4.296 3.736 0.704 840 HG LEU 52 HG LEU 52 6.721 3.738 -0.503 841 HD11 LEU 52 HD11 LEU 52 6.549 1.137 1.000 842 HD12 LEU 52 HD12 LEU 52 7.754 2.401 1.243 843 HD13 LEU 52 HD13 LEU 52 7.698 1.519 -0.282 844 HD21 LEU 52 HD21 LEU 52 5.867 1.919 -1.884 845 HD22 LEU 52 HD22 LEU 52 4.600 3.088 -1.515 846 HD23 LEU 52 HD23 LEU 52 4.656 1.548 -0.659 847 H THR 53 H THR 53 4.345 6.861 1.131 848 HA THR 53 HA THR 53 3.030 6.857 3.774 849 HB THR 53 HB THR 53 3.101 9.182 1.845 850 HG1 THR 53 HG1 THR 53 5.196 8.146 3.091 851 HG21 THR 53 HG21 THR 53 2.663 8.973 4.828 852 HG22 THR 53 HG22 THR 53 1.435 9.321 3.609 853 HG23 THR 53 HG23 THR 53 2.728 10.481 3.918 854 H ILE 54 H ILE 54 1.016 6.119 3.737 855 HA ILE 54 HA ILE 54 -0.417 6.157 1.170 856 HB ILE 54 HB ILE 54 -0.845 4.339 3.545 857 HG12 ILE 54 HG12 ILE 54 0.384 3.884 0.817 858 HG13 ILE 54 HG13 ILE 54 1.182 3.743 2.380 859 HG21 ILE 54 HG21 ILE 54 -2.195 4.378 0.848 860 HG22 ILE 54 HG22 ILE 54 -2.933 4.817 2.389 861 HG23 ILE 54 HG23 ILE 54 -2.426 3.152 2.094 862 HD11 ILE 54 HD11 ILE 54 0.678 1.565 1.405 863 HD12 ILE 54 HD12 ILE 54 -1.037 1.978 1.381 864 HD13 ILE 54 HD13 ILE 54 -0.191 1.818 2.919 865 H PHE 55 H PHE 55 -2.058 7.447 0.974 866 HA PHE 55 HA PHE 55 -3.374 8.508 3.389 867 HB2 PHE 55 HB2 PHE 55 -3.214 9.596 0.568 868 HB3 PHE 55 HB3 PHE 55 -4.215 10.293 1.834 869 HD1 PHE 55 HD1 PHE 55 -0.727 9.559 0.879 870 HD2 PHE 55 HD2 PHE 55 -3.329 11.799 3.385 871 HE1 PHE 55 HE1 PHE 55 1.169 10.953 1.595 872 HE2 PHE 55 HE2 PHE 55 -1.440 13.202 4.103 873 HZ PHE 55 HZ PHE 55 0.813 12.779 3.209 874 H VAL 56 H VAL 56 -5.538 8.180 3.686 875 HA VAL 56 HA VAL 56 -6.885 6.413 1.831 876 HB VAL 56 HB VAL 56 -7.407 7.327 4.594 877 HG11 VAL 56 HG11 VAL 56 -9.453 8.144 3.492 878 HG12 VAL 56 HG12 VAL 56 -9.787 6.749 4.518 879 HG13 VAL 56 HG13 VAL 56 -9.695 6.555 2.768 880 HG21 VAL 56 HG21 VAL 56 -8.119 4.996 4.796 881 HG22 VAL 56 HG22 VAL 56 -6.514 5.144 4.071 882 HG23 VAL 56 HG23 VAL 56 -7.917 4.801 3.052 883 H GLY 57 H GLY 57 -8.357 6.957 0.379 884 HA2 GLY 57 HA2 GLY 57 -8.410 9.668 -0.418 885 HA3 GLY 57 HA3 GLY 57 -9.271 8.351 -1.183 886 H GLU 58 H GLU 58 -9.700 11.214 0.160 887 HA GLU 58 HA GLU 58 -11.819 10.871 1.989 888 HB2 GLU 58 HB2 GLU 58 -12.213 13.285 1.655 889 HB3 GLU 58 HB3 GLU 58 -10.518 12.923 1.941 890 HG2 GLU 58 HG2 GLU 58 -10.053 13.119 -0.432 891 HG3 GLU 58 HG3 GLU 58 -11.759 13.420 -0.755 892 H ASN 59 H ASN 59 -11.709 11.425 -1.478 893 HA ASN 59 HA ASN 59 -14.260 10.290 -1.939 894 HB2 ASN 59 HB2 ASN 59 -15.032 12.410 -0.969 895 HB3 ASN 59 HB3 ASN 59 -14.052 13.308 -2.114 896 HD21 ASN 59 HD21 ASN 59 -16.924 13.394 -1.622 897 HD22 ASN 59 HD22 ASN 59 -17.684 13.031 -3.140 898 H THR 60 H THR 60 -13.853 9.305 -3.777 899 HA THR 60 HA THR 60 -12.951 10.854 -6.058 900 HB THR 60 HB THR 60 -11.536 8.287 -5.281 901 HG1 THR 60 HG1 THR 60 -11.074 10.892 -4.642 902 HG21 THR 60 HG21 THR 60 -10.069 8.799 -7.184 903 HG22 THR 60 HG22 THR 60 -11.070 10.197 -7.577 904 HG23 THR 60 HG23 THR 60 -11.739 8.570 -7.702 905 H GLY 61 H GLY 61 -15.135 10.568 -6.638 906 HA2 GLY 61 HA2 GLY 61 -16.218 7.899 -6.902 907 HA3 GLY 61 HA3 GLY 61 -17.029 9.407 -7.303 908 H VAL 62 H VAL 62 -16.504 6.748 -8.721 909 HA VAL 62 HA VAL 62 -15.428 7.891 -11.201 910 HB VAL 62 HB VAL 62 -14.063 6.048 -10.516 911 HG11 VAL 62 HG11 VAL 62 -14.942 3.785 -10.169 912 HG12 VAL 62 HG12 VAL 62 -16.584 4.404 -10.348 913 HG13 VAL 62 HG13 VAL 62 -15.586 4.933 -8.994 914 HG21 VAL 62 HG21 VAL 62 -14.303 4.528 -12.415 915 HG22 VAL 62 HG22 VAL 62 -14.505 6.213 -12.899 916 HG23 VAL 62 HG23 VAL 62 -15.917 5.171 -12.723 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 16.781 15.090 -2.097 2 H2 GLY 1 H2 GLY 1 15.600 14.300 -1.174 3 H3 GLY 1 H3 GLY 1 16.926 15.035 -0.409 4 HA2 GLY 1 HA2 GLY 1 14.967 16.396 -0.149 5 HA3 GLY 1 HA3 GLY 1 16.180 17.210 -1.125 6 H ALA 2 H ALA 2 13.751 14.699 -1.889 7 HA ALA 2 HA ALA 2 12.975 16.262 -4.233 8 HB1 ALA 2 HB1 ALA 2 13.392 13.868 -4.512 9 HB2 ALA 2 HB2 ALA 2 11.720 14.278 -4.896 10 HB3 ALA 2 HB3 ALA 2 12.110 13.508 -3.358 11 H MET 3 H MET 3 11.220 17.497 -4.296 12 HA MET 3 HA MET 3 9.279 17.301 -2.105 13 HB2 MET 3 HB2 MET 3 9.776 19.475 -4.142 14 HB3 MET 3 HB3 MET 3 8.467 19.511 -2.971 15 HG2 MET 3 HG2 MET 3 10.089 19.482 -1.149 16 HG3 MET 3 HG3 MET 3 11.404 19.437 -2.318 17 HE1 MET 3 HE1 MET 3 12.059 21.446 -3.905 18 HE2 MET 3 HE2 MET 3 11.114 22.928 -4.040 19 HE3 MET 3 HE3 MET 3 10.429 21.394 -4.577 20 H GLU 4 H GLU 4 9.719 16.615 -5.406 21 HA GLU 4 HA GLU 4 6.863 15.964 -5.651 22 HB2 GLU 4 HB2 GLU 4 7.750 17.774 -7.208 23 HB3 GLU 4 HB3 GLU 4 8.743 16.532 -7.952 24 HG2 GLU 4 HG2 GLU 4 5.783 16.180 -7.760 25 HG3 GLU 4 HG3 GLU 4 6.484 17.192 -9.021 26 H MET 5 H MET 5 6.665 13.897 -5.263 27 HA MET 5 HA MET 5 8.737 12.043 -6.247 28 HB2 MET 5 HB2 MET 5 6.991 11.445 -3.878 29 HB3 MET 5 HB3 MET 5 8.562 10.774 -4.289 30 HG2 MET 5 HG2 MET 5 9.090 12.130 -2.521 31 HG3 MET 5 HG3 MET 5 9.403 13.197 -3.884 32 HE1 MET 5 HE1 MET 5 5.910 12.101 -2.406 33 HE2 MET 5 HE2 MET 5 5.628 13.395 -1.240 34 HE3 MET 5 HE3 MET 5 6.952 12.258 -0.990 35 HA PRO 6 HA PRO 6 5.732 9.917 -8.584 36 HB2 PRO 6 HB2 PRO 6 6.365 7.294 -8.047 37 HB3 PRO 6 HB3 PRO 6 7.245 8.325 -9.178 38 HG2 PRO 6 HG2 PRO 6 7.900 7.654 -6.338 39 HG3 PRO 6 HG3 PRO 6 8.978 7.746 -7.745 40 HD2 PRO 6 HD2 PRO 6 8.844 9.734 -5.954 41 HD3 PRO 6 HD3 PRO 6 9.051 10.066 -7.689 42 H THR 7 H THR 7 3.671 9.461 -8.283 43 HA THR 7 HA THR 7 2.821 8.621 -5.588 44 HB THR 7 HB THR 7 1.252 10.344 -7.502 45 HG1 THR 7 HG1 THR 7 3.411 11.011 -6.083 46 HG21 THR 7 HG21 THR 7 -0.044 10.911 -5.504 47 HG22 THR 7 HG22 THR 7 0.958 9.823 -4.544 48 HG23 THR 7 HG23 THR 7 -0.078 9.175 -5.818 49 H PHE 8 H PHE 8 1.398 6.975 -5.432 50 HA PHE 8 HA PHE 8 0.383 5.801 -7.941 51 HB2 PHE 8 HB2 PHE 8 1.058 4.444 -5.320 52 HB3 PHE 8 HB3 PHE 8 0.376 3.644 -6.728 53 HD1 PHE 8 HD1 PHE 8 3.353 5.405 -5.436 54 HD2 PHE 8 HD2 PHE 8 1.769 2.937 -8.521 55 HE1 PHE 8 HE1 PHE 8 5.632 4.977 -6.258 56 HE2 PHE 8 HE2 PHE 8 4.050 2.506 -9.351 57 HZ PHE 8 HZ PHE 8 5.985 3.527 -8.220 58 H TYR 9 H TYR 9 -1.764 5.137 -8.000 59 HA TYR 9 HA TYR 9 -3.378 5.765 -5.620 60 HB2 TYR 9 HB2 TYR 9 -3.393 7.436 -7.716 61 HB3 TYR 9 HB3 TYR 9 -4.559 6.261 -8.311 62 HD1 TYR 9 HD1 TYR 9 -6.149 5.527 -6.048 63 HD2 TYR 9 HD2 TYR 9 -4.470 9.320 -6.987 64 HE1 TYR 9 HE1 TYR 9 -7.901 6.628 -4.720 65 HE2 TYR 9 HE2 TYR 9 -6.211 10.430 -5.660 66 HH TYR 9 HH TYR 9 -8.130 8.856 -3.467 67 H LEU 10 H LEU 10 -4.549 4.079 -5.016 68 HA LEU 10 HA LEU 10 -5.589 2.249 -7.033 69 HB2 LEU 10 HB2 LEU 10 -4.939 0.330 -5.448 70 HB3 LEU 10 HB3 LEU 10 -3.718 1.001 -6.508 71 HG LEU 10 HG LEU 10 -3.066 2.450 -4.456 72 HD11 LEU 10 HD11 LEU 10 -3.480 1.380 -2.311 73 HD12 LEU 10 HD12 LEU 10 -4.523 0.196 -3.099 74 HD13 LEU 10 HD13 LEU 10 -4.984 1.899 -3.069 75 HD21 LEU 10 HD21 LEU 10 -1.639 0.765 -5.422 76 HD22 LEU 10 HD22 LEU 10 -2.536 -0.511 -4.599 77 HD23 LEU 10 HD23 LEU 10 -1.589 0.647 -3.663 78 H ALA 11 H ALA 11 -7.324 0.885 -6.242 79 HA ALA 11 HA ALA 11 -8.598 1.934 -3.799 80 HB1 ALA 11 HB1 ALA 11 -10.783 1.650 -4.853 81 HB2 ALA 11 HB2 ALA 11 -9.998 1.146 -6.349 82 HB3 ALA 11 HB3 ALA 11 -9.778 2.790 -5.751 83 H LEU 12 H LEU 12 -9.181 0.462 -2.353 84 HA LEU 12 HA LEU 12 -8.870 -2.372 -3.127 85 HB2 LEU 12 HB2 LEU 12 -8.168 -1.140 -0.466 86 HB3 LEU 12 HB3 LEU 12 -7.862 -2.786 -0.980 87 HG LEU 12 HG LEU 12 -6.547 -0.331 -2.140 88 HD11 LEU 12 HD11 LEU 12 -5.840 -0.781 0.157 89 HD12 LEU 12 HD12 LEU 12 -4.545 -1.116 -0.993 90 HD13 LEU 12 HD13 LEU 12 -5.461 -2.447 -0.284 91 HD21 LEU 12 HD21 LEU 12 -6.752 -2.133 -3.773 92 HD22 LEU 12 HD22 LEU 12 -6.025 -3.262 -2.632 93 HD23 LEU 12 HD23 LEU 12 -5.074 -1.920 -3.270 94 H HIS 13 H HIS 13 -10.345 -3.816 -2.327 95 HA HIS 13 HA HIS 13 -12.817 -2.789 -1.317 96 HB2 HIS 13 HB2 HIS 13 -11.776 -5.586 -1.748 97 HB3 HIS 13 HB3 HIS 13 -13.354 -5.278 -1.030 98 HD1 HIS 13 HD1 HIS 13 -11.938 -6.079 -4.152 99 HD2 HIS 13 HD2 HIS 13 -14.875 -3.401 -2.913 100 HE1 HIS 13 HE1 HIS 13 -13.269 -5.516 -6.216 101 HE2 HIS 13 HE2 HIS 13 -14.923 -3.761 -5.476 102 H GLY 14 H GLY 14 -13.524 -2.604 0.706 103 HA2 GLY 14 HA2 GLY 14 -11.729 -2.621 2.864 104 HA3 GLY 14 HA3 GLY 14 -13.473 -2.491 2.992 105 H GLY 15 H GLY 15 -10.793 -4.350 3.687 106 HA2 GLY 15 HA2 GLY 15 -10.972 -6.109 5.290 107 HA3 GLY 15 HA3 GLY 15 -12.540 -6.519 4.625 108 H GLN 16 H GLN 16 -10.566 -5.949 2.049 109 HA GLN 16 HA GLN 16 -10.215 -8.823 1.671 110 HB2 GLN 16 HB2 GLN 16 -10.115 -6.505 -0.256 111 HB3 GLN 16 HB3 GLN 16 -9.727 -8.159 -0.712 112 HG2 GLN 16 HG2 GLN 16 -12.364 -7.143 0.320 113 HG3 GLN 16 HG3 GLN 16 -11.995 -7.661 -1.325 114 HE21 GLN 16 HE21 GLN 16 -13.983 -8.648 0.605 115 HE22 GLN 16 HE22 GLN 16 -13.672 -10.340 0.768 116 H THR 17 H THR 17 -8.271 -9.728 0.928 117 HA THR 17 HA THR 17 -5.916 -8.366 2.016 118 HB THR 17 HB THR 17 -6.035 -11.211 0.996 119 HG1 THR 17 HG1 THR 17 -7.528 -10.279 2.931 120 HG21 THR 17 HG21 THR 17 -4.332 -9.850 3.094 121 HG22 THR 17 HG22 THR 17 -3.816 -10.282 1.465 122 HG23 THR 17 HG23 THR 17 -4.230 -11.547 2.622 123 H TYR 18 H TYR 18 -4.263 -7.717 0.799 124 HA TYR 18 HA TYR 18 -4.244 -8.423 -2.054 125 HB2 TYR 18 HB2 TYR 18 -3.830 -5.710 -0.788 126 HB3 TYR 18 HB3 TYR 18 -3.375 -6.083 -2.448 127 HD1 TYR 18 HD1 TYR 18 -5.062 -6.423 -4.150 128 HD2 TYR 18 HD2 TYR 18 -6.170 -5.498 -0.153 129 HE1 TYR 18 HE1 TYR 18 -7.328 -5.885 -4.922 130 HE2 TYR 18 HE2 TYR 18 -8.444 -4.950 -0.902 131 HH TYR 18 HH TYR 18 -9.580 -5.669 -4.083 132 H HIS 19 H HIS 19 -2.254 -8.525 -3.023 133 HA HIS 19 HA HIS 19 0.050 -8.770 -1.252 134 HB2 HIS 19 HB2 HIS 19 -0.688 -9.762 -3.947 135 HB3 HIS 19 HB3 HIS 19 1.009 -9.405 -3.694 136 HD1 HIS 19 HD1 HIS 19 -1.090 -12.168 -3.662 137 HD2 HIS 19 HD2 HIS 19 1.700 -10.728 -0.923 138 HE1 HIS 19 HE1 HIS 19 -0.417 -14.147 -2.271 139 HE2 HIS 19 HE2 HIS 19 1.461 -13.314 -0.818 140 H LEU 20 H LEU 20 1.305 -7.113 -0.971 141 HA LEU 20 HA LEU 20 1.376 -4.976 -2.982 142 HB2 LEU 20 HB2 LEU 20 0.561 -4.017 -1.014 143 HB3 LEU 20 HB3 LEU 20 1.568 -5.023 0.007 144 HG LEU 20 HG LEU 20 3.523 -3.692 -0.560 145 HD11 LEU 20 HD11 LEU 20 2.978 -3.089 -2.828 146 HD12 LEU 20 HD12 LEU 20 3.283 -1.632 -1.876 147 HD13 LEU 20 HD13 LEU 20 1.628 -2.097 -2.271 148 HD21 LEU 20 HD21 LEU 20 2.866 -1.608 0.532 149 HD22 LEU 20 HD22 LEU 20 2.150 -3.008 1.334 150 HD23 LEU 20 HD23 LEU 20 1.167 -2.006 0.269 151 H ILE 21 H ILE 21 3.150 -4.826 -4.122 152 HA ILE 21 HA ILE 21 5.711 -5.615 -2.898 153 HB ILE 21 HB ILE 21 4.947 -6.063 -5.791 154 HG12 ILE 21 HG12 ILE 21 5.463 -8.312 -3.903 155 HG13 ILE 21 HG13 ILE 21 3.900 -7.508 -3.816 156 HG21 ILE 21 HG21 ILE 21 7.037 -7.346 -5.895 157 HG22 ILE 21 HG22 ILE 21 7.373 -6.933 -4.214 158 HG23 ILE 21 HG23 ILE 21 7.334 -5.668 -5.441 159 HD11 ILE 21 HD11 ILE 21 3.457 -8.024 -6.117 160 HD12 ILE 21 HD12 ILE 21 3.890 -9.501 -5.250 161 HD13 ILE 21 HD13 ILE 21 5.066 -8.718 -6.307 162 H VAL 22 H VAL 22 7.129 -3.996 -2.905 163 HA VAL 22 HA VAL 22 6.921 -1.968 -5.028 164 HB VAL 22 HB VAL 22 6.475 -1.040 -2.767 165 HG11 VAL 22 HG11 VAL 22 7.870 -2.493 -1.428 166 HG12 VAL 22 HG12 VAL 22 8.342 -0.812 -1.178 167 HG13 VAL 22 HG13 VAL 22 9.319 -1.859 -2.210 168 HG21 VAL 22 HG21 VAL 22 9.010 -0.070 -4.073 169 HG22 VAL 22 HG22 VAL 22 8.034 0.851 -2.927 170 HG23 VAL 22 HG23 VAL 22 7.365 0.405 -4.497 171 H ASP 23 H ASP 23 8.696 -1.627 -6.236 172 HA ASP 23 HA ASP 23 11.271 -2.671 -5.371 173 HB2 ASP 23 HB2 ASP 23 11.603 -4.040 -7.323 174 HB3 ASP 23 HB3 ASP 23 10.108 -4.547 -6.553 175 H THR 24 H THR 24 12.954 -2.130 -7.191 176 HA THR 24 HA THR 24 12.247 0.550 -8.197 177 HB THR 24 HB THR 24 14.912 0.782 -7.962 178 HG1 THR 24 HG1 THR 24 14.075 -1.113 -6.027 179 HG21 THR 24 HG21 THR 24 13.275 2.360 -7.094 180 HG22 THR 24 HG22 THR 24 14.489 2.005 -5.864 181 HG23 THR 24 HG23 THR 24 12.892 1.260 -5.767 182 H ASP 25 H ASP 25 12.689 1.047 -10.216 183 HA ASP 25 HA ASP 25 13.664 -0.994 -12.013 184 HB2 ASP 25 HB2 ASP 25 11.848 0.288 -12.838 185 HB3 ASP 25 HB3 ASP 25 12.596 1.804 -12.359 186 H SER 26 H SER 26 15.367 -0.335 -13.698 187 HA SER 26 HA SER 26 17.800 0.017 -12.422 188 HB2 SER 26 HB2 SER 26 17.226 0.633 -15.324 189 HB3 SER 26 HB3 SER 26 18.763 0.126 -14.627 190 HG SER 26 HG SER 26 17.070 -1.455 -15.676 191 H LEU 27 H LEU 27 15.637 2.435 -13.767 192 HA LEU 27 HA LEU 27 17.562 4.550 -13.840 193 HB2 LEU 27 HB2 LEU 27 14.556 4.671 -13.771 194 HB3 LEU 27 HB3 LEU 27 15.617 6.007 -14.168 195 HG LEU 27 HG LEU 27 15.424 3.459 -15.771 196 HD11 LEU 27 HD11 LEU 27 14.128 4.759 -17.362 197 HD12 LEU 27 HD12 LEU 27 14.190 6.158 -16.291 198 HD13 LEU 27 HD13 LEU 27 13.315 4.707 -15.796 199 HD21 LEU 27 HD21 LEU 27 17.560 4.613 -15.979 200 HD22 LEU 27 HD22 LEU 27 16.720 6.119 -16.346 201 HD23 LEU 27 HD23 LEU 27 16.620 4.760 -17.466 202 H GLY 28 H GLY 28 15.764 3.096 -11.326 203 HA2 GLY 28 HA2 GLY 28 16.356 3.600 -9.048 204 HA3 GLY 28 HA3 GLY 28 16.591 5.277 -9.523 205 H ASN 29 H ASN 29 13.875 4.214 -11.044 206 HA ASN 29 HA ASN 29 12.157 5.585 -9.160 207 HB2 ASN 29 HB2 ASN 29 10.405 5.303 -10.884 208 HB3 ASN 29 HB3 ASN 29 11.844 6.105 -11.498 209 HD21 ASN 29 HD21 ASN 29 13.101 5.108 -12.969 210 HD22 ASN 29 HD22 ASN 29 12.655 3.654 -13.782 211 HA PRO 30 HA PRO 30 10.624 1.823 -7.474 212 HB2 PRO 30 HB2 PRO 30 8.644 2.897 -5.962 213 HB3 PRO 30 HB3 PRO 30 10.353 2.997 -5.534 214 HG2 PRO 30 HG2 PRO 30 8.548 5.091 -6.531 215 HG3 PRO 30 HG3 PRO 30 10.068 5.245 -5.643 216 HD2 PRO 30 HD2 PRO 30 9.624 5.572 -8.443 217 HD3 PRO 30 HD3 PRO 30 11.158 5.683 -7.559 218 H SER 31 H SER 31 8.895 0.433 -7.585 219 HA SER 31 HA SER 31 6.693 1.189 -9.385 220 HB2 SER 31 HB2 SER 31 8.394 -0.219 -10.541 221 HB3 SER 31 HB3 SER 31 8.174 -1.450 -9.303 222 HG SER 31 HG SER 31 6.430 -2.095 -10.260 223 H LEU 32 H LEU 32 4.699 0.112 -8.929 224 HA LEU 32 HA LEU 32 4.648 -1.208 -6.308 225 HB2 LEU 32 HB2 LEU 32 3.886 1.246 -6.355 226 HB3 LEU 32 HB3 LEU 32 2.478 0.654 -7.216 227 HG LEU 32 HG LEU 32 2.172 -0.951 -5.237 228 HD11 LEU 32 HD11 LEU 32 3.104 -0.149 -3.120 229 HD12 LEU 32 HD12 LEU 32 4.033 1.068 -3.996 230 HD13 LEU 32 HD13 LEU 32 4.366 -0.646 -4.248 231 HD21 LEU 32 HD21 LEU 32 0.954 0.738 -3.979 232 HD22 LEU 32 HD22 LEU 32 0.710 0.943 -5.713 233 HD23 LEU 32 HD23 LEU 32 1.808 2.014 -4.843 234 H SER 33 H SER 33 3.753 -3.115 -6.384 235 HA SER 33 HA SER 33 1.706 -3.636 -8.436 236 HB2 SER 33 HB2 SER 33 3.782 -5.552 -7.340 237 HB3 SER 33 HB3 SER 33 2.509 -5.978 -8.482 238 HG SER 33 HG SER 33 4.921 -4.874 -8.962 239 H VAL 34 H VAL 34 -0.228 -3.968 -7.558 240 HA VAL 34 HA VAL 34 -0.360 -5.306 -4.941 241 HB VAL 34 HB VAL 34 -2.108 -3.048 -5.942 242 HG11 VAL 34 HG11 VAL 34 -3.342 -3.263 -3.840 243 HG12 VAL 34 HG12 VAL 34 -2.393 -4.690 -3.426 244 HG13 VAL 34 HG13 VAL 34 -3.479 -4.727 -4.814 245 HG21 VAL 34 HG21 VAL 34 0.046 -2.358 -5.005 246 HG22 VAL 34 HG22 VAL 34 -0.301 -3.271 -3.535 247 HG23 VAL 34 HG23 VAL 34 -1.292 -1.875 -3.960 248 H ILE 35 H ILE 35 -1.404 -7.160 -4.981 249 HA ILE 35 HA ILE 35 -3.302 -7.669 -7.183 250 HB ILE 35 HB ILE 35 -1.788 -9.937 -5.992 251 HG12 ILE 35 HG12 ILE 35 -0.629 -8.066 -8.071 252 HG13 ILE 35 HG13 ILE 35 -0.013 -8.306 -6.445 253 HG21 ILE 35 HG21 ILE 35 -2.766 -9.302 -8.772 254 HG22 ILE 35 HG22 ILE 35 -3.594 -10.305 -7.583 255 HG23 ILE 35 HG23 ILE 35 -2.049 -10.829 -8.257 256 HD11 ILE 35 HD11 ILE 35 1.340 -9.488 -8.059 257 HD12 ILE 35 HD12 ILE 35 -0.078 -10.363 -8.638 258 HD13 ILE 35 HD13 ILE 35 0.514 -10.630 -6.998 259 HA PRO 36 HA PRO 36 -6.080 -8.702 -3.817 260 HB2 PRO 36 HB2 PRO 36 -7.931 -10.010 -5.357 261 HB3 PRO 36 HB3 PRO 36 -7.854 -8.251 -5.189 262 HG2 PRO 36 HG2 PRO 36 -6.816 -9.992 -7.390 263 HG3 PRO 36 HG3 PRO 36 -7.635 -8.425 -7.492 264 HD2 PRO 36 HD2 PRO 36 -4.963 -8.669 -7.755 265 HD3 PRO 36 HD3 PRO 36 -5.708 -7.245 -7.002 266 H SER 37 H SER 37 -6.110 -10.416 -2.476 267 HA SER 37 HA SER 37 -4.750 -12.818 -3.166 268 HB2 SER 37 HB2 SER 37 -6.443 -12.155 -0.751 269 HB3 SER 37 HB3 SER 37 -5.414 -13.582 -0.909 270 HG SER 37 HG SER 37 -4.218 -11.140 -1.431 271 H ASN 38 H ASN 38 -8.052 -11.786 -3.201 272 HA ASN 38 HA ASN 38 -8.725 -14.300 -4.560 273 HB2 ASN 38 HB2 ASN 38 -10.406 -12.835 -2.525 274 HB3 ASN 38 HB3 ASN 38 -11.088 -13.994 -3.657 275 HD21 ASN 38 HD21 ASN 38 -9.178 -13.543 -0.812 276 HD22 ASN 38 HD22 ASN 38 -9.075 -15.217 -0.382 277 HA PRO 39 HA PRO 39 -9.497 -10.964 -7.512 278 HB2 PRO 39 HB2 PRO 39 -9.632 -12.605 -9.678 279 HB3 PRO 39 HB3 PRO 39 -8.106 -12.049 -8.979 280 HG2 PRO 39 HG2 PRO 39 -9.518 -14.662 -8.613 281 HG3 PRO 39 HG3 PRO 39 -7.789 -14.347 -8.848 282 HD2 PRO 39 HD2 PRO 39 -8.859 -14.857 -6.413 283 HD3 PRO 39 HD3 PRO 39 -7.462 -13.785 -6.636 284 H TYR 40 H TYR 40 -11.345 -13.806 -6.807 285 HA TYR 40 HA TYR 40 -13.548 -13.203 -8.530 286 HB2 TYR 40 HB2 TYR 40 -13.480 -15.040 -6.127 287 HB3 TYR 40 HB3 TYR 40 -14.678 -15.047 -7.419 288 HD1 TYR 40 HD1 TYR 40 -13.762 -15.472 -9.824 289 HD2 TYR 40 HD2 TYR 40 -11.637 -16.452 -6.268 290 HE1 TYR 40 HE1 TYR 40 -12.380 -17.063 -11.092 291 HE2 TYR 40 HE2 TYR 40 -10.253 -18.045 -7.529 292 HH TYR 40 HH TYR 40 -10.099 -18.091 -10.882 293 H GLN 41 H GLN 41 -12.683 -12.497 -5.215 294 HA GLN 41 HA GLN 41 -15.261 -11.506 -4.477 295 HB2 GLN 41 HB2 GLN 41 -12.562 -11.067 -3.188 296 HB3 GLN 41 HB3 GLN 41 -14.111 -10.627 -2.475 297 HG2 GLN 41 HG2 GLN 41 -14.755 -13.044 -2.625 298 HG3 GLN 41 HG3 GLN 41 -13.090 -13.390 -3.084 299 HE21 GLN 41 HE21 GLN 41 -15.224 -12.436 -0.539 300 HE22 GLN 41 HE22 GLN 41 -14.093 -12.602 0.764 301 H GLU 42 H GLU 42 -12.524 -10.247 -6.119 302 HA GLU 42 HA GLU 42 -13.110 -7.484 -5.873 303 HB2 GLU 42 HB2 GLU 42 -11.689 -8.980 -8.085 304 HB3 GLU 42 HB3 GLU 42 -11.688 -7.234 -7.882 305 HG2 GLU 42 HG2 GLU 42 -10.557 -9.233 -5.938 306 HG3 GLU 42 HG3 GLU 42 -9.628 -8.244 -7.065 307 H GLN 43 H GLN 43 -14.152 -10.045 -8.005 308 HA GLN 43 HA GLN 43 -15.638 -8.348 -9.778 309 HB2 GLN 43 HB2 GLN 43 -15.912 -11.328 -9.338 310 HB3 GLN 43 HB3 GLN 43 -16.468 -10.416 -10.733 311 HG2 GLN 43 HG2 GLN 43 -14.170 -9.907 -11.337 312 HG3 GLN 43 HG3 GLN 43 -13.597 -10.786 -9.919 313 HE21 GLN 43 HE21 GLN 43 -15.076 -11.044 -13.048 314 HE22 GLN 43 HE22 GLN 43 -14.812 -12.747 -13.263 315 H LEU 44 H LEU 44 -16.362 -10.473 -7.071 316 HA LEU 44 HA LEU 44 -19.174 -9.693 -7.087 317 HB2 LEU 44 HB2 LEU 44 -17.697 -11.592 -5.255 318 HB3 LEU 44 HB3 LEU 44 -19.437 -11.412 -5.382 319 HG LEU 44 HG LEU 44 -17.661 -12.398 -7.616 320 HD11 LEU 44 HD11 LEU 44 -18.570 -14.606 -7.129 321 HD12 LEU 44 HD12 LEU 44 -19.433 -13.952 -5.736 322 HD13 LEU 44 HD13 LEU 44 -17.670 -13.970 -5.753 323 HD21 LEU 44 HD21 LEU 44 -19.776 -13.084 -8.642 324 HD22 LEU 44 HD22 LEU 44 -19.700 -11.340 -8.398 325 HD23 LEU 44 HD23 LEU 44 -20.659 -12.339 -7.310 326 H SER 45 H SER 45 -18.380 -7.450 -6.618 327 HA SER 45 HA SER 45 -17.127 -6.974 -4.087 328 HB2 SER 45 HB2 SER 45 -17.464 -4.544 -4.757 329 HB3 SER 45 HB3 SER 45 -16.473 -5.530 -5.834 330 HG SER 45 HG SER 45 -18.528 -4.117 -6.534 331 H ASP 46 H ASP 46 -18.825 -7.995 -2.774 332 HA ASP 46 HA ASP 46 -21.120 -6.332 -2.201 333 HB2 ASP 46 HB2 ASP 46 -19.863 -8.675 -0.765 334 HB3 ASP 46 HB3 ASP 46 -21.221 -7.779 -0.094 335 H THR 47 H THR 47 -17.874 -6.167 -1.753 336 HA THR 47 HA THR 47 -18.019 -4.494 0.642 337 HB THR 47 HB THR 47 -15.457 -4.546 0.321 338 HG1 THR 47 HG1 THR 47 -15.986 -6.949 -1.086 339 HG21 THR 47 HG21 THR 47 -16.932 -7.084 1.018 340 HG22 THR 47 HG22 THR 47 -16.631 -5.733 2.110 341 HG23 THR 47 HG23 THR 47 -15.280 -6.688 1.494 342 HA PRO 48 HA PRO 48 -17.580 -0.893 -1.982 343 HB2 PRO 48 HB2 PRO 48 -17.030 0.903 -0.032 344 HB3 PRO 48 HB3 PRO 48 -18.654 0.259 -0.291 345 HG2 PRO 48 HG2 PRO 48 -16.607 -0.527 1.742 346 HG3 PRO 48 HG3 PRO 48 -18.358 -0.317 1.936 347 HD2 PRO 48 HD2 PRO 48 -17.157 -2.748 1.646 348 HD3 PRO 48 HD3 PRO 48 -18.821 -2.413 1.128 349 H LEU 49 H LEU 49 -15.900 0.494 -2.706 350 HA LEU 49 HA LEU 49 -13.229 -0.518 -2.158 351 HB2 LEU 49 HB2 LEU 49 -14.320 1.432 -4.170 352 HB3 LEU 49 HB3 LEU 49 -12.601 1.235 -3.919 353 HG LEU 49 HG LEU 49 -14.477 -0.957 -4.806 354 HD11 LEU 49 HD11 LEU 49 -12.438 0.644 -6.349 355 HD12 LEU 49 HD12 LEU 49 -14.192 0.772 -6.511 356 HD13 LEU 49 HD13 LEU 49 -13.372 -0.720 -6.970 357 HD21 LEU 49 HD21 LEU 49 -12.566 -1.795 -3.544 358 HD22 LEU 49 HD22 LEU 49 -11.469 -0.864 -4.565 359 HD23 LEU 49 HD23 LEU 49 -12.406 -2.190 -5.255 360 H ILE 50 H ILE 50 -11.715 0.508 -1.011 361 HA ILE 50 HA ILE 50 -12.230 3.308 -0.272 362 HB ILE 50 HB ILE 50 -10.282 1.351 0.968 363 HG12 ILE 50 HG12 ILE 50 -12.789 2.578 2.135 364 HG13 ILE 50 HG13 ILE 50 -12.712 0.957 1.458 365 HG21 ILE 50 HG21 ILE 50 -9.935 3.129 2.647 366 HG22 ILE 50 HG22 ILE 50 -10.955 4.206 1.690 367 HG23 ILE 50 HG23 ILE 50 -9.427 3.623 1.031 368 HD11 ILE 50 HD11 ILE 50 -11.080 0.324 3.155 369 HD12 ILE 50 HD12 ILE 50 -12.569 0.921 3.884 370 HD13 ILE 50 HD13 ILE 50 -11.143 1.955 3.825 371 HA PRO 51 HA PRO 51 -8.962 4.123 -3.213 372 HB2 PRO 51 HB2 PRO 51 -9.069 6.805 -3.066 373 HB3 PRO 51 HB3 PRO 51 -10.302 5.868 -3.919 374 HG2 PRO 51 HG2 PRO 51 -10.395 7.073 -1.184 375 HG3 PRO 51 HG3 PRO 51 -11.649 7.024 -2.429 376 HD2 PRO 51 HD2 PRO 51 -11.560 5.316 -0.294 377 HD3 PRO 51 HD3 PRO 51 -12.326 4.923 -1.846 378 H LEU 52 H LEU 52 -6.830 4.300 -2.909 379 HA LEU 52 HA LEU 52 -5.844 5.657 -0.502 380 HB2 LEU 52 HB2 LEU 52 -5.027 2.925 -1.484 381 HB3 LEU 52 HB3 LEU 52 -4.124 3.839 -0.286 382 HG LEU 52 HG LEU 52 -6.575 3.821 0.868 383 HD11 LEU 52 HD11 LEU 52 -6.337 1.210 -0.609 384 HD12 LEU 52 HD12 LEU 52 -7.569 2.448 -0.866 385 HD13 LEU 52 HD13 LEU 52 -7.503 1.570 0.664 386 HD21 LEU 52 HD21 LEU 52 -4.515 3.226 1.973 387 HD22 LEU 52 HD22 LEU 52 -4.445 1.705 1.084 388 HD23 LEU 52 HD23 LEU 52 -5.730 1.981 2.261 389 H THR 53 H THR 53 -4.229 6.998 -0.881 390 HA THR 53 HA THR 53 -2.899 6.879 -3.515 391 HB THR 53 HB THR 53 -3.009 9.267 -1.657 392 HG1 THR 53 HG1 THR 53 -5.065 8.204 -2.856 393 HG21 THR 53 HG21 THR 53 -1.270 9.323 -3.374 394 HG22 THR 53 HG22 THR 53 -2.525 10.518 -3.710 395 HG23 THR 53 HG23 THR 53 -2.483 9.009 -4.620 396 H ILE 54 H ILE 54 -0.862 6.195 -3.475 397 HA ILE 54 HA ILE 54 0.559 6.249 -0.899 398 HB ILE 54 HB ILE 54 1.028 4.425 -3.261 399 HG12 ILE 54 HG12 ILE 54 -0.326 3.941 -0.594 400 HG13 ILE 54 HG13 ILE 54 -1.085 3.895 -2.181 401 HG21 ILE 54 HG21 ILE 54 2.501 3.199 -1.726 402 HG22 ILE 54 HG22 ILE 54 2.238 4.437 -0.497 403 HG23 ILE 54 HG23 ILE 54 3.060 4.849 -2.003 404 HD11 ILE 54 HD11 ILE 54 1.036 2.001 -1.201 405 HD12 ILE 54 HD12 ILE 54 0.225 1.938 -2.763 406 HD13 ILE 54 HD13 ILE 54 -0.692 1.660 -1.283 407 H PHE 55 H PHE 55 2.280 7.454 -0.706 408 HA PHE 55 HA PHE 55 3.525 8.588 -3.122 409 HB2 PHE 55 HB2 PHE 55 3.370 9.644 -0.292 410 HB3 PHE 55 HB3 PHE 55 4.373 10.356 -1.547 411 HD1 PHE 55 HD1 PHE 55 0.872 9.603 -0.630 412 HD2 PHE 55 HD2 PHE 55 3.509 11.872 -3.074 413 HE1 PHE 55 HE1 PHE 55 -1.019 11.002 -1.362 414 HE2 PHE 55 HE2 PHE 55 1.629 13.278 -3.809 415 HZ PHE 55 HZ PHE 55 -0.640 12.843 -2.955 416 H VAL 56 H VAL 56 5.681 8.374 -3.441 417 HA VAL 56 HA VAL 56 7.089 6.504 -1.718 418 HB VAL 56 HB VAL 56 7.345 7.384 -4.516 419 HG11 VAL 56 HG11 VAL 56 9.485 8.241 -3.650 420 HG12 VAL 56 HG12 VAL 56 9.720 6.849 -4.706 421 HG13 VAL 56 HG13 VAL 56 9.831 6.655 -2.959 422 HG21 VAL 56 HG21 VAL 56 6.533 5.198 -3.891 423 HG22 VAL 56 HG22 VAL 56 8.019 4.875 -2.998 424 HG23 VAL 56 HG23 VAL 56 8.066 5.042 -4.757 425 H GLY 57 H GLY 57 8.855 6.945 -0.515 426 HA2 GLY 57 HA2 GLY 57 9.659 9.778 -0.338 427 HA3 GLY 57 HA3 GLY 57 9.760 8.617 0.977 428 H GLU 58 H GLU 58 12.027 9.595 0.965 429 HA GLU 58 HA GLU 58 13.703 8.222 -1.038 430 HB2 GLU 58 HB2 GLU 58 14.292 10.741 0.526 431 HB3 GLU 58 HB3 GLU 58 15.409 9.953 -0.578 432 HG2 GLU 58 HG2 GLU 58 13.766 10.315 -2.402 433 HG3 GLU 58 HG3 GLU 58 12.786 11.246 -1.269 434 H ASN 59 H ASN 59 14.135 6.331 -0.038 435 HA ASN 59 HA ASN 59 15.549 4.932 1.042 436 HB2 ASN 59 HB2 ASN 59 17.212 6.776 0.799 437 HB3 ASN 59 HB3 ASN 59 16.742 7.349 2.394 438 HD21 ASN 59 HD21 ASN 59 16.980 3.965 1.479 439 HD22 ASN 59 HD22 ASN 59 18.342 3.598 2.489 440 H THR 60 H THR 60 14.500 7.483 3.333 441 HA THR 60 HA THR 60 13.369 5.370 4.994 442 HB THR 60 HB THR 60 15.660 5.720 5.876 443 HG1 THR 60 HG1 THR 60 14.842 5.375 7.794 444 HG21 THR 60 HG21 THR 60 14.698 8.526 6.444 445 HG22 THR 60 HG22 THR 60 15.961 8.073 5.300 446 HG23 THR 60 HG23 THR 60 16.202 7.822 7.029 447 H GLY 61 H GLY 61 11.997 6.287 6.754 448 HA2 GLY 61 HA2 GLY 61 11.094 9.006 6.469 449 HA3 GLY 61 HA3 GLY 61 9.972 7.829 5.796 450 H VAL 62 H VAL 62 12.014 7.316 8.604 451 HA VAL 62 HA VAL 62 9.570 7.076 10.209 452 HB VAL 62 HB VAL 62 11.113 5.813 11.831 453 HG11 VAL 62 HG11 VAL 62 10.797 3.713 10.606 454 HG12 VAL 62 HG12 VAL 62 10.486 4.624 9.128 455 HG13 VAL 62 HG13 VAL 62 9.371 4.745 10.489 456 HG21 VAL 62 HG21 VAL 62 13.038 4.690 10.773 457 HG22 VAL 62 HG22 VAL 62 13.254 6.440 10.861 458 HG23 VAL 62 HG23 VAL 62 12.806 5.681 9.333 459 H1 GLY 1 H1 GLY 1 -16.606 15.119 2.431 460 H2 GLY 1 H2 GLY 1 -15.449 14.350 1.465 461 H3 GLY 1 H3 GLY 1 -16.786 15.099 0.749 462 HA2 GLY 1 HA2 GLY 1 -14.821 16.458 0.478 463 HA3 GLY 1 HA3 GLY 1 -16.029 17.259 1.472 464 H ALA 2 H ALA 2 -13.626 14.730 2.219 465 HA ALA 2 HA ALA 2 -12.812 16.289 4.546 466 HB1 ALA 2 HB1 ALA 2 -13.243 13.897 4.830 467 HB2 ALA 2 HB2 ALA 2 -11.566 14.297 5.202 468 HB3 ALA 2 HB3 ALA 2 -11.970 13.528 3.666 469 H MET 3 H MET 3 -11.043 17.490 4.612 470 HA MET 3 HA MET 3 -9.118 17.307 2.400 471 HB2 MET 3 HB2 MET 3 -9.610 19.475 4.451 472 HB3 MET 3 HB3 MET 3 -8.299 19.516 3.276 473 HG2 MET 3 HG2 MET 3 -9.926 19.498 1.456 474 HG3 MET 3 HG3 MET 3 -11.241 19.451 2.630 475 HE1 MET 3 HE1 MET 3 -11.884 21.465 4.224 476 HE2 MET 3 HE2 MET 3 -10.929 22.941 4.360 477 HE3 MET 3 HE3 MET 3 -10.253 21.402 4.892 478 H GLU 4 H GLU 4 -9.547 16.640 5.717 479 HA GLU 4 HA GLU 4 -6.694 15.957 5.940 480 HB2 GLU 4 HB2 GLU 4 -7.561 17.768 7.511 481 HB3 GLU 4 HB3 GLU 4 -8.561 16.533 8.254 482 HG2 GLU 4 HG2 GLU 4 -5.600 16.172 8.047 483 HG3 GLU 4 HG3 GLU 4 -6.300 17.162 9.324 484 H MET 5 H MET 5 -6.511 13.888 5.554 485 HA MET 5 HA MET 5 -8.590 12.042 6.535 486 HB2 MET 5 HB2 MET 5 -6.853 11.444 4.157 487 HB3 MET 5 HB3 MET 5 -8.427 10.780 4.569 488 HG2 MET 5 HG2 MET 5 -8.951 12.139 2.807 489 HG3 MET 5 HG3 MET 5 -9.257 13.211 4.166 490 HE1 MET 5 HE1 MET 5 -5.778 12.096 2.673 491 HE2 MET 5 HE2 MET 5 -5.488 13.390 1.509 492 HE3 MET 5 HE3 MET 5 -6.819 12.259 1.258 493 HA PRO 6 HA PRO 6 -5.580 9.892 8.844 494 HB2 PRO 6 HB2 PRO 6 -6.232 7.272 8.300 495 HB3 PRO 6 HB3 PRO 6 -7.102 8.306 9.438 496 HG2 PRO 6 HG2 PRO 6 -7.769 7.651 6.600 497 HG3 PRO 6 HG3 PRO 6 -8.839 7.746 8.011 498 HD2 PRO 6 HD2 PRO 6 -8.705 9.739 6.235 499 HD3 PRO 6 HD3 PRO 6 -8.895 10.063 7.971 500 H THR 7 H THR 7 -3.525 9.413 8.538 501 HA THR 7 HA THR 7 -2.686 8.598 5.832 502 HB THR 7 HB THR 7 -1.103 10.310 7.746 503 HG1 THR 7 HG1 THR 7 -3.266 10.985 6.343 504 HG21 THR 7 HG21 THR 7 0.195 10.867 5.744 505 HG22 THR 7 HG22 THR 7 -0.822 9.788 4.787 506 HG23 THR 7 HG23 THR 7 0.212 9.130 6.057 507 H PHE 8 H PHE 8 -1.279 6.942 5.665 508 HA PHE 8 HA PHE 8 -0.255 5.761 8.166 509 HB2 PHE 8 HB2 PHE 8 -0.944 4.409 5.547 510 HB3 PHE 8 HB3 PHE 8 -0.257 3.606 6.950 511 HD1 PHE 8 HD1 PHE 8 -3.230 5.378 5.673 512 HD2 PHE 8 HD2 PHE 8 -1.649 2.894 8.744 513 HE1 PHE 8 HE1 PHE 8 -5.510 4.959 6.502 514 HE2 PHE 8 HE2 PHE 8 -3.928 2.476 9.585 515 HZ PHE 8 HZ PHE 8 -5.860 3.506 8.461 516 H TYR 9 H TYR 9 1.904 5.102 8.222 517 HA TYR 9 HA TYR 9 3.503 5.717 5.831 518 HB2 TYR 9 HB2 TYR 9 3.535 7.373 7.938 519 HB3 TYR 9 HB3 TYR 9 4.703 6.193 8.519 520 HD1 TYR 9 HD1 TYR 9 6.277 5.463 6.243 521 HD2 TYR 9 HD2 TYR 9 4.612 9.258 7.206 522 HE1 TYR 9 HE1 TYR 9 8.023 6.562 4.908 523 HE2 TYR 9 HE2 TYR 9 6.350 10.367 5.869 524 HH TYR 9 HH TYR 9 8.283 8.768 3.678 525 H LEU 10 H LEU 10 4.659 4.020 5.213 526 HA LEU 10 HA LEU 10 5.703 2.186 7.226 527 HB2 LEU 10 HB2 LEU 10 5.037 0.270 5.643 528 HB3 LEU 10 HB3 LEU 10 3.823 0.945 6.708 529 HG LEU 10 HG LEU 10 3.169 2.400 4.663 530 HD11 LEU 10 HD11 LEU 10 3.570 1.329 2.511 531 HD12 LEU 10 HD12 LEU 10 4.615 0.144 3.292 532 HD13 LEU 10 HD13 LEU 10 5.078 1.845 3.262 533 HD21 LEU 10 HD21 LEU 10 1.739 0.717 5.629 534 HD22 LEU 10 HD22 LEU 10 2.625 -0.559 4.792 535 HD23 LEU 10 HD23 LEU 10 1.678 0.609 3.869 536 H ALA 11 H ALA 11 7.437 0.826 6.422 537 HA ALA 11 HA ALA 11 8.696 1.869 3.972 538 HB1 ALA 11 HB1 ALA 11 10.882 1.567 5.019 539 HB2 ALA 11 HB2 ALA 11 10.099 1.060 6.517 540 HB3 ALA 11 HB3 ALA 11 9.889 2.709 5.925 541 H LEU 12 H LEU 12 9.275 0.391 2.524 542 HA LEU 12 HA LEU 12 8.945 -2.439 3.293 543 HB2 LEU 12 HB2 LEU 12 8.231 -1.204 0.636 544 HB3 LEU 12 HB3 LEU 12 7.923 -2.848 1.149 545 HG LEU 12 HG LEU 12 6.622 -0.389 2.324 546 HD11 LEU 12 HD11 LEU 12 5.905 -0.821 0.033 547 HD12 LEU 12 HD12 LEU 12 4.613 -1.163 1.185 548 HD13 LEU 12 HD13 LEU 12 5.522 -2.490 0.459 549 HD21 LEU 12 HD21 LEU 12 6.832 -2.201 3.946 550 HD22 LEU 12 HD22 LEU 12 6.089 -3.320 2.802 551 HD23 LEU 12 HD23 LEU 12 5.152 -1.978 3.457 552 H HIS 13 H HIS 13 10.410 -3.891 2.479 553 HA HIS 13 HA HIS 13 12.885 -2.875 1.465 554 HB2 HIS 13 HB2 HIS 13 11.830 -5.665 1.890 555 HB3 HIS 13 HB3 HIS 13 13.405 -5.365 1.169 556 HD1 HIS 13 HD1 HIS 13 11.995 -6.162 4.298 557 HD2 HIS 13 HD2 HIS 13 14.939 -3.491 3.047 558 HE1 HIS 13 HE1 HIS 13 13.344 -5.614 6.354 559 HE2 HIS 13 HE2 HIS 13 15.014 -3.881 5.602 560 H GLY 14 H GLY 14 13.578 -2.671 -0.562 561 HA2 GLY 14 HA2 GLY 14 11.777 -2.687 -2.710 562 HA3 GLY 14 HA3 GLY 14 13.522 -2.561 -2.850 563 H GLY 15 H GLY 15 10.831 -4.408 -3.541 564 HA2 GLY 15 HA2 GLY 15 10.998 -6.168 -5.143 565 HA3 GLY 15 HA3 GLY 15 12.568 -6.583 -4.487 566 H GLN 16 H GLN 16 10.595 -6.013 -1.910 567 HA GLN 16 HA GLN 16 10.235 -8.889 -1.534 568 HB2 GLN 16 HB2 GLN 16 10.155 -6.573 0.397 569 HB3 GLN 16 HB3 GLN 16 9.760 -8.227 0.854 570 HG2 GLN 16 HG2 GLN 16 12.397 -7.225 -0.194 571 HG3 GLN 16 HG3 GLN 16 12.037 -7.742 1.453 572 HE21 GLN 16 HE21 GLN 16 14.008 -8.737 -0.484 573 HE22 GLN 16 HE22 GLN 16 13.685 -10.424 -0.655 574 H THR 17 H THR 17 8.301 -9.777 -0.791 575 HA THR 17 HA THR 17 5.943 -8.407 -1.863 576 HB THR 17 HB THR 17 6.054 -11.257 -0.846 577 HG1 THR 17 HG1 THR 17 7.540 -10.336 -2.788 578 HG21 THR 17 HG21 THR 17 4.346 -9.879 -2.928 579 HG22 THR 17 HG22 THR 17 3.838 -10.320 -1.297 580 HG23 THR 17 HG23 THR 17 4.237 -11.577 -2.467 581 H TYR 18 H TYR 18 4.302 -7.755 -0.632 582 HA TYR 18 HA TYR 18 4.290 -8.470 2.220 583 HB2 TYR 18 HB2 TYR 18 3.885 -5.754 0.967 584 HB3 TYR 18 HB3 TYR 18 3.436 -6.127 2.626 585 HD1 TYR 18 HD1 TYR 18 5.128 -6.486 4.323 586 HD2 TYR 18 HD2 TYR 18 6.219 -5.548 0.320 587 HE1 TYR 18 HE1 TYR 18 7.398 -5.957 5.085 588 HE2 TYR 18 HE2 TYR 18 8.500 -5.011 1.062 589 HH TYR 18 HH TYR 18 9.632 -5.730 4.259 590 H HIS 19 H HIS 19 2.304 -8.566 3.199 591 HA HIS 19 HA HIS 19 -0.009 -8.792 1.437 592 HB2 HIS 19 HB2 HIS 19 0.732 -9.795 4.128 593 HB3 HIS 19 HB3 HIS 19 -0.966 -9.431 3.876 594 HD1 HIS 19 HD1 HIS 19 1.129 -12.203 3.832 595 HD2 HIS 19 HD2 HIS 19 -1.674 -10.742 1.114 596 HE1 HIS 19 HE1 HIS 19 0.447 -14.175 2.433 597 HE2 HIS 19 HE2 HIS 19 -1.455 -13.325 1.017 598 H LEU 20 H LEU 20 -1.259 -7.130 1.164 599 HA LEU 20 HA LEU 20 -1.310 -5.001 3.184 600 HB2 LEU 20 HB2 LEU 20 -0.506 -4.032 1.214 601 HB3 LEU 20 HB3 LEU 20 -1.521 -5.039 0.199 602 HG LEU 20 HG LEU 20 -3.469 -3.700 0.772 603 HD11 LEU 20 HD11 LEU 20 -2.908 -3.103 3.043 604 HD12 LEU 20 HD12 LEU 20 -3.211 -1.646 2.092 605 HD13 LEU 20 HD13 LEU 20 -1.555 -2.118 2.475 606 HD21 LEU 20 HD21 LEU 20 -2.799 -1.618 -0.322 607 HD22 LEU 20 HD22 LEU 20 -2.097 -3.021 -1.124 608 HD23 LEU 20 HD23 LEU 20 -1.103 -2.028 -0.060 609 H ILE 21 H ILE 21 -3.078 -4.840 4.332 610 HA ILE 21 HA ILE 21 -5.648 -5.619 3.115 611 HB ILE 21 HB ILE 21 -4.878 -6.076 6.006 612 HG12 ILE 21 HG12 ILE 21 -5.414 -8.321 4.116 613 HG13 ILE 21 HG13 ILE 21 -3.847 -7.524 4.022 614 HG21 ILE 21 HG21 ILE 21 -6.972 -7.355 6.107 615 HG22 ILE 21 HG22 ILE 21 -7.314 -6.929 4.432 616 HG23 ILE 21 HG23 ILE 21 -7.265 -5.673 5.668 617 HD11 ILE 21 HD11 ILE 21 -3.396 -8.046 6.319 618 HD12 ILE 21 HD12 ILE 21 -3.838 -9.517 5.453 619 HD13 ILE 21 HD13 ILE 21 -5.009 -8.734 6.516 620 H VAL 22 H VAL 22 -7.054 -3.991 3.120 621 HA VAL 22 HA VAL 22 -6.832 -1.974 5.249 622 HB VAL 22 HB VAL 22 -6.402 -1.037 2.991 623 HG11 VAL 22 HG11 VAL 22 -7.811 -2.486 1.655 624 HG12 VAL 22 HG12 VAL 22 -8.277 -0.803 1.408 625 HG13 VAL 22 HG13 VAL 22 -9.253 -1.848 2.444 626 HG21 VAL 22 HG21 VAL 22 -8.929 -0.066 4.312 627 HG22 VAL 22 HG22 VAL 22 -7.950 0.857 3.172 628 HG23 VAL 22 HG23 VAL 22 -7.279 0.395 4.737 629 H ASP 23 H ASP 23 -8.599 -1.631 6.480 630 HA ASP 23 HA ASP 23 -11.183 -2.656 5.623 631 HB2 ASP 23 HB2 ASP 23 -11.520 -4.024 7.576 632 HB3 ASP 23 HB3 ASP 23 -10.037 -4.545 6.792 633 H THR 24 H THR 24 -12.856 -2.111 7.459 634 HA THR 24 HA THR 24 -12.129 0.557 8.459 635 HB THR 24 HB THR 24 -14.796 0.798 8.244 636 HG1 THR 24 HG1 THR 24 -13.972 -1.026 6.223 637 HG21 THR 24 HG21 THR 24 -13.158 2.371 7.362 638 HG22 THR 24 HG22 THR 24 -14.384 2.018 6.143 639 HG23 THR 24 HG23 THR 24 -12.792 1.269 6.030 640 H ASP 25 H ASP 25 -12.566 1.058 10.491 641 HA ASP 25 HA ASP 25 -13.532 -0.990 12.281 642 HB2 ASP 25 HB2 ASP 25 -11.716 0.285 13.103 643 HB3 ASP 25 HB3 ASP 25 -12.460 1.805 12.627 644 H SER 26 H SER 26 -15.232 -0.333 13.978 645 HA SER 26 HA SER 26 -17.673 0.031 12.716 646 HB2 SER 26 HB2 SER 26 -17.080 0.649 15.612 647 HB3 SER 26 HB3 SER 26 -18.623 0.140 14.924 648 HG SER 26 HG SER 26 -16.964 -1.448 15.970 649 H LEU 27 H LEU 27 -15.492 2.444 14.035 650 HA LEU 27 HA LEU 27 -17.413 4.561 14.140 651 HB2 LEU 27 HB2 LEU 27 -14.405 4.673 14.055 652 HB3 LEU 27 HB3 LEU 27 -15.454 6.014 14.463 653 HG LEU 27 HG LEU 27 -15.268 3.457 16.055 654 HD11 LEU 27 HD11 LEU 27 -13.967 4.751 17.653 655 HD12 LEU 27 HD12 LEU 27 -14.020 6.151 16.582 656 HD13 LEU 27 HD13 LEU 27 -13.155 4.696 16.087 657 HD21 LEU 27 HD21 LEU 27 -17.399 4.621 16.285 658 HD22 LEU 27 HD22 LEU 27 -16.550 6.121 16.659 659 HD23 LEU 27 HD23 LEU 27 -16.449 4.750 17.764 660 H GLY 28 H GLY 28 -15.627 3.116 11.612 661 HA2 GLY 28 HA2 GLY 28 -16.226 3.623 9.338 662 HA3 GLY 28 HA3 GLY 28 -16.464 5.298 9.816 663 H ASN 29 H ASN 29 -13.738 4.235 11.328 664 HA ASN 29 HA ASN 29 -12.023 5.597 9.435 665 HB2 ASN 29 HB2 ASN 29 -10.264 5.295 11.154 666 HB3 ASN 29 HB3 ASN 29 -11.695 6.108 11.774 667 HD21 ASN 29 HD21 ASN 29 -12.951 5.132 13.250 668 HD22 ASN 29 HD22 ASN 29 -12.516 3.663 14.054 669 HA PRO 30 HA PRO 30 -10.515 1.824 7.732 670 HB2 PRO 30 HB2 PRO 30 -8.532 2.892 6.217 671 HB3 PRO 30 HB3 PRO 30 -10.243 3.006 5.796 672 HG2 PRO 30 HG2 PRO 30 -8.422 5.086 6.793 673 HG3 PRO 30 HG3 PRO 30 -9.947 5.251 5.912 674 HD2 PRO 30 HD2 PRO 30 -9.490 5.565 8.713 675 HD3 PRO 30 HD3 PRO 30 -11.027 5.688 7.836 676 H SER 31 H SER 31 -8.784 0.426 7.828 677 HA SER 31 HA SER 31 -6.578 1.172 9.627 678 HB2 SER 31 HB2 SER 31 -8.279 -0.239 10.785 679 HB3 SER 31 HB3 SER 31 -8.069 -1.462 9.540 680 HG SER 31 HG SER 31 -6.329 -2.123 10.493 681 H LEU 32 H LEU 32 -4.588 0.072 9.162 682 HA LEU 32 HA LEU 32 -4.558 -1.231 6.532 683 HB2 LEU 32 HB2 LEU 32 -3.782 1.218 6.583 684 HB3 LEU 32 HB3 LEU 32 -2.373 0.616 7.437 685 HG LEU 32 HG LEU 32 -2.080 -0.981 5.448 686 HD11 LEU 32 HD11 LEU 32 -3.018 -0.165 3.338 687 HD12 LEU 32 HD12 LEU 32 -3.943 1.048 4.224 688 HD13 LEU 32 HD13 LEU 32 -4.276 -0.666 4.466 689 HD21 LEU 32 HD21 LEU 32 -0.860 0.706 4.187 690 HD22 LEU 32 HD22 LEU 32 -0.608 0.905 5.920 691 HD23 LEU 32 HD23 LEU 32 -1.705 1.984 5.058 692 H SER 33 H SER 33 -3.670 -3.141 6.595 693 HA SER 33 HA SER 33 -1.617 -3.678 8.636 694 HB2 SER 33 HB2 SER 33 -3.711 -5.583 7.551 695 HB3 SER 33 HB3 SER 33 -2.437 -6.011 8.698 696 HG SER 33 HG SER 33 -4.838 -4.932 9.195 697 H VAL 34 H VAL 34 0.305 -4.010 7.759 698 HA VAL 34 HA VAL 34 0.429 -5.347 5.135 699 HB VAL 34 HB VAL 34 2.193 -3.102 6.137 700 HG11 VAL 34 HG11 VAL 34 3.417 -3.313 4.028 701 HG12 VAL 34 HG12 VAL 34 2.463 -4.736 3.614 702 HG13 VAL 34 HG13 VAL 34 3.555 -4.781 4.996 703 HG21 VAL 34 HG21 VAL 34 0.041 -2.400 5.209 704 HG22 VAL 34 HG22 VAL 34 0.379 -3.307 3.734 705 HG23 VAL 34 HG23 VAL 34 1.378 -1.916 4.165 706 H ILE 35 H ILE 35 1.466 -7.201 5.162 707 HA ILE 35 HA ILE 35 3.371 -7.732 7.356 708 HB ILE 35 HB ILE 35 1.841 -9.989 6.168 709 HG12 ILE 35 HG12 ILE 35 0.697 -8.117 8.252 710 HG13 ILE 35 HG13 ILE 35 0.073 -8.352 6.629 711 HG21 ILE 35 HG21 ILE 35 2.832 -9.362 8.942 712 HG22 ILE 35 HG22 ILE 35 3.654 -10.365 7.748 713 HG23 ILE 35 HG23 ILE 35 2.109 -10.888 8.426 714 HD11 ILE 35 HD11 ILE 35 -1.276 -9.531 8.247 715 HD12 ILE 35 HD12 ILE 35 0.141 -10.415 8.816 716 HD13 ILE 35 HD13 ILE 35 -0.459 -10.672 7.178 717 HA PRO 36 HA PRO 36 6.129 -8.769 3.975 718 HB2 PRO 36 HB2 PRO 36 7.982 -10.083 5.509 719 HB3 PRO 36 HB3 PRO 36 7.910 -8.326 5.344 720 HG2 PRO 36 HG2 PRO 36 6.876 -10.071 7.543 721 HG3 PRO 36 HG3 PRO 36 7.703 -8.504 7.647 722 HD2 PRO 36 HD2 PRO 36 5.029 -8.735 7.914 723 HD3 PRO 36 HD3 PRO 36 5.780 -7.315 7.160 724 H SER 37 H SER 37 6.143 -10.474 2.633 725 HA SER 37 HA SER 37 4.778 -12.877 3.312 726 HB2 SER 37 HB2 SER 37 6.479 -12.215 0.900 727 HB3 SER 37 HB3 SER 37 5.425 -13.623 1.046 728 HG SER 37 HG SER 37 4.232 -11.203 1.606 729 H ASN 38 H ASN 38 8.082 -11.849 3.350 730 HA ASN 38 HA ASN 38 8.755 -14.372 4.689 731 HB2 ASN 38 HB2 ASN 38 10.432 -12.907 2.652 732 HB3 ASN 38 HB3 ASN 38 11.112 -14.074 3.775 733 HD21 ASN 38 HD21 ASN 38 9.220 -13.609 0.935 734 HD22 ASN 38 HD22 ASN 38 9.090 -15.277 0.491 735 HA PRO 39 HA PRO 39 9.558 -11.052 7.643 736 HB2 PRO 39 HB2 PRO 39 9.688 -12.695 9.812 737 HB3 PRO 39 HB3 PRO 39 8.167 -12.131 9.115 738 HG2 PRO 39 HG2 PRO 39 9.565 -14.751 8.744 739 HG3 PRO 39 HG3 PRO 39 7.837 -14.426 8.987 740 HD2 PRO 39 HD2 PRO 39 8.892 -14.942 6.545 741 HD3 PRO 39 HD3 PRO 39 7.507 -13.857 6.775 742 H TYR 40 H TYR 40 11.387 -13.895 6.927 743 HA TYR 40 HA TYR 40 13.600 -13.312 8.641 744 HB2 TYR 40 HB2 TYR 40 13.512 -15.137 6.233 745 HB3 TYR 40 HB3 TYR 40 14.713 -15.157 7.520 746 HD1 TYR 40 HD1 TYR 40 13.801 -15.575 9.924 747 HD2 TYR 40 HD2 TYR 40 11.670 -16.543 6.374 748 HE1 TYR 40 HE1 TYR 40 12.419 -17.166 11.194 749 HE2 TYR 40 HE2 TYR 40 10.285 -18.136 7.631 750 HH TYR 40 HH TYR 40 10.160 -18.218 10.995 751 H GLN 41 H GLN 41 12.734 -12.594 5.326 752 HA GLN 41 HA GLN 41 15.311 -11.608 4.583 753 HB2 GLN 41 HB2 GLN 41 12.607 -11.154 3.304 754 HB3 GLN 41 HB3 GLN 41 14.154 -10.723 2.585 755 HG2 GLN 41 HG2 GLN 41 14.784 -13.145 2.733 756 HG3 GLN 41 HG3 GLN 41 13.118 -13.477 3.199 757 HE21 GLN 41 HE21 GLN 41 15.247 -12.533 0.641 758 HE22 GLN 41 HE22 GLN 41 14.109 -12.713 -0.653 759 H GLU 42 H GLU 42 12.575 -10.344 6.235 760 HA GLU 42 HA GLU 42 13.170 -7.581 6.001 761 HB2 GLU 42 HB2 GLU 42 11.755 -9.084 8.217 762 HB3 GLU 42 HB3 GLU 42 11.761 -7.336 8.021 763 HG2 GLU 42 HG2 GLU 42 10.611 -9.325 6.079 764 HG3 GLU 42 HG3 GLU 42 9.696 -8.326 7.209 765 H GLN 43 H GLN 43 14.212 -10.156 8.127 766 HA GLN 43 HA GLN 43 15.720 -8.472 9.893 767 HB2 GLN 43 HB2 GLN 43 15.977 -11.450 9.450 768 HB3 GLN 43 HB3 GLN 43 16.539 -10.543 10.846 769 HG2 GLN 43 HG2 GLN 43 14.243 -10.027 11.449 770 HG3 GLN 43 HG3 GLN 43 13.668 -10.905 10.032 771 HE21 GLN 43 HE21 GLN 43 15.149 -11.160 13.160 772 HE22 GLN 43 HE22 GLN 43 14.864 -12.857 13.385 773 H LEU 44 H LEU 44 16.420 -10.598 7.177 774 HA LEU 44 HA LEU 44 19.232 -9.824 7.185 775 HB2 LEU 44 HB2 LEU 44 17.742 -11.711 5.354 776 HB3 LEU 44 HB3 LEU 44 19.484 -11.539 5.475 777 HG LEU 44 HG LEU 44 17.714 -12.517 7.716 778 HD11 LEU 44 HD11 LEU 44 18.611 -14.726 7.217 779 HD12 LEU 44 HD12 LEU 44 19.469 -14.072 5.821 780 HD13 LEU 44 HD13 LEU 44 17.706 -14.079 5.851 781 HD21 LEU 44 HD21 LEU 44 19.834 -13.215 8.725 782 HD22 LEU 44 HD22 LEU 44 19.763 -11.470 8.491 783 HD23 LEU 44 HD23 LEU 44 20.710 -12.471 7.391 784 H SER 45 H SER 45 18.440 -7.578 6.730 785 HA SER 45 HA SER 45 17.188 -7.086 4.206 786 HB2 SER 45 HB2 SER 45 17.523 -4.661 4.881 787 HB3 SER 45 HB3 SER 45 16.536 -5.646 5.962 788 HG SER 45 HG SER 45 18.629 -4.235 6.616 789 H ASP 46 H ASP 46 18.892 -8.115 2.893 790 HA ASP 46 HA ASP 46 21.179 -6.449 2.302 791 HB2 ASP 46 HB2 ASP 46 19.899 -8.777 0.859 792 HB3 ASP 46 HB3 ASP 46 21.261 -7.885 0.189 793 H THR 47 H THR 47 17.939 -6.251 1.886 794 HA THR 47 HA THR 47 18.067 -4.596 -0.524 795 HB THR 47 HB THR 47 15.503 -4.646 -0.177 796 HG1 THR 47 HG1 THR 47 15.996 -7.069 1.171 797 HG21 THR 47 HG21 THR 47 16.969 -7.187 -0.900 798 HG22 THR 47 HG22 THR 47 16.667 -5.828 -1.984 799 HG23 THR 47 HG23 THR 47 15.317 -6.779 -1.364 800 HA PRO 48 HA PRO 48 17.650 -1.002 2.109 801 HB2 PRO 48 HB2 PRO 48 17.100 0.802 0.176 802 HB3 PRO 48 HB3 PRO 48 18.725 0.149 0.423 803 HG2 PRO 48 HG2 PRO 48 16.661 -0.618 -1.604 804 HG3 PRO 48 HG3 PRO 48 18.410 -0.412 -1.808 805 HD2 PRO 48 HD2 PRO 48 17.210 -2.844 -1.524 806 HD3 PRO 48 HD3 PRO 48 18.875 -2.511 -1.007 807 H LEU 49 H LEU 49 15.984 0.380 2.857 808 HA LEU 49 HA LEU 49 13.305 -0.602 2.306 809 HB2 LEU 49 HB2 LEU 49 14.417 1.332 4.319 810 HB3 LEU 49 HB3 LEU 49 12.696 1.145 4.076 811 HG LEU 49 HG LEU 49 14.564 -1.059 4.949 812 HD11 LEU 49 HD11 LEU 49 12.537 0.546 6.502 813 HD12 LEU 49 HD12 LEU 49 14.291 0.674 6.651 814 HD13 LEU 49 HD13 LEU 49 13.474 -0.819 7.118 815 HD21 LEU 49 HD21 LEU 49 12.642 -1.885 3.693 816 HD22 LEU 49 HD22 LEU 49 11.555 -0.955 4.724 817 HD23 LEU 49 HD23 LEU 49 12.492 -2.287 5.402 818 H ILE 50 H ILE 50 11.798 0.436 1.173 819 HA ILE 50 HA ILE 50 12.316 3.236 0.439 820 HB ILE 50 HB ILE 50 10.351 1.291 -0.801 821 HG12 ILE 50 HG12 ILE 50 12.866 2.499 -1.975 822 HG13 ILE 50 HG13 ILE 50 12.777 0.878 -1.299 823 HG21 ILE 50 HG21 ILE 50 10.008 3.076 -2.475 824 HG22 ILE 50 HG22 ILE 50 11.038 4.145 -1.515 825 HG23 ILE 50 HG23 ILE 50 9.510 3.566 -0.855 826 HD11 ILE 50 HD11 ILE 50 11.142 0.259 -2.993 827 HD12 ILE 50 HD12 ILE 50 12.632 0.852 -3.725 828 HD13 ILE 50 HD13 ILE 50 11.207 1.889 -3.658 829 HA PRO 51 HA PRO 51 9.063 4.053 3.403 830 HB2 PRO 51 HB2 PRO 51 9.185 6.739 3.256 831 HB3 PRO 51 HB3 PRO 51 10.414 5.793 4.104 832 HG2 PRO 51 HG2 PRO 51 10.508 7.000 1.369 833 HG3 PRO 51 HG3 PRO 51 11.765 6.937 2.610 834 HD2 PRO 51 HD2 PRO 51 11.655 5.236 0.471 835 HD3 PRO 51 HD3 PRO 51 12.425 4.836 2.018 836 H LEU 52 H LEU 52 6.934 4.229 3.100 837 HA LEU 52 HA LEU 52 5.946 5.604 0.702 838 HB2 LEU 52 HB2 LEU 52 5.115 2.874 1.680 839 HB3 LEU 52 HB3 LEU 52 4.212 3.797 0.490 840 HG LEU 52 HG LEU 52 6.657 3.768 -0.680 841 HD11 LEU 52 HD11 LEU 52 6.416 1.158 0.797 842 HD12 LEU 52 HD12 LEU 52 7.653 2.390 1.047 843 HD13 LEU 52 HD13 LEU 52 7.574 1.515 -0.483 844 HD21 LEU 52 HD21 LEU 52 4.581 3.182 -1.770 845 HD22 LEU 52 HD22 LEU 52 4.519 1.656 -0.886 846 HD23 LEU 52 HD23 LEU 52 5.791 1.938 -2.074 847 H THR 53 H THR 53 4.336 6.953 1.087 848 HA THR 53 HA THR 53 3.013 6.835 3.724 849 HB THR 53 HB THR 53 3.125 9.224 1.871 850 HG1 THR 53 HG1 THR 53 5.170 8.141 3.065 851 HG21 THR 53 HG21 THR 53 1.391 9.279 3.606 852 HG22 THR 53 HG22 THR 53 2.650 10.475 3.930 853 HG23 THR 53 HG23 THR 53 2.613 8.965 4.842 854 H ILE 54 H ILE 54 0.980 6.157 3.698 855 HA ILE 54 HA ILE 54 -0.451 6.224 1.132 856 HB ILE 54 HB ILE 54 -0.925 4.393 3.489 857 HG12 ILE 54 HG12 ILE 54 0.416 3.916 0.815 858 HG13 ILE 54 HG13 ILE 54 1.183 3.860 2.398 859 HG21 ILE 54 HG21 ILE 54 -2.404 3.180 1.949 860 HG22 ILE 54 HG22 ILE 54 -2.134 4.424 0.726 861 HG23 ILE 54 HG23 ILE 54 -2.958 4.832 2.232 862 HD11 ILE 54 HD11 ILE 54 -0.952 1.982 1.419 863 HD12 ILE 54 HD12 ILE 54 -0.140 1.909 2.982 864 HD13 ILE 54 HD13 ILE 54 0.773 1.631 1.498 865 H PHE 55 H PHE 55 -2.168 7.433 0.940 866 HA PHE 55 HA PHE 55 -3.402 8.565 3.364 867 HB2 PHE 55 HB2 PHE 55 -3.256 9.636 0.541 868 HB3 PHE 55 HB3 PHE 55 -4.253 10.344 1.804 869 HD1 PHE 55 HD1 PHE 55 -0.753 9.581 0.872 870 HD2 PHE 55 HD2 PHE 55 -3.373 11.857 3.338 871 HE1 PHE 55 HE1 PHE 55 1.142 10.971 1.601 872 HE2 PHE 55 HE2 PHE 55 -1.481 13.251 4.065 873 HZ PHE 55 HZ PHE 55 0.776 12.806 3.200 874 H VAL 56 H VAL 56 -5.559 8.365 3.695 875 HA VAL 56 HA VAL 56 -6.978 6.505 1.973 876 HB VAL 56 HB VAL 56 -7.221 7.377 4.774 877 HG11 VAL 56 HG11 VAL 56 -9.360 8.245 3.925 878 HG12 VAL 56 HG12 VAL 56 -9.591 6.853 4.977 879 HG13 VAL 56 HG13 VAL 56 -9.717 6.663 3.228 880 HG21 VAL 56 HG21 VAL 56 -6.429 5.183 4.147 881 HG22 VAL 56 HG22 VAL 56 -7.924 4.877 3.260 882 HG23 VAL 56 HG23 VAL 56 -7.958 5.045 5.018 883 H GLY 57 H GLY 57 -8.745 6.960 0.785 884 HA2 GLY 57 HA2 GLY 57 -9.543 9.793 0.610 885 HA3 GLY 57 HA3 GLY 57 -9.652 8.631 -0.701 886 H GLU 58 H GLU 58 -11.912 9.639 -0.665 887 HA GLU 58 HA GLU 58 -13.583 8.261 1.328 888 HB2 GLU 58 HB2 GLU 58 -14.168 10.779 -0.229 889 HB3 GLU 58 HB3 GLU 58 -15.289 9.993 0.873 890 HG2 GLU 58 HG2 GLU 58 -13.648 10.350 2.702 891 HG3 GLU 58 HG3 GLU 58 -12.656 11.268 1.571 892 H ASN 59 H ASN 59 -14.039 6.369 0.331 893 HA ASN 59 HA ASN 59 -15.463 4.983 -0.754 894 HB2 ASN 59 HB2 ASN 59 -17.109 6.836 -0.493 895 HB3 ASN 59 HB3 ASN 59 -16.644 7.418 -2.088 896 HD21 ASN 59 HD21 ASN 59 -16.906 4.032 -1.181 897 HD22 ASN 59 HD22 ASN 59 -18.267 3.677 -2.190 898 H THR 60 H THR 60 -14.402 7.534 -3.041 899 HA THR 60 HA THR 60 -13.291 5.418 -4.710 900 HB THR 60 HB THR 60 -15.585 5.779 -5.581 901 HG1 THR 60 HG1 THR 60 -14.799 5.466 -7.523 902 HG21 THR 60 HG21 THR 60 -14.614 8.584 -6.141 903 HG22 THR 60 HG22 THR 60 -15.879 8.129 -4.998 904 HG23 THR 60 HG23 THR 60 -16.123 7.885 -6.729 905 H GLY 61 H GLY 61 -11.934 6.343 -6.479 906 HA2 GLY 61 HA2 GLY 61 -11.011 9.049 -6.176 907 HA3 GLY 61 HA3 GLY 61 -9.894 7.862 -5.515 908 H VAL 62 H VAL 62 -11.947 7.380 -8.327 909 HA VAL 62 HA VAL 62 -9.506 7.129 -9.939 910 HB VAL 62 HB VAL 62 -11.058 5.869 -11.557 911 HG11 VAL 62 HG11 VAL 62 -10.754 3.767 -10.335 912 HG12 VAL 62 HG12 VAL 62 -10.429 4.675 -8.859 913 HG13 VAL 62 HG13 VAL 62 -9.322 4.791 -10.227 914 HG21 VAL 62 HG21 VAL 62 -12.988 4.758 -10.500 915 HG22 VAL 62 HG22 VAL 62 -13.193 6.509 -10.575 916 HG23 VAL 62 HG23 VAL 62 -12.743 5.739 -9.054 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 10.547 20.549 0.566 2 H2 GLY 1 H2 GLY 1 10.367 19.351 -0.624 3 H3 GLY 1 H3 GLY 1 10.487 20.980 -1.073 4 HA2 GLY 1 HA2 GLY 1 12.749 21.077 -0.240 5 HA3 GLY 1 HA3 GLY 1 12.625 19.383 0.218 6 H ALA 2 H ALA 2 14.625 19.529 -1.263 7 HA ALA 2 HA ALA 2 14.013 19.584 -4.101 8 HB1 ALA 2 HB1 ALA 2 16.603 18.927 -2.696 9 HB2 ALA 2 HB2 ALA 2 16.129 20.522 -3.274 10 HB3 ALA 2 HB3 ALA 2 16.397 19.213 -4.423 11 H MET 3 H MET 3 12.429 17.744 -3.225 12 HA MET 3 HA MET 3 13.388 15.304 -4.384 13 HB2 MET 3 HB2 MET 3 14.260 15.013 -2.120 14 HB3 MET 3 HB3 MET 3 12.676 15.362 -1.442 15 HG2 MET 3 HG2 MET 3 11.780 13.350 -2.507 16 HG3 MET 3 HG3 MET 3 13.376 12.999 -3.167 17 HE1 MET 3 HE1 MET 3 12.610 14.496 0.405 18 HE2 MET 3 HE2 MET 3 12.422 13.018 1.350 19 HE3 MET 3 HE3 MET 3 11.249 13.412 0.096 20 H GLU 4 H GLU 4 11.740 14.980 -5.714 21 HA GLU 4 HA GLU 4 9.027 15.602 -4.923 22 HB2 GLU 4 HB2 GLU 4 8.454 14.850 -7.223 23 HB3 GLU 4 HB3 GLU 4 9.657 16.130 -7.189 24 HG2 GLU 4 HG2 GLU 4 11.412 14.373 -7.452 25 HG3 GLU 4 HG3 GLU 4 10.114 13.206 -7.702 26 H MET 5 H MET 5 7.367 14.099 -4.664 27 HA MET 5 HA MET 5 8.337 11.391 -4.047 28 HB2 MET 5 HB2 MET 5 5.909 12.796 -2.948 29 HB3 MET 5 HB3 MET 5 6.486 11.215 -2.469 30 HG2 MET 5 HG2 MET 5 8.510 12.203 -1.566 31 HG3 MET 5 HG3 MET 5 7.974 13.800 -2.079 32 HE1 MET 5 HE1 MET 5 5.863 10.860 -0.479 33 HE2 MET 5 HE2 MET 5 5.949 11.293 1.229 34 HE3 MET 5 HE3 MET 5 7.410 10.807 0.368 35 HA PRO 6 HA PRO 6 5.973 10.063 -7.652 36 HB2 PRO 6 HB2 PRO 6 6.558 7.536 -6.173 37 HB3 PRO 6 HB3 PRO 6 6.691 7.892 -7.896 38 HG2 PRO 6 HG2 PRO 6 8.877 7.815 -6.396 39 HG3 PRO 6 HG3 PRO 6 8.688 9.089 -7.617 40 HD2 PRO 6 HD2 PRO 6 8.354 9.253 -4.643 41 HD3 PRO 6 HD3 PRO 6 9.033 10.444 -5.771 42 H THR 7 H THR 7 3.852 9.572 -7.871 43 HA THR 7 HA THR 7 2.446 8.903 -5.394 44 HB THR 7 HB THR 7 1.195 10.403 -7.674 45 HG1 THR 7 HG1 THR 7 3.102 11.278 -5.930 46 HG21 THR 7 HG21 THR 7 0.556 10.241 -4.730 47 HG22 THR 7 HG22 THR 7 -0.325 9.435 -6.029 48 HG23 THR 7 HG23 THR 7 -0.328 11.196 -5.920 49 H PHE 8 H PHE 8 1.198 7.156 -5.376 50 HA PHE 8 HA PHE 8 0.378 5.967 -7.951 51 HB2 PHE 8 HB2 PHE 8 1.071 4.560 -5.359 52 HB3 PHE 8 HB3 PHE 8 0.427 3.773 -6.789 53 HD1 PHE 8 HD1 PHE 8 3.340 5.511 -5.371 54 HD2 PHE 8 HD2 PHE 8 1.834 3.248 -8.643 55 HE1 PHE 8 HE1 PHE 8 5.638 5.159 -6.181 56 HE2 PHE 8 HE2 PHE 8 4.129 2.897 -9.464 57 HZ PHE 8 HZ PHE 8 6.037 3.849 -8.230 58 H TYR 9 H TYR 9 -1.768 5.332 -8.120 59 HA TYR 9 HA TYR 9 -3.447 5.844 -5.754 60 HB2 TYR 9 HB2 TYR 9 -3.471 7.442 -7.928 61 HB3 TYR 9 HB3 TYR 9 -4.637 6.231 -8.449 62 HD1 TYR 9 HD1 TYR 9 -6.445 5.636 -6.534 63 HD2 TYR 9 HD2 TYR 9 -4.295 9.292 -6.855 64 HE1 TYR 9 HE1 TYR 9 -8.188 6.771 -5.221 65 HE2 TYR 9 HE2 TYR 9 -6.029 10.436 -5.549 66 HH TYR 9 HH TYR 9 -8.371 8.798 -3.772 67 H LEU 10 H LEU 10 -4.587 4.133 -5.136 68 HA LEU 10 HA LEU 10 -5.543 2.247 -7.141 69 HB2 LEU 10 HB2 LEU 10 -4.862 0.363 -5.522 70 HB3 LEU 10 HB3 LEU 10 -3.654 1.049 -6.588 71 HG LEU 10 HG LEU 10 -3.036 2.541 -4.563 72 HD11 LEU 10 HD11 LEU 10 -4.967 1.979 -3.180 73 HD12 LEU 10 HD12 LEU 10 -3.455 1.531 -2.390 74 HD13 LEU 10 HD13 LEU 10 -4.455 0.291 -3.148 75 HD21 LEU 10 HD21 LEU 10 -1.516 0.809 -3.734 76 HD22 LEU 10 HD22 LEU 10 -1.592 0.834 -5.495 77 HD23 LEU 10 HD23 LEU 10 -2.452 -0.413 -4.592 78 H ALA 11 H ALA 11 -7.271 0.885 -6.403 79 HA ALA 11 HA ALA 11 -8.628 1.896 -3.991 80 HB1 ALA 11 HB1 ALA 11 -9.896 0.849 -6.515 81 HB2 ALA 11 HB2 ALA 11 -9.801 2.541 -6.034 82 HB3 ALA 11 HB3 ALA 11 -10.751 1.405 -5.079 83 H LEU 12 H LEU 12 -9.087 0.477 -2.465 84 HA LEU 12 HA LEU 12 -8.649 -2.378 -3.081 85 HB2 LEU 12 HB2 LEU 12 -8.048 -0.955 -0.488 86 HB3 LEU 12 HB3 LEU 12 -7.709 -2.632 -0.858 87 HG LEU 12 HG LEU 12 -6.395 -0.243 -2.147 88 HD11 LEU 12 HD11 LEU 12 -5.726 -0.590 0.175 89 HD12 LEU 12 HD12 LEU 12 -4.411 -0.967 -0.937 90 HD13 LEU 12 HD13 LEU 12 -5.333 -2.272 -0.187 91 HD21 LEU 12 HD21 LEU 12 -4.908 -1.880 -3.191 92 HD22 LEU 12 HD22 LEU 12 -6.580 -2.115 -3.699 93 HD23 LEU 12 HD23 LEU 12 -5.865 -3.193 -2.499 94 H HIS 13 H HIS 13 -10.095 -3.844 -2.221 95 HA HIS 13 HA HIS 13 -12.633 -2.845 -1.379 96 HB2 HIS 13 HB2 HIS 13 -11.502 -5.651 -1.460 97 HB3 HIS 13 HB3 HIS 13 -13.142 -5.293 -0.937 98 HD1 HIS 13 HD1 HIS 13 -14.778 -4.327 -2.786 99 HD2 HIS 13 HD2 HIS 13 -11.134 -5.764 -4.179 100 HE1 HIS 13 HE1 HIS 13 -15.045 -4.561 -5.274 101 HE2 HIS 13 HE2 HIS 13 -12.789 -5.298 -6.115 102 H GLY 14 H GLY 14 -13.349 -2.409 0.596 103 HA2 GLY 14 HA2 GLY 14 -11.567 -2.226 2.765 104 HA3 GLY 14 HA3 GLY 14 -13.307 -2.016 2.854 105 H GLY 15 H GLY 15 -10.666 -3.984 3.623 106 HA2 GLY 15 HA2 GLY 15 -10.896 -5.569 5.415 107 HA3 GLY 15 HA3 GLY 15 -12.494 -5.964 4.812 108 H GLN 16 H GLN 16 -10.228 -5.627 2.323 109 HA GLN 16 HA GLN 16 -9.989 -8.554 2.164 110 HB2 GLN 16 HB2 GLN 16 -10.181 -6.443 0.040 111 HB3 GLN 16 HB3 GLN 16 -9.510 -8.030 -0.315 112 HG2 GLN 16 HG2 GLN 16 -12.280 -7.418 0.685 113 HG3 GLN 16 HG3 GLN 16 -11.826 -7.998 -0.920 114 HE21 GLN 16 HE21 GLN 16 -12.321 -8.837 2.399 115 HE22 GLN 16 HE22 GLN 16 -12.211 -10.555 2.201 116 H THR 17 H THR 17 -8.068 -9.456 1.295 117 HA THR 17 HA THR 17 -5.693 -7.998 2.199 118 HB THR 17 HB THR 17 -5.839 -10.907 1.383 119 HG1 THR 17 HG1 THR 17 -6.974 -9.664 3.537 120 HG21 THR 17 HG21 THR 17 -3.996 -9.372 3.227 121 HG22 THR 17 HG22 THR 17 -3.597 -9.979 1.621 122 HG23 THR 17 HG23 THR 17 -3.929 -11.109 2.935 123 H TYR 18 H TYR 18 -4.076 -7.452 0.878 124 HA TYR 18 HA TYR 18 -4.157 -8.301 -1.934 125 HB2 TYR 18 HB2 TYR 18 -3.812 -5.523 -0.818 126 HB3 TYR 18 HB3 TYR 18 -3.286 -5.951 -2.442 127 HD1 TYR 18 HD1 TYR 18 -4.890 -6.461 -4.178 128 HD2 TYR 18 HD2 TYR 18 -6.184 -5.363 -0.277 129 HE1 TYR 18 HE1 TYR 18 -7.151 -6.071 -5.048 130 HE2 TYR 18 HE2 TYR 18 -8.454 -4.968 -1.137 131 HH TYR 18 HH TYR 18 -9.479 -6.028 -4.186 132 H HIS 19 H HIS 19 -2.191 -8.366 -2.998 133 HA HIS 19 HA HIS 19 0.160 -8.600 -1.287 134 HB2 HIS 19 HB2 HIS 19 -0.612 -9.492 -4.027 135 HB3 HIS 19 HB3 HIS 19 1.092 -9.249 -3.702 136 HD1 HIS 19 HD1 HIS 19 -0.945 -11.935 -4.043 137 HD2 HIS 19 HD2 HIS 19 1.387 -10.682 -0.827 138 HE1 HIS 19 HE1 HIS 19 -0.506 -13.996 -2.679 139 HE2 HIS 19 HE2 HIS 19 1.132 -13.261 -0.918 140 H LEU 20 H LEU 20 1.418 -6.924 -1.046 141 HA LEU 20 HA LEU 20 1.368 -4.761 -3.030 142 HB2 LEU 20 HB2 LEU 20 0.522 -3.898 -1.019 143 HB3 LEU 20 HB3 LEU 20 1.642 -4.825 -0.043 144 HG LEU 20 HG LEU 20 3.472 -3.350 -0.697 145 HD11 LEU 20 HD11 LEU 20 3.005 -1.301 -1.963 146 HD12 LEU 20 HD12 LEU 20 1.364 -1.877 -2.265 147 HD13 LEU 20 HD13 LEU 20 2.747 -2.759 -2.921 148 HD21 LEU 20 HD21 LEU 20 2.720 -1.341 0.474 149 HD22 LEU 20 HD22 LEU 20 2.158 -2.802 1.282 150 HD23 LEU 20 HD23 LEU 20 1.044 -1.858 0.294 151 H ILE 21 H ILE 21 3.137 -4.459 -4.155 152 HA ILE 21 HA ILE 21 5.732 -5.230 -3.000 153 HB ILE 21 HB ILE 21 4.916 -5.637 -5.884 154 HG12 ILE 21 HG12 ILE 21 5.525 -7.890 -4.016 155 HG13 ILE 21 HG13 ILE 21 3.932 -7.144 -3.948 156 HG21 ILE 21 HG21 ILE 21 7.298 -5.197 -5.595 157 HG22 ILE 21 HG22 ILE 21 7.024 -6.875 -6.061 158 HG23 ILE 21 HG23 ILE 21 7.398 -6.476 -4.386 159 HD11 ILE 21 HD11 ILE 21 3.539 -7.674 -6.258 160 HD12 ILE 21 HD12 ILE 21 4.007 -9.135 -5.383 161 HD13 ILE 21 HD13 ILE 21 5.174 -8.314 -6.423 162 H VAL 22 H VAL 22 7.105 -3.562 -2.975 163 HA VAL 22 HA VAL 22 6.854 -1.541 -5.103 164 HB VAL 22 HB VAL 22 6.445 -0.577 -2.867 165 HG11 VAL 22 HG11 VAL 22 7.789 -2.034 -1.495 166 HG12 VAL 22 HG12 VAL 22 8.316 -0.364 -1.274 167 HG13 VAL 22 HG13 VAL 22 9.261 -1.462 -2.281 168 HG21 VAL 22 HG21 VAL 22 7.381 0.829 -4.606 169 HG22 VAL 22 HG22 VAL 22 9.011 0.331 -4.156 170 HG23 VAL 22 HG23 VAL 22 8.037 1.281 -3.034 171 H ASP 23 H ASP 23 8.530 -1.352 -6.447 172 HA ASP 23 HA ASP 23 11.126 -2.481 -5.669 173 HB2 ASP 23 HB2 ASP 23 10.018 -4.284 -6.827 174 HB3 ASP 23 HB3 ASP 23 9.535 -3.209 -8.129 175 H THR 24 H THR 24 12.900 -1.639 -6.877 176 HA THR 24 HA THR 24 12.247 0.899 -8.218 177 HB THR 24 HB THR 24 14.745 1.389 -7.750 178 HG1 THR 24 HG1 THR 24 14.462 -1.027 -6.549 179 HG21 THR 24 HG21 THR 24 12.746 1.278 -5.492 180 HG22 THR 24 HG22 THR 24 12.903 2.572 -6.684 181 HG23 THR 24 HG23 THR 24 14.201 2.273 -5.529 182 H ASP 25 H ASP 25 12.912 1.294 -10.236 183 HA ASP 25 HA ASP 25 13.915 -0.928 -11.778 184 HB2 ASP 25 HB2 ASP 25 13.179 0.202 -13.647 185 HB3 ASP 25 HB3 ASP 25 12.130 0.917 -12.429 186 H SER 26 H SER 26 15.510 0.087 -13.697 187 HA SER 26 HA SER 26 18.016 0.190 -12.416 188 HB2 SER 26 HB2 SER 26 17.376 0.965 -15.267 189 HB3 SER 26 HB3 SER 26 18.932 0.419 -14.639 190 HG SER 26 HG SER 26 17.119 -1.407 -13.985 191 H LEU 27 H LEU 27 15.848 2.711 -13.547 192 HA LEU 27 HA LEU 27 17.853 4.784 -13.415 193 HB2 LEU 27 HB2 LEU 27 14.858 5.100 -13.545 194 HB3 LEU 27 HB3 LEU 27 16.066 6.303 -13.951 195 HG LEU 27 HG LEU 27 15.601 3.740 -15.477 196 HD11 LEU 27 HD11 LEU 27 14.587 5.147 -17.171 197 HD12 LEU 27 HD12 LEU 27 14.830 6.571 -16.157 198 HD13 LEU 27 HD13 LEU 27 13.720 5.299 -15.640 199 HD21 LEU 27 HD21 LEU 27 17.047 4.769 -17.167 200 HD22 LEU 27 HD22 LEU 27 17.899 4.523 -15.643 201 HD23 LEU 27 HD23 LEU 27 17.335 6.134 -16.087 202 H GLY 28 H GLY 28 15.552 3.355 -11.246 203 HA2 GLY 28 HA2 GLY 28 15.990 3.614 -8.869 204 HA3 GLY 28 HA3 GLY 28 16.409 5.290 -9.189 205 H ASN 29 H ASN 29 13.699 4.078 -10.891 206 HA ASN 29 HA ASN 29 11.913 5.747 -9.265 207 HB2 ASN 29 HB2 ASN 29 11.366 4.298 -11.875 208 HB3 ASN 29 HB3 ASN 29 10.317 5.476 -11.101 209 HD21 ASN 29 HD21 ASN 29 13.154 4.959 -12.978 210 HD22 ASN 29 HD22 ASN 29 13.422 6.619 -13.406 211 HA PRO 30 HA PRO 30 10.244 2.162 -7.304 212 HB2 PRO 30 HB2 PRO 30 8.149 3.356 -6.104 213 HB3 PRO 30 HB3 PRO 30 9.812 3.594 -5.552 214 HG2 PRO 30 HG2 PRO 30 8.116 5.365 -7.275 215 HG3 PRO 30 HG3 PRO 30 9.179 5.805 -5.926 216 HD2 PRO 30 HD2 PRO 30 9.909 6.052 -8.532 217 HD3 PRO 30 HD3 PRO 30 11.066 5.738 -7.223 218 H SER 31 H SER 31 8.736 0.698 -7.753 219 HA SER 31 HA SER 31 6.520 1.429 -9.541 220 HB2 SER 31 HB2 SER 31 8.378 0.204 -10.722 221 HB3 SER 31 HB3 SER 31 8.103 -1.147 -9.630 222 HG SER 31 HG SER 31 6.699 -1.748 -11.068 223 H LEU 32 H LEU 32 4.561 0.422 -9.051 224 HA LEU 32 HA LEU 32 4.594 -1.012 -6.477 225 HB2 LEU 32 HB2 LEU 32 3.739 1.420 -6.545 226 HB3 LEU 32 HB3 LEU 32 2.342 0.759 -7.374 227 HG LEU 32 HG LEU 32 2.059 -0.795 -5.385 228 HD11 LEU 32 HD11 LEU 32 4.021 1.152 -4.180 229 HD12 LEU 32 HD12 LEU 32 4.296 -0.567 -4.464 230 HD13 LEU 32 HD13 LEU 32 3.085 -0.048 -3.291 231 HD21 LEU 32 HD21 LEU 32 0.670 1.193 -5.805 232 HD22 LEU 32 HD22 LEU 32 1.812 2.165 -4.879 233 HD23 LEU 32 HD23 LEU 32 0.904 0.878 -4.088 234 H SER 33 H SER 33 3.639 -2.909 -6.451 235 HA SER 33 HA SER 33 1.644 -3.530 -8.529 236 HB2 SER 33 HB2 SER 33 3.718 -5.417 -7.377 237 HB3 SER 33 HB3 SER 33 2.510 -5.822 -8.598 238 HG SER 33 HG SER 33 3.508 -4.395 -10.018 239 H VAL 34 H VAL 34 -0.281 -3.887 -7.646 240 HA VAL 34 HA VAL 34 -0.370 -5.205 -5.012 241 HB VAL 34 HB VAL 34 -2.185 -3.021 -6.047 242 HG11 VAL 34 HG11 VAL 34 -2.437 -4.655 -3.524 243 HG12 VAL 34 HG12 VAL 34 -3.522 -4.714 -4.914 244 HG13 VAL 34 HG13 VAL 34 -3.413 -3.247 -3.942 245 HG21 VAL 34 HG21 VAL 34 -0.083 -2.232 -5.111 246 HG22 VAL 34 HG22 VAL 34 -0.365 -3.178 -3.648 247 HG23 VAL 34 HG23 VAL 34 -1.429 -1.827 -4.045 248 H ILE 35 H ILE 35 -1.323 -7.095 -5.016 249 HA ILE 35 HA ILE 35 -3.214 -7.743 -7.191 250 HB ILE 35 HB ILE 35 -1.555 -9.908 -5.991 251 HG12 ILE 35 HG12 ILE 35 -0.537 -7.992 -8.097 252 HG13 ILE 35 HG13 ILE 35 0.123 -8.196 -6.486 253 HG21 ILE 35 HG21 ILE 35 -2.598 -9.369 -8.765 254 HG22 ILE 35 HG22 ILE 35 -3.347 -10.410 -7.555 255 HG23 ILE 35 HG23 ILE 35 -1.779 -10.841 -8.241 256 HD11 ILE 35 HD11 ILE 35 1.504 -9.311 -8.126 257 HD12 ILE 35 HD12 ILE 35 0.122 -10.264 -8.670 258 HD13 ILE 35 HD13 ILE 35 0.761 -10.490 -7.041 259 HA PRO 36 HA PRO 36 -5.953 -8.679 -3.795 260 HB2 PRO 36 HB2 PRO 36 -7.657 -10.291 -5.253 261 HB3 PRO 36 HB3 PRO 36 -7.757 -8.530 -5.176 262 HG2 PRO 36 HG2 PRO 36 -6.545 -10.270 -7.279 263 HG3 PRO 36 HG3 PRO 36 -7.482 -8.775 -7.460 264 HD2 PRO 36 HD2 PRO 36 -4.806 -8.810 -7.706 265 HD3 PRO 36 HD3 PRO 36 -5.657 -7.428 -6.983 266 H SER 37 H SER 37 -5.930 -10.238 -2.273 267 HA SER 37 HA SER 37 -4.362 -12.588 -2.605 268 HB2 SER 37 HB2 SER 37 -4.717 -11.375 -0.427 269 HB3 SER 37 HB3 SER 37 -6.359 -12.018 -0.402 270 HG SER 37 HG SER 37 -5.307 -14.145 -0.570 271 H ASN 38 H ASN 38 -7.664 -11.819 -3.107 272 HA ASN 38 HA ASN 38 -8.066 -14.510 -4.163 273 HB2 ASN 38 HB2 ASN 38 -9.185 -14.315 -1.889 274 HB3 ASN 38 HB3 ASN 38 -10.211 -13.070 -2.593 275 HD21 ASN 38 HD21 ASN 38 -9.491 -16.451 -2.452 276 HD22 ASN 38 HD22 ASN 38 -10.882 -16.981 -3.342 277 HA PRO 39 HA PRO 39 -9.008 -11.489 -7.391 278 HB2 PRO 39 HB2 PRO 39 -9.021 -13.320 -9.420 279 HB3 PRO 39 HB3 PRO 39 -7.553 -12.572 -8.781 280 HG2 PRO 39 HG2 PRO 39 -8.725 -15.259 -8.192 281 HG3 PRO 39 HG3 PRO 39 -7.028 -14.806 -8.440 282 HD2 PRO 39 HD2 PRO 39 -8.074 -15.215 -5.985 283 HD3 PRO 39 HD3 PRO 39 -6.789 -14.028 -6.284 284 H TYR 40 H TYR 40 -10.778 -14.158 -6.254 285 HA TYR 40 HA TYR 40 -12.994 -13.825 -8.095 286 HB2 TYR 40 HB2 TYR 40 -12.834 -15.571 -5.628 287 HB3 TYR 40 HB3 TYR 40 -13.989 -15.708 -6.954 288 HD1 TYR 40 HD1 TYR 40 -13.237 -16.518 -9.171 289 HD2 TYR 40 HD2 TYR 40 -10.630 -16.492 -5.805 290 HE1 TYR 40 HE1 TYR 40 -11.704 -18.042 -10.348 291 HE2 TYR 40 HE2 TYR 40 -9.096 -18.014 -6.974 292 HH TYR 40 HH TYR 40 -9.339 -18.662 -10.303 293 H GLN 41 H GLN 41 -12.049 -12.907 -4.870 294 HA GLN 41 HA GLN 41 -14.573 -11.945 -4.005 295 HB2 GLN 41 HB2 GLN 41 -11.851 -11.944 -3.022 296 HB3 GLN 41 HB3 GLN 41 -12.617 -10.383 -2.756 297 HG2 GLN 41 HG2 GLN 41 -12.953 -11.736 -0.828 298 HG3 GLN 41 HG3 GLN 41 -14.500 -11.545 -1.649 299 HE21 GLN 41 HE21 GLN 41 -12.004 -13.713 -0.692 300 HE22 GLN 41 HE22 GLN 41 -12.811 -15.181 -1.132 301 H GLU 42 H GLU 42 -12.091 -10.684 -6.055 302 HA GLU 42 HA GLU 42 -12.880 -7.985 -6.159 303 HB2 GLU 42 HB2 GLU 42 -11.674 -9.753 -8.300 304 HB3 GLU 42 HB3 GLU 42 -11.825 -8.008 -8.425 305 HG2 GLU 42 HG2 GLU 42 -10.258 -9.427 -6.286 306 HG3 GLU 42 HG3 GLU 42 -9.568 -8.789 -7.777 307 H GLN 43 H GLN 43 -14.087 -10.898 -7.626 308 HA GLN 43 HA GLN 43 -15.933 -9.511 -9.382 309 HB2 GLN 43 HB2 GLN 43 -15.844 -12.469 -8.757 310 HB3 GLN 43 HB3 GLN 43 -16.517 -11.688 -10.184 311 HG2 GLN 43 HG2 GLN 43 -14.310 -11.038 -10.916 312 HG3 GLN 43 HG3 GLN 43 -13.603 -11.720 -9.452 313 HE21 GLN 43 HE21 GLN 43 -15.032 -12.399 -12.527 314 HE22 GLN 43 HE22 GLN 43 -14.585 -14.070 -12.600 315 H LEU 44 H LEU 44 -15.993 -11.480 -6.461 316 HA LEU 44 HA LEU 44 -18.850 -11.030 -6.093 317 HB2 LEU 44 HB2 LEU 44 -16.874 -12.549 -4.385 318 HB3 LEU 44 HB3 LEU 44 -18.614 -12.552 -4.193 319 HG LEU 44 HG LEU 44 -17.170 -13.615 -6.621 320 HD11 LEU 44 HD11 LEU 44 -18.374 -15.086 -4.279 321 HD12 LEU 44 HD12 LEU 44 -16.656 -14.949 -4.648 322 HD13 LEU 44 HD13 LEU 44 -17.725 -15.828 -5.741 323 HD21 LEU 44 HD21 LEU 44 -20.049 -13.805 -5.742 324 HD22 LEU 44 HD22 LEU 44 -19.348 -14.621 -7.139 325 HD23 LEU 44 HD23 LEU 44 -19.432 -12.858 -7.096 326 H SER 45 H SER 45 -17.878 -8.633 -6.025 327 HA SER 45 HA SER 45 -16.659 -7.917 -3.533 328 HB2 SER 45 HB2 SER 45 -16.965 -5.557 -4.483 329 HB3 SER 45 HB3 SER 45 -15.915 -6.657 -5.375 330 HG SER 45 HG SER 45 -18.195 -5.437 -6.172 331 H ASP 46 H ASP 46 -18.143 -8.451 -1.923 332 HA ASP 46 HA ASP 46 -20.578 -6.865 -1.760 333 HB2 ASP 46 HB2 ASP 46 -20.939 -7.914 0.379 334 HB3 ASP 46 HB3 ASP 46 -20.419 -9.163 -0.744 335 H THR 47 H THR 47 -17.341 -6.480 -1.334 336 HA THR 47 HA THR 47 -17.546 -4.473 0.777 337 HB THR 47 HB THR 47 -14.968 -4.594 0.503 338 HG1 THR 47 HG1 THR 47 -15.284 -7.223 -0.323 339 HG21 THR 47 HG21 THR 47 -14.866 -6.522 2.015 340 HG22 THR 47 HG22 THR 47 -16.522 -6.946 1.584 341 HG23 THR 47 HG23 THR 47 -16.193 -5.445 2.448 342 HA PRO 48 HA PRO 48 -17.218 -1.288 -2.335 343 HB2 PRO 48 HB2 PRO 48 -16.801 0.790 -0.651 344 HB3 PRO 48 HB3 PRO 48 -18.386 0.038 -0.858 345 HG2 PRO 48 HG2 PRO 48 -16.367 -0.364 1.314 346 HG3 PRO 48 HG3 PRO 48 -18.129 -0.202 1.439 347 HD2 PRO 48 HD2 PRO 48 -16.854 -2.598 1.530 348 HD3 PRO 48 HD3 PRO 48 -18.494 -2.403 0.887 349 H LEU 49 H LEU 49 -15.630 0.194 -3.148 350 HA LEU 49 HA LEU 49 -12.913 -0.625 -2.460 351 HB2 LEU 49 HB2 LEU 49 -14.074 0.903 -4.770 352 HB3 LEU 49 HB3 LEU 49 -12.347 0.813 -4.490 353 HG LEU 49 HG LEU 49 -14.162 -1.539 -5.010 354 HD11 LEU 49 HD11 LEU 49 -13.790 -0.127 -6.974 355 HD12 LEU 49 HD12 LEU 49 -12.982 -1.687 -7.129 356 HD13 LEU 49 HD13 LEU 49 -12.048 -0.244 -6.717 357 HD21 LEU 49 HD21 LEU 49 -12.092 -2.825 -5.118 358 HD22 LEU 49 HD22 LEU 49 -12.305 -2.098 -3.525 359 HD23 LEU 49 HD23 LEU 49 -11.171 -1.388 -4.674 360 H ILE 50 H ILE 50 -11.773 0.495 -1.095 361 HA ILE 50 HA ILE 50 -12.375 3.306 -0.607 362 HB ILE 50 HB ILE 50 -10.327 1.499 0.704 363 HG12 ILE 50 HG12 ILE 50 -12.974 2.492 1.783 364 HG13 ILE 50 HG13 ILE 50 -12.729 0.887 1.101 365 HG21 ILE 50 HG21 ILE 50 -10.160 3.264 2.399 366 HG22 ILE 50 HG22 ILE 50 -11.266 4.267 1.463 367 HG23 ILE 50 HG23 ILE 50 -9.684 3.851 0.806 368 HD11 ILE 50 HD11 ILE 50 -11.119 0.382 2.856 369 HD12 ILE 50 HD12 ILE 50 -12.678 0.852 3.532 370 HD13 ILE 50 HD13 ILE 50 -11.337 1.997 3.528 371 HA PRO 51 HA PRO 51 -9.071 4.411 -3.421 372 HB2 PRO 51 HB2 PRO 51 -9.195 7.091 -2.970 373 HB3 PRO 51 HB3 PRO 51 -10.333 6.236 -4.021 374 HG2 PRO 51 HG2 PRO 51 -10.674 7.196 -1.218 375 HG3 PRO 51 HG3 PRO 51 -11.838 7.161 -2.551 376 HD2 PRO 51 HD2 PRO 51 -11.784 5.332 -0.507 377 HD3 PRO 51 HD3 PRO 51 -12.458 5.012 -2.117 378 H LEU 52 H LEU 52 -6.950 4.505 -3.068 379 HA LEU 52 HA LEU 52 -5.959 5.773 -0.621 380 HB2 LEU 52 HB2 LEU 52 -5.192 3.024 -1.609 381 HB3 LEU 52 HB3 LEU 52 -4.266 3.919 -0.418 382 HG LEU 52 HG LEU 52 -6.695 3.960 0.762 383 HD11 LEU 52 HD11 LEU 52 -7.696 1.743 0.559 384 HD12 LEU 52 HD12 LEU 52 -6.571 1.358 -0.743 385 HD13 LEU 52 HD13 LEU 52 -7.764 2.639 -0.958 386 HD21 LEU 52 HD21 LEU 52 -4.609 3.277 1.804 387 HD22 LEU 52 HD22 LEU 52 -4.668 1.739 0.942 388 HD23 LEU 52 HD23 LEU 52 -5.893 2.120 2.153 389 H THR 53 H THR 53 -4.183 6.958 -0.881 390 HA THR 53 HA THR 53 -2.864 6.894 -3.526 391 HB THR 53 HB THR 53 -3.019 9.255 -1.638 392 HG1 THR 53 HG1 THR 53 -4.996 8.243 -2.991 393 HG21 THR 53 HG21 THR 53 -1.162 9.335 -3.224 394 HG22 THR 53 HG22 THR 53 -2.382 10.539 -3.638 395 HG23 THR 53 HG23 THR 53 -2.277 9.039 -4.560 396 H ILE 54 H ILE 54 -0.817 6.225 -3.475 397 HA ILE 54 HA ILE 54 0.582 6.276 -0.885 398 HB ILE 54 HB ILE 54 1.089 4.472 -3.256 399 HG12 ILE 54 HG12 ILE 54 -0.242 3.969 -0.587 400 HG13 ILE 54 HG13 ILE 54 -0.988 3.866 -2.178 401 HG21 ILE 54 HG21 ILE 54 2.312 4.460 -0.497 402 HG22 ILE 54 HG22 ILE 54 3.118 4.966 -1.983 403 HG23 ILE 54 HG23 ILE 54 2.623 3.286 -1.775 404 HD11 ILE 54 HD11 ILE 54 1.181 2.066 -1.130 405 HD12 ILE 54 HD12 ILE 54 0.419 1.956 -2.715 406 HD13 ILE 54 HD13 ILE 54 -0.531 1.663 -1.262 407 H PHE 55 H PHE 55 2.335 7.454 -0.672 408 HA PHE 55 HA PHE 55 3.620 8.550 -3.088 409 HB2 PHE 55 HB2 PHE 55 3.458 9.636 -0.274 410 HB3 PHE 55 HB3 PHE 55 4.527 10.294 -1.507 411 HD1 PHE 55 HD1 PHE 55 1.020 9.841 -0.500 412 HD2 PHE 55 HD2 PHE 55 3.702 11.691 -3.237 413 HE1 PHE 55 HE1 PHE 55 -0.794 11.306 -1.282 414 HE2 PHE 55 HE2 PHE 55 1.892 13.163 -4.019 415 HZ PHE 55 HZ PHE 55 -0.356 12.971 -3.044 416 H VAL 56 H VAL 56 5.757 8.245 -3.401 417 HA VAL 56 HA VAL 56 7.172 6.523 -1.508 418 HB VAL 56 HB VAL 56 7.814 7.374 -4.331 419 HG11 VAL 56 HG11 VAL 56 9.847 6.018 -4.161 420 HG12 VAL 56 HG12 VAL 56 9.519 5.737 -2.454 421 HG13 VAL 56 HG13 VAL 56 9.883 7.364 -3.024 422 HG21 VAL 56 HG21 VAL 56 7.338 4.687 -3.083 423 HG22 VAL 56 HG22 VAL 56 7.717 4.991 -4.783 424 HG23 VAL 56 HG23 VAL 56 6.201 5.579 -4.090 425 H GLY 57 H GLY 57 8.329 7.513 0.045 426 HA2 GLY 57 HA2 GLY 57 10.653 8.635 -0.287 427 HA3 GLY 57 HA3 GLY 57 9.643 10.013 -0.666 428 H GLU 58 H GLU 58 11.355 10.426 1.254 429 HA GLU 58 HA GLU 58 10.182 9.821 3.840 430 HB2 GLU 58 HB2 GLU 58 12.608 11.490 3.145 431 HB3 GLU 58 HB3 GLU 58 12.125 11.003 4.764 432 HG2 GLU 58 HG2 GLU 58 12.406 8.634 4.060 433 HG3 GLU 58 HG3 GLU 58 13.057 9.222 2.529 434 H ASN 59 H ASN 59 8.378 10.953 4.230 435 HA ASN 59 HA ASN 59 8.338 13.833 3.723 436 HB2 ASN 59 HB2 ASN 59 6.317 12.359 3.299 437 HB3 ASN 59 HB3 ASN 59 6.191 12.156 5.042 438 HD21 ASN 59 HD21 ASN 59 7.167 15.113 3.397 439 HD22 ASN 59 HD22 ASN 59 5.789 16.042 3.886 440 H THR 60 H THR 60 9.364 11.703 6.017 441 HA THR 60 HA THR 60 8.731 12.996 8.446 442 HB THR 60 HB THR 60 10.812 11.688 9.232 443 HG1 THR 60 HG1 THR 60 11.841 10.505 7.761 444 HG21 THR 60 HG21 THR 60 9.600 9.553 9.150 445 HG22 THR 60 HG22 THR 60 8.522 10.214 7.923 446 HG23 THR 60 HG23 THR 60 8.520 10.887 9.554 447 H GLY 61 H GLY 61 11.785 12.934 6.582 448 HA2 GLY 61 HA2 GLY 61 13.425 14.537 6.346 449 HA3 GLY 61 HA3 GLY 61 12.280 15.713 6.980 450 H VAL 62 H VAL 62 14.213 12.947 8.093 451 HA VAL 62 HA VAL 62 14.460 14.225 10.713 452 HB VAL 62 HB VAL 62 15.400 12.079 11.475 453 HG11 VAL 62 HG11 VAL 62 12.766 11.843 10.027 454 HG12 VAL 62 HG12 VAL 62 13.013 12.472 11.656 455 HG13 VAL 62 HG13 VAL 62 13.331 10.773 11.312 456 HG21 VAL 62 HG21 VAL 62 16.420 11.334 9.389 457 HG22 VAL 62 HG22 VAL 62 14.823 11.135 8.665 458 HG23 VAL 62 HG23 VAL 62 15.311 10.113 10.017 459 H1 GLY 1 H1 GLY 1 -10.358 20.614 -0.223 460 H2 GLY 1 H2 GLY 1 -10.189 19.390 0.941 461 H3 GLY 1 H3 GLY 1 -10.300 21.010 1.425 462 HA2 GLY 1 HA2 GLY 1 -12.560 21.138 0.577 463 HA3 GLY 1 HA3 GLY 1 -12.446 19.445 0.111 464 H ALA 2 H ALA 2 -14.448 19.588 1.599 465 HA ALA 2 HA ALA 2 -13.825 19.625 4.432 466 HB1 ALA 2 HB1 ALA 2 -16.423 18.982 3.035 467 HB2 ALA 2 HB2 ALA 2 -15.939 20.573 3.624 468 HB3 ALA 2 HB3 ALA 2 -16.209 19.258 4.764 469 H MET 3 H MET 3 -12.251 17.785 3.550 470 HA MET 3 HA MET 3 -13.223 15.341 4.696 471 HB2 MET 3 HB2 MET 3 -14.100 15.066 2.435 472 HB3 MET 3 HB3 MET 3 -12.516 15.411 1.755 473 HG2 MET 3 HG2 MET 3 -11.629 13.386 2.810 474 HG3 MET 3 HG3 MET 3 -13.227 13.038 3.463 475 HE1 MET 3 HE1 MET 3 -12.461 14.555 -0.099 476 HE2 MET 3 HE2 MET 3 -12.285 13.086 -1.057 477 HE3 MET 3 HE3 MET 3 -11.102 13.469 0.193 478 H GLU 4 H GLU 4 -11.568 15.019 6.026 479 HA GLU 4 HA GLU 4 -8.853 15.610 5.222 480 HB2 GLU 4 HB2 GLU 4 -8.280 14.845 7.517 481 HB3 GLU 4 HB3 GLU 4 -9.472 16.139 7.489 482 HG2 GLU 4 HG2 GLU 4 -11.244 14.393 7.751 483 HG3 GLU 4 HG3 GLU 4 -9.952 13.217 7.999 484 H MET 5 H MET 5 -7.204 14.106 4.963 485 HA MET 5 HA MET 5 -8.188 11.402 4.328 486 HB2 MET 5 HB2 MET 5 -5.756 12.808 3.235 487 HB3 MET 5 HB3 MET 5 -6.341 11.230 2.746 488 HG2 MET 5 HG2 MET 5 -8.365 12.230 1.859 489 HG3 MET 5 HG3 MET 5 -7.816 13.825 2.372 490 HE1 MET 5 HE1 MET 5 -5.728 10.879 0.754 491 HE2 MET 5 HE2 MET 5 -5.818 11.316 -0.952 492 HE3 MET 5 HE3 MET 5 -7.278 10.833 -0.088 493 HA PRO 6 HA PRO 6 -5.818 10.046 7.923 494 HB2 PRO 6 HB2 PRO 6 -6.418 7.530 6.435 495 HB3 PRO 6 HB3 PRO 6 -6.549 7.881 8.160 496 HG2 PRO 6 HG2 PRO 6 -8.735 7.820 6.660 497 HG3 PRO 6 HG3 PRO 6 -8.540 9.085 7.890 498 HD2 PRO 6 HD2 PRO 6 -8.214 9.269 4.918 499 HD3 PRO 6 HD3 PRO 6 -8.885 10.455 6.054 500 H THR 7 H THR 7 -3.700 9.549 8.130 501 HA THR 7 HA THR 7 -2.309 8.875 5.646 502 HB THR 7 HB THR 7 -1.047 10.367 7.926 503 HG1 THR 7 HG1 THR 7 -2.949 11.242 6.164 504 HG21 THR 7 HG21 THR 7 -0.413 10.212 4.982 505 HG22 THR 7 HG22 THR 7 0.464 9.395 6.275 506 HG23 THR 7 HG23 THR 7 0.475 11.156 6.177 507 H PHE 8 H PHE 8 -1.059 7.126 5.620 508 HA PHE 8 HA PHE 8 -0.245 5.924 8.189 509 HB2 PHE 8 HB2 PHE 8 -0.954 4.533 5.593 510 HB3 PHE 8 HB3 PHE 8 -0.310 3.735 7.018 511 HD1 PHE 8 HD1 PHE 8 -3.219 5.496 5.614 512 HD2 PHE 8 HD2 PHE 8 -1.719 3.211 8.876 513 HE1 PHE 8 HE1 PHE 8 -5.516 5.153 6.427 514 HE2 PHE 8 HE2 PHE 8 -4.014 2.870 9.698 515 HZ PHE 8 HZ PHE 8 -5.919 3.835 8.470 516 H TYR 9 H TYR 9 1.899 5.285 8.352 517 HA TYR 9 HA TYR 9 3.574 5.795 5.981 518 HB2 TYR 9 HB2 TYR 9 3.608 7.381 8.161 519 HB3 TYR 9 HB3 TYR 9 4.769 6.163 8.675 520 HD1 TYR 9 HD1 TYR 9 6.569 5.566 6.750 521 HD2 TYR 9 HD2 TYR 9 4.437 9.232 7.101 522 HE1 TYR 9 HE1 TYR 9 8.315 6.701 5.439 523 HE2 TYR 9 HE2 TYR 9 6.173 10.374 5.788 524 HH TYR 9 HH TYR 9 8.507 8.743 3.997 525 H LEU 10 H LEU 10 4.695 4.076 5.349 526 HA LEU 10 HA LEU 10 5.651 2.176 7.345 527 HB2 LEU 10 HB2 LEU 10 4.955 0.303 5.721 528 HB3 LEU 10 HB3 LEU 10 3.753 0.992 6.787 529 HG LEU 10 HG LEU 10 3.144 2.496 4.772 530 HD11 LEU 10 HD11 LEU 10 5.068 1.931 3.385 531 HD12 LEU 10 HD12 LEU 10 3.551 1.494 2.597 532 HD13 LEU 10 HD13 LEU 10 4.547 0.246 3.347 533 HD21 LEU 10 HD21 LEU 10 1.616 0.774 3.936 534 HD22 LEU 10 HD22 LEU 10 1.691 0.795 5.698 535 HD23 LEU 10 HD23 LEU 10 2.546 -0.456 4.795 536 H ALA 11 H ALA 11 7.358 0.788 6.577 537 HA ALA 11 HA ALA 11 8.727 1.826 4.185 538 HB1 ALA 11 HB1 ALA 11 9.993 0.766 6.701 539 HB2 ALA 11 HB2 ALA 11 9.903 2.460 6.228 540 HB3 ALA 11 HB3 ALA 11 10.849 1.324 5.266 541 H LEU 12 H LEU 12 9.166 0.413 2.653 542 HA LEU 12 HA LEU 12 8.727 -2.444 3.255 543 HB2 LEU 12 HB2 LEU 12 8.128 -1.005 0.673 544 HB3 LEU 12 HB3 LEU 12 7.781 -2.679 1.037 545 HG LEU 12 HG LEU 12 6.478 -0.289 2.338 546 HD11 LEU 12 HD11 LEU 12 5.802 -0.627 0.014 547 HD12 LEU 12 HD12 LEU 12 4.488 -0.999 1.131 548 HD13 LEU 12 HD13 LEU 12 5.402 -2.306 0.373 549 HD21 LEU 12 HD21 LEU 12 4.988 -1.930 3.375 550 HD22 LEU 12 HD22 LEU 12 6.659 -2.167 3.883 551 HD23 LEU 12 HD23 LEU 12 5.942 -3.240 2.678 552 H HIS 13 H HIS 13 10.169 -3.910 2.395 553 HA HIS 13 HA HIS 13 12.707 -2.923 1.539 554 HB2 HIS 13 HB2 HIS 13 11.555 -5.718 1.607 555 HB3 HIS 13 HB3 HIS 13 13.197 -5.370 1.081 556 HD1 HIS 13 HD1 HIS 13 14.844 -4.416 2.941 557 HD2 HIS 13 HD2 HIS 13 11.198 -5.850 4.332 558 HE1 HIS 13 HE1 HIS 13 15.114 -4.663 5.428 559 HE2 HIS 13 HE2 HIS 13 12.840 -5.340 6.264 560 H GLY 14 H GLY 14 13.414 -2.473 -0.435 561 HA2 GLY 14 HA2 GLY 14 11.631 -2.275 -2.599 562 HA3 GLY 14 HA3 GLY 14 13.371 -2.073 -2.691 563 H GLY 15 H GLY 15 10.716 -4.027 -3.455 564 HA2 GLY 15 HA2 GLY 15 10.934 -5.600 -5.258 565 HA3 GLY 15 HA3 GLY 15 12.533 -6.005 -4.659 566 H GLN 16 H GLN 16 10.276 -5.676 -2.161 567 HA GLN 16 HA GLN 16 10.017 -8.602 -2.024 568 HB2 GLN 16 HB2 GLN 16 10.227 -6.501 0.111 569 HB3 GLN 16 HB3 GLN 16 9.555 -8.088 0.463 570 HG2 GLN 16 HG2 GLN 16 12.324 -7.483 -0.549 571 HG3 GLN 16 HG3 GLN 16 11.875 -8.065 1.054 572 HE21 GLN 16 HE21 GLN 16 12.363 -8.907 -2.266 573 HE22 GLN 16 HE22 GLN 16 12.233 -10.623 -2.065 574 H THR 17 H THR 17 8.095 -9.496 -1.141 575 HA THR 17 HA THR 17 5.728 -8.016 -2.039 576 HB THR 17 HB THR 17 5.867 -10.937 -1.257 577 HG1 THR 17 HG1 THR 17 7.043 -9.706 -3.372 578 HG21 THR 17 HG21 THR 17 4.019 -9.381 -3.072 579 HG22 THR 17 HG22 THR 17 3.627 -9.990 -1.463 580 HG23 THR 17 HG23 THR 17 3.945 -11.119 -2.782 581 H TYR 18 H TYR 18 4.117 -7.475 -0.719 582 HA TYR 18 HA TYR 18 4.203 -8.336 2.092 583 HB2 TYR 18 HB2 TYR 18 3.873 -5.555 0.986 584 HB3 TYR 18 HB3 TYR 18 3.345 -5.985 2.609 585 HD1 TYR 18 HD1 TYR 18 4.958 -6.510 4.342 586 HD2 TYR 18 HD2 TYR 18 6.236 -5.403 0.440 587 HE1 TYR 18 HE1 TYR 18 7.224 -6.134 5.205 588 HE2 TYR 18 HE2 TYR 18 8.512 -5.025 1.289 589 HH TYR 18 HH TYR 18 9.536 -6.080 4.356 590 H HIS 19 H HIS 19 2.239 -8.391 3.164 591 HA HIS 19 HA HIS 19 -0.119 -8.614 1.456 592 HB2 HIS 19 HB2 HIS 19 0.658 -9.519 4.189 593 HB3 HIS 19 HB3 HIS 19 -1.047 -9.270 3.868 594 HD1 HIS 19 HD1 HIS 19 0.936 -11.972 4.219 595 HD2 HIS 19 HD2 HIS 19 -1.355 -10.687 0.991 596 HE1 HIS 19 HE1 HIS 19 0.520 -14.020 2.830 597 HE2 HIS 19 HE2 HIS 19 -1.142 -13.269 1.102 598 H LEU 20 H LEU 20 -1.365 -6.925 1.224 599 HA LEU 20 HA LEU 20 -1.300 -4.771 3.220 600 HB2 LEU 20 HB2 LEU 20 -0.461 -3.902 1.208 601 HB3 LEU 20 HB3 LEU 20 -1.587 -4.823 0.232 602 HG LEU 20 HG LEU 20 -3.409 -3.342 0.899 603 HD11 LEU 20 HD11 LEU 20 -2.929 -1.305 2.175 604 HD12 LEU 20 HD12 LEU 20 -1.289 -1.889 2.465 605 HD13 LEU 20 HD13 LEU 20 -2.672 -2.769 3.124 606 HD21 LEU 20 HD21 LEU 20 -2.644 -1.332 -0.265 607 HD22 LEU 20 HD22 LEU 20 -2.093 -2.795 -1.079 608 HD23 LEU 20 HD23 LEU 20 -0.973 -1.863 -0.087 609 H ILE 21 H ILE 21 -3.066 -4.464 4.354 610 HA ILE 21 HA ILE 21 -5.668 -5.223 3.195 611 HB ILE 21 HB ILE 21 -4.849 -5.645 6.076 612 HG12 ILE 21 HG12 ILE 21 -5.462 -7.890 4.200 613 HG13 ILE 21 HG13 ILE 21 -3.867 -7.147 4.138 614 HG21 ILE 21 HG21 ILE 21 -7.232 -5.195 5.795 615 HG22 ILE 21 HG22 ILE 21 -6.965 -6.875 6.255 616 HG23 ILE 21 HG23 ILE 21 -7.340 -6.469 4.582 617 HD11 ILE 21 HD11 ILE 21 -3.475 -7.689 6.442 618 HD12 ILE 21 HD12 ILE 21 -3.956 -9.145 5.566 619 HD13 ILE 21 HD13 ILE 21 -5.115 -8.321 6.610 620 H VAL 22 H VAL 22 -7.038 -3.546 3.186 621 HA VAL 22 HA VAL 22 -6.765 -1.535 5.317 622 HB VAL 22 HB VAL 22 -6.361 -0.562 3.086 623 HG11 VAL 22 HG11 VAL 22 -7.716 -2.006 1.705 624 HG12 VAL 22 HG12 VAL 22 -8.237 -0.334 1.495 625 HG13 VAL 22 HG13 VAL 22 -9.184 -1.435 2.497 626 HG21 VAL 22 HG21 VAL 22 -7.281 0.837 4.837 627 HG22 VAL 22 HG22 VAL 22 -8.918 0.352 4.391 628 HG23 VAL 22 HG23 VAL 22 -7.943 1.302 3.272 629 H ASP 23 H ASP 23 -8.436 -1.348 6.670 630 HA ASP 23 HA ASP 23 -11.041 -2.458 5.889 631 HB2 ASP 23 HB2 ASP 23 -9.923 -4.268 7.027 632 HB3 ASP 23 HB3 ASP 23 -9.443 -3.205 8.341 633 H THR 24 H THR 24 -12.807 -1.622 7.119 634 HA THR 24 HA THR 24 -12.133 0.908 8.463 635 HB THR 24 HB THR 24 -14.634 1.415 8.001 636 HG1 THR 24 HG1 THR 24 -14.397 -1.001 6.831 637 HG21 THR 24 HG21 THR 24 -12.637 1.309 5.742 638 HG22 THR 24 HG22 THR 24 -12.784 2.595 6.942 639 HG23 THR 24 HG23 THR 24 -14.088 2.311 5.786 640 H ASP 25 H ASP 25 -12.811 1.315 10.482 641 HA ASP 25 HA ASP 25 -13.808 -0.924 12.017 642 HB2 ASP 25 HB2 ASP 25 -13.057 0.192 13.890 643 HB3 ASP 25 HB3 ASP 25 -12.010 0.909 12.670 644 H SER 26 H SER 26 -15.393 0.083 13.944 645 HA SER 26 HA SER 26 -17.902 0.211 12.679 646 HB2 SER 26 HB2 SER 26 -17.258 0.989 15.529 647 HB3 SER 26 HB3 SER 26 -18.804 0.413 14.904 648 HG SER 26 HG SER 26 -17.094 -1.433 14.229 649 H LEU 27 H LEU 27 -15.708 2.713 13.811 650 HA LEU 27 HA LEU 27 -17.709 4.793 13.697 651 HB2 LEU 27 HB2 LEU 27 -14.715 5.106 13.815 652 HB3 LEU 27 HB3 LEU 27 -15.921 6.306 14.229 653 HG LEU 27 HG LEU 27 -15.459 3.735 15.743 654 HD11 LEU 27 HD11 LEU 27 -14.440 5.133 17.441 655 HD12 LEU 27 HD12 LEU 27 -14.676 6.562 16.434 656 HD13 LEU 27 HD13 LEU 27 -13.572 5.286 15.912 657 HD21 LEU 27 HD21 LEU 27 -16.892 4.762 17.444 658 HD22 LEU 27 HD22 LEU 27 -17.753 4.526 15.924 659 HD23 LEU 27 HD23 LEU 27 -17.180 6.133 16.372 660 H GLY 28 H GLY 28 -15.431 3.364 11.512 661 HA2 GLY 28 HA2 GLY 28 -15.859 3.640 9.139 662 HA3 GLY 28 HA3 GLY 28 -16.274 5.317 9.464 663 H ASN 29 H ASN 29 -13.568 4.085 11.159 664 HA ASN 29 HA ASN 29 -11.775 5.750 9.535 665 HB2 ASN 29 HB2 ASN 29 -11.228 4.288 12.138 666 HB3 ASN 29 HB3 ASN 29 -10.176 5.464 11.365 667 HD21 ASN 29 HD21 ASN 29 -13.008 4.949 13.244 668 HD22 ASN 29 HD22 ASN 29 -13.272 6.606 13.678 669 HA PRO 30 HA PRO 30 -10.132 2.171 7.550 670 HB2 PRO 30 HB2 PRO 30 -8.039 3.362 6.348 671 HB3 PRO 30 HB3 PRO 30 -9.704 3.610 5.802 672 HG2 PRO 30 HG2 PRO 30 -7.993 5.363 7.528 673 HG3 PRO 30 HG3 PRO 30 -9.058 5.818 6.189 674 HD2 PRO 30 HD2 PRO 30 -9.777 6.051 8.797 675 HD3 PRO 30 HD3 PRO 30 -10.943 5.752 7.492 676 H SER 31 H SER 31 -8.630 0.696 7.987 677 HA SER 31 HA SER 31 -6.400 1.413 9.767 678 HB2 SER 31 HB2 SER 31 -8.237 0.188 10.973 679 HB3 SER 31 HB3 SER 31 -8.007 -1.150 9.855 680 HG SER 31 HG SER 31 -6.622 -1.781 11.310 681 H LEU 32 H LEU 32 -4.456 0.408 9.259 682 HA LEU 32 HA LEU 32 -4.503 -1.026 6.695 683 HB2 LEU 32 HB2 LEU 32 -3.632 1.400 6.769 684 HB3 LEU 32 HB3 LEU 32 -2.236 0.727 7.590 685 HG LEU 32 HG LEU 32 -1.968 -0.818 5.593 686 HD11 LEU 32 HD11 LEU 32 -3.922 1.148 4.407 687 HD12 LEU 32 HD12 LEU 32 -4.205 -0.573 4.683 688 HD13 LEU 32 HD13 LEU 32 -2.996 -0.054 3.508 689 HD21 LEU 32 HD21 LEU 32 -0.565 1.156 6.021 690 HD22 LEU 32 HD22 LEU 32 -1.703 2.144 5.104 691 HD23 LEU 32 HD23 LEU 32 -0.807 0.855 4.303 692 H SER 33 H SER 33 -3.543 -2.926 6.649 693 HA SER 33 HA SER 33 -1.560 -3.571 8.727 694 HB2 SER 33 HB2 SER 33 -3.641 -5.452 7.570 695 HB3 SER 33 HB3 SER 33 -2.427 -5.868 8.778 696 HG SER 33 HG SER 33 -3.418 -4.385 10.197 697 H VAL 34 H VAL 34 0.367 -3.948 7.838 698 HA VAL 34 HA VAL 34 0.441 -5.235 5.190 699 HB VAL 34 HB VAL 34 2.268 -3.064 6.238 700 HG11 VAL 34 HG11 VAL 34 2.504 -4.685 3.705 701 HG12 VAL 34 HG12 VAL 34 3.594 -4.759 5.090 702 HG13 VAL 34 HG13 VAL 34 3.492 -3.285 4.126 703 HG21 VAL 34 HG21 VAL 34 0.165 -2.261 5.306 704 HG22 VAL 34 HG22 VAL 34 0.442 -3.201 3.839 705 HG23 VAL 34 HG23 VAL 34 1.509 -1.854 4.240 706 H ILE 35 H ILE 35 1.380 -7.132 5.188 707 HA ILE 35 HA ILE 35 3.273 -7.796 7.355 708 HB ILE 35 HB ILE 35 1.606 -9.950 6.145 709 HG12 ILE 35 HG12 ILE 35 0.605 -8.044 8.269 710 HG13 ILE 35 HG13 ILE 35 -0.062 -8.233 6.658 711 HG21 ILE 35 HG21 ILE 35 2.659 -9.427 8.923 712 HG22 ILE 35 HG22 ILE 35 3.401 -10.468 7.708 713 HG23 ILE 35 HG23 ILE 35 1.832 -10.894 8.395 714 HD11 ILE 35 HD11 ILE 35 -1.446 -9.345 8.297 715 HD12 ILE 35 HD12 ILE 35 -0.070 -10.308 8.835 716 HD13 ILE 35 HD13 ILE 35 -0.717 -10.526 7.207 717 HA PRO 36 HA PRO 36 6.005 -8.734 3.942 718 HB2 PRO 36 HB2 PRO 36 7.707 -10.359 5.390 719 HB3 PRO 36 HB3 PRO 36 7.812 -8.598 5.320 720 HG2 PRO 36 HG2 PRO 36 6.599 -10.344 7.416 721 HG3 PRO 36 HG3 PRO 36 7.543 -8.855 7.603 722 HD2 PRO 36 HD2 PRO 36 4.869 -8.878 7.854 723 HD3 PRO 36 HD3 PRO 36 5.722 -7.495 7.138 724 H SER 37 H SER 37 5.965 -10.284 2.414 725 HA SER 37 HA SER 37 4.385 -12.623 2.736 726 HB2 SER 37 HB2 SER 37 4.751 -11.401 0.564 727 HB3 SER 37 HB3 SER 37 6.387 -12.059 0.535 728 HG SER 37 HG SER 37 5.327 -14.181 0.673 729 H ASN 38 H ASN 38 7.700 -11.876 3.226 730 HA ASN 38 HA ASN 38 8.084 -14.576 4.279 731 HB2 ASN 38 HB2 ASN 38 9.203 -14.373 2.002 732 HB3 ASN 38 HB3 ASN 38 10.235 -13.139 2.715 733 HD21 ASN 38 HD21 ASN 38 9.507 -16.510 2.541 734 HD22 ASN 38 HD22 ASN 38 10.900 -17.058 3.419 735 HA PRO 39 HA PRO 39 9.051 -11.568 7.521 736 HB2 PRO 39 HB2 PRO 39 9.059 -13.410 9.541 737 HB3 PRO 39 HB3 PRO 39 7.595 -12.653 8.909 738 HG2 PRO 39 HG2 PRO 39 8.749 -15.344 8.302 739 HG3 PRO 39 HG3 PRO 39 7.057 -14.880 8.561 740 HD2 PRO 39 HD2 PRO 39 8.089 -15.281 6.095 741 HD3 PRO 39 HD3 PRO 39 6.817 -14.084 6.411 742 H TYR 40 H TYR 40 10.802 -14.250 6.366 743 HA TYR 40 HA TYR 40 13.023 -13.941 8.203 744 HB2 TYR 40 HB2 TYR 40 12.847 -15.666 5.724 745 HB3 TYR 40 HB3 TYR 40 14.010 -15.813 7.038 746 HD1 TYR 40 HD1 TYR 40 13.271 -16.639 9.259 747 HD2 TYR 40 HD2 TYR 40 10.650 -16.590 5.905 748 HE1 TYR 40 HE1 TYR 40 11.739 -18.157 10.439 749 HE2 TYR 40 HE2 TYR 40 9.112 -18.104 7.078 750 HH TYR 40 HH TYR 40 9.324 -18.709 10.393 751 H GLN 41 H GLN 41 12.078 -12.991 4.985 752 HA GLN 41 HA GLN 41 14.607 -12.039 4.123 753 HB2 GLN 41 HB2 GLN 41 11.884 -12.026 3.140 754 HB3 GLN 41 HB3 GLN 41 12.650 -10.464 2.881 755 HG2 GLN 41 HG2 GLN 41 12.984 -11.803 0.946 756 HG3 GLN 41 HG3 GLN 41 14.533 -11.629 1.767 757 HE21 GLN 41 HE21 GLN 41 12.021 -13.773 0.806 758 HE22 GLN 41 HE22 GLN 41 12.811 -15.252 1.240 759 H GLU 42 H GLU 42 12.135 -10.776 6.182 760 HA GLU 42 HA GLU 42 12.933 -8.080 6.296 761 HB2 GLU 42 HB2 GLU 42 11.732 -9.859 8.430 762 HB3 GLU 42 HB3 GLU 42 11.887 -8.114 8.561 763 HG2 GLU 42 HG2 GLU 42 10.313 -9.518 6.417 764 HG3 GLU 42 HG3 GLU 42 9.625 -8.888 7.914 765 H GLN 43 H GLN 43 14.128 -10.998 7.761 766 HA GLN 43 HA GLN 43 15.997 -9.638 9.503 767 HB2 GLN 43 HB2 GLN 43 15.889 -12.588 8.865 768 HB3 GLN 43 HB3 GLN 43 16.570 -11.817 10.295 769 HG2 GLN 43 HG2 GLN 43 14.361 -11.162 11.029 770 HG3 GLN 43 HG3 GLN 43 13.651 -11.839 9.564 771 HE21 GLN 43 HE21 GLN 43 15.083 -12.533 12.641 772 HE22 GLN 43 HE22 GLN 43 14.637 -14.211 12.695 773 H LEU 44 H LEU 44 16.029 -11.591 6.569 774 HA LEU 44 HA LEU 44 18.889 -11.154 6.197 775 HB2 LEU 44 HB2 LEU 44 16.905 -12.656 4.483 776 HB3 LEU 44 HB3 LEU 44 18.648 -12.666 4.293 777 HG LEU 44 HG LEU 44 17.203 -13.728 6.718 778 HD11 LEU 44 HD11 LEU 44 18.382 -15.204 4.371 779 HD12 LEU 44 HD12 LEU 44 16.667 -15.052 4.746 780 HD13 LEU 44 HD13 LEU 44 17.731 -15.943 5.833 781 HD21 LEU 44 HD21 LEU 44 20.077 -13.936 5.826 782 HD22 LEU 44 HD22 LEU 44 19.378 -14.750 7.225 783 HD23 LEU 44 HD23 LEU 44 19.473 -12.988 7.186 784 H SER 45 H SER 45 17.939 -8.755 6.142 785 HA SER 45 HA SER 45 16.707 -8.017 3.661 786 HB2 SER 45 HB2 SER 45 17.042 -5.662 4.626 787 HB3 SER 45 HB3 SER 45 15.978 -6.756 5.507 788 HG SER 45 HG SER 45 18.246 -5.558 6.340 789 H ASP 46 H ASP 46 18.192 -8.546 2.037 790 HA ASP 46 HA ASP 46 20.635 -6.967 1.880 791 HB2 ASP 46 HB2 ASP 46 20.984 -8.018 -0.259 792 HB3 ASP 46 HB3 ASP 46 20.444 -9.269 0.855 793 H THR 47 H THR 47 17.402 -6.567 1.476 794 HA THR 47 HA THR 47 17.602 -4.562 -0.637 795 HB THR 47 HB THR 47 15.021 -4.681 -0.348 796 HG1 THR 47 HG1 THR 47 15.327 -7.311 0.437 797 HG21 THR 47 HG21 THR 47 14.901 -6.591 -1.876 798 HG22 THR 47 HG22 THR 47 16.558 -7.030 -1.458 799 HG23 THR 47 HG23 THR 47 16.234 -5.519 -2.306 800 HA PRO 48 HA PRO 48 17.302 -1.388 2.485 801 HB2 PRO 48 HB2 PRO 48 16.882 0.698 0.809 802 HB3 PRO 48 HB3 PRO 48 18.465 -0.059 1.006 803 HG2 PRO 48 HG2 PRO 48 16.436 -0.450 -1.157 804 HG3 PRO 48 HG3 PRO 48 18.198 -0.294 -1.289 805 HD2 PRO 48 HD2 PRO 48 16.913 -2.686 -1.381 806 HD3 PRO 48 HD3 PRO 48 18.559 -2.496 -0.745 807 H LEU 49 H LEU 49 15.723 0.101 3.309 808 HA LEU 49 HA LEU 49 13.004 -0.709 2.626 809 HB2 LEU 49 HB2 LEU 49 14.173 0.801 4.946 810 HB3 LEU 49 HB3 LEU 49 12.446 0.719 4.668 811 HG LEU 49 HG LEU 49 14.253 -1.645 5.173 812 HD11 LEU 49 HD11 LEU 49 13.890 -0.235 7.140 813 HD12 LEU 49 HD12 LEU 49 13.073 -1.791 7.293 814 HD13 LEU 49 HD13 LEU 49 12.145 -0.341 6.888 815 HD21 LEU 49 HD21 LEU 49 12.176 -2.919 5.280 816 HD22 LEU 49 HD22 LEU 49 12.386 -2.184 3.690 817 HD23 LEU 49 HD23 LEU 49 11.261 -1.475 4.849 818 H ILE 50 H ILE 50 11.864 0.428 1.269 819 HA ILE 50 HA ILE 50 12.474 3.240 0.795 820 HB ILE 50 HB ILE 50 10.412 1.446 -0.517 821 HG12 ILE 50 HG12 ILE 50 13.063 2.428 -1.599 822 HG13 ILE 50 HG13 ILE 50 12.807 0.823 -0.923 823 HG21 ILE 50 HG21 ILE 50 10.248 3.224 -2.203 824 HG22 ILE 50 HG22 ILE 50 11.361 4.215 -1.261 825 HG23 ILE 50 HG23 ILE 50 9.779 3.802 -0.604 826 HD11 ILE 50 HD11 ILE 50 11.192 0.338 -2.678 827 HD12 ILE 50 HD12 ILE 50 12.755 0.799 -3.354 828 HD13 ILE 50 HD13 ILE 50 11.423 1.955 -3.343 829 HA PRO 51 HA PRO 51 9.183 4.344 3.622 830 HB2 PRO 51 HB2 PRO 51 9.315 7.024 3.192 831 HB3 PRO 51 HB3 PRO 51 10.454 6.157 4.230 832 HG2 PRO 51 HG2 PRO 51 10.787 7.131 1.431 833 HG3 PRO 51 HG3 PRO 51 11.956 7.088 2.757 834 HD2 PRO 51 HD2 PRO 51 11.889 5.270 0.706 835 HD3 PRO 51 HD3 PRO 51 12.568 4.935 2.312 836 H LEU 52 H LEU 52 7.065 4.443 3.274 837 HA LEU 52 HA LEU 52 6.065 5.731 0.841 838 HB2 LEU 52 HB2 LEU 52 5.296 2.983 1.819 839 HB3 LEU 52 HB3 LEU 52 4.366 3.885 0.638 840 HG LEU 52 HG LEU 52 6.792 3.922 -0.555 841 HD11 LEU 52 HD11 LEU 52 7.788 1.698 -0.362 842 HD12 LEU 52 HD12 LEU 52 6.665 1.313 0.942 843 HD13 LEU 52 HD13 LEU 52 7.865 2.588 1.159 844 HD21 LEU 52 HD21 LEU 52 4.699 3.250 -1.595 845 HD22 LEU 52 HD22 LEU 52 4.752 1.710 -0.739 846 HD23 LEU 52 HD23 LEU 52 5.976 2.088 -1.951 847 H THR 53 H THR 53 4.306 6.930 1.116 848 HA THR 53 HA THR 53 2.986 6.858 3.759 849 HB THR 53 HB THR 53 3.154 9.224 1.879 850 HG1 THR 53 HG1 THR 53 5.128 8.194 3.227 851 HG21 THR 53 HG21 THR 53 1.298 9.302 3.463 852 HG22 THR 53 HG22 THR 53 2.522 10.501 3.887 853 HG23 THR 53 HG23 THR 53 2.408 8.996 4.800 854 H ILE 54 H ILE 54 0.934 6.205 3.712 855 HA ILE 54 HA ILE 54 -0.470 6.266 1.125 856 HB ILE 54 HB ILE 54 -0.981 4.453 3.489 857 HG12 ILE 54 HG12 ILE 54 0.347 3.960 0.816 858 HG13 ILE 54 HG13 ILE 54 1.093 3.842 2.405 859 HG21 ILE 54 HG21 ILE 54 -2.205 4.463 0.733 860 HG22 ILE 54 HG22 ILE 54 -3.009 4.960 2.222 861 HG23 ILE 54 HG23 ILE 54 -2.521 3.280 2.001 862 HD11 ILE 54 HD11 ILE 54 -1.090 2.059 1.349 863 HD12 ILE 54 HD12 ILE 54 -0.325 1.935 2.933 864 HD13 ILE 54 HD13 ILE 54 0.621 1.647 1.474 865 H PHE 55 H PHE 55 -2.208 7.463 0.921 866 HA PHE 55 HA PHE 55 -3.492 8.545 3.342 867 HB2 PHE 55 HB2 PHE 55 -3.333 9.642 0.533 868 HB3 PHE 55 HB3 PHE 55 -4.391 10.302 1.775 869 HD1 PHE 55 HD1 PHE 55 -0.889 9.832 0.756 870 HD2 PHE 55 HD2 PHE 55 -3.551 11.683 3.509 871 HE1 PHE 55 HE1 PHE 55 0.935 11.288 1.540 872 HE2 PHE 55 HE2 PHE 55 -1.734 13.141 4.294 873 HZ PHE 55 HZ PHE 55 0.514 12.943 3.309 874 H VAL 56 H VAL 56 -5.627 8.248 3.663 875 HA VAL 56 HA VAL 56 -7.056 6.539 1.765 876 HB VAL 56 HB VAL 56 -7.681 7.383 4.595 877 HG11 VAL 56 HG11 VAL 56 -9.724 6.039 4.428 878 HG12 VAL 56 HG12 VAL 56 -9.408 5.766 2.715 879 HG13 VAL 56 HG13 VAL 56 -9.757 7.394 3.298 880 HG21 VAL 56 HG21 VAL 56 -7.221 4.702 3.327 881 HG22 VAL 56 HG22 VAL 56 -7.595 4.993 5.030 882 HG23 VAL 56 HG23 VAL 56 -6.078 5.582 4.340 883 H GLY 57 H GLY 57 -8.222 7.542 0.218 884 HA2 GLY 57 HA2 GLY 57 -10.535 8.676 0.558 885 HA3 GLY 57 HA3 GLY 57 -9.520 10.049 0.944 886 H GLU 58 H GLU 58 -11.216 10.510 -0.970 887 HA GLU 58 HA GLU 58 -10.066 9.877 -3.558 888 HB2 GLU 58 HB2 GLU 58 -12.477 11.560 -2.857 889 HB3 GLU 58 HB3 GLU 58 -12.002 11.069 -4.476 890 HG2 GLU 58 HG2 GLU 58 -12.298 8.704 -3.773 891 HG3 GLU 58 HG3 GLU 58 -12.943 9.294 -2.240 892 H ASN 59 H ASN 59 -8.247 11.004 -3.944 893 HA ASN 59 HA ASN 59 -8.200 13.881 -3.427 894 HB2 ASN 59 HB2 ASN 59 -6.179 12.403 -3.014 895 HB3 ASN 59 HB3 ASN 59 -6.062 12.201 -4.761 896 HD21 ASN 59 HD21 ASN 59 -7.018 15.157 -3.107 897 HD22 ASN 59 HD22 ASN 59 -5.646 16.088 -3.598 898 H THR 60 H THR 60 -9.246 11.771 -5.731 899 HA THR 60 HA THR 60 -8.608 13.067 -8.157 900 HB THR 60 HB THR 60 -10.699 11.775 -8.944 901 HG1 THR 60 HG1 THR 60 -11.718 10.560 -7.482 902 HG21 THR 60 HG21 THR 60 -9.505 9.631 -8.869 903 HG22 THR 60 HG22 THR 60 -8.418 10.278 -7.638 904 HG23 THR 60 HG23 THR 60 -8.415 10.955 -9.269 905 H GLY 61 H GLY 61 -11.652 13.021 -6.277 906 HA2 GLY 61 HA2 GLY 61 -13.295 14.620 -6.045 907 HA3 GLY 61 HA3 GLY 61 -12.148 15.799 -6.667 908 H VAL 62 H VAL 62 -14.118 13.061 -7.772 909 HA VAL 62 HA VAL 62 -14.335 14.336 -10.401 910 HB VAL 62 HB VAL 62 -15.291 12.195 -11.168 911 HG11 VAL 62 HG11 VAL 62 -12.660 11.946 -9.724 912 HG12 VAL 62 HG12 VAL 62 -12.900 12.581 -11.351 913 HG13 VAL 62 HG13 VAL 62 -13.227 10.881 -11.010 914 HG21 VAL 62 HG21 VAL 62 -16.307 11.454 -9.080 915 HG22 VAL 62 HG22 VAL 62 -14.707 11.248 -8.362 916 HG23 VAL 62 HG23 VAL 62 -15.206 10.227 -9.711 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 6.310 20.977 1.615 2 H2 GLY 1 H2 GLY 1 7.368 22.261 1.294 3 H3 GLY 1 H3 GLY 1 7.938 20.872 2.078 4 HA2 GLY 1 HA2 GLY 1 7.466 19.556 0.086 5 HA3 GLY 1 HA3 GLY 1 6.979 21.038 -0.725 6 H ALA 2 H ALA 2 9.264 19.022 -1.027 7 HA ALA 2 HA ALA 2 11.413 21.035 -1.167 8 HB1 ALA 2 HB1 ALA 2 11.828 19.590 0.762 9 HB2 ALA 2 HB2 ALA 2 13.046 19.353 -0.488 10 HB3 ALA 2 HB3 ALA 2 11.755 18.168 -0.278 11 H MET 3 H MET 3 10.609 17.713 -2.164 12 HA MET 3 HA MET 3 11.371 18.420 -4.909 13 HB2 MET 3 HB2 MET 3 12.217 15.955 -3.375 14 HB3 MET 3 HB3 MET 3 12.325 16.084 -5.124 15 HG2 MET 3 HG2 MET 3 13.810 18.040 -4.849 16 HG3 MET 3 HG3 MET 3 13.759 17.792 -3.105 17 HE1 MET 3 HE1 MET 3 13.809 14.987 -5.860 18 HE2 MET 3 HE2 MET 3 15.542 14.717 -6.054 19 HE3 MET 3 HE3 MET 3 14.825 16.246 -6.562 20 H GLU 4 H GLU 4 10.283 17.252 -6.528 21 HA GLU 4 HA GLU 4 7.622 16.470 -5.810 22 HB2 GLU 4 HB2 GLU 4 9.089 16.415 -8.450 23 HB3 GLU 4 HB3 GLU 4 7.384 16.019 -8.262 24 HG2 GLU 4 HG2 GLU 4 6.934 18.262 -7.452 25 HG3 GLU 4 HG3 GLU 4 8.649 18.660 -7.573 26 H MET 5 H MET 5 6.725 14.467 -5.772 27 HA MET 5 HA MET 5 8.552 12.185 -6.099 28 HB2 MET 5 HB2 MET 5 7.444 11.140 -4.128 29 HB3 MET 5 HB3 MET 5 8.340 12.598 -3.722 30 HG2 MET 5 HG2 MET 5 6.269 13.874 -3.673 31 HG3 MET 5 HG3 MET 5 5.363 12.430 -4.113 32 HE1 MET 5 HE1 MET 5 8.451 12.549 -1.703 33 HE2 MET 5 HE2 MET 5 7.682 12.796 -0.136 34 HE3 MET 5 HE3 MET 5 7.653 14.081 -1.344 35 HA PRO 6 HA PRO 6 5.463 10.491 -8.651 36 HB2 PRO 6 HB2 PRO 6 6.491 7.840 -8.099 37 HB3 PRO 6 HB3 PRO 6 6.645 8.824 -9.548 38 HG2 PRO 6 HG2 PRO 6 8.721 8.216 -7.869 39 HG3 PRO 6 HG3 PRO 6 8.683 9.596 -8.980 40 HD2 PRO 6 HD2 PRO 6 8.245 9.506 -6.047 41 HD3 PRO 6 HD3 PRO 6 8.953 10.783 -7.053 42 H THR 7 H THR 7 3.460 9.712 -8.399 43 HA THR 7 HA THR 7 2.746 8.783 -5.694 44 HB THR 7 HB THR 7 0.953 10.272 -7.610 45 HG1 THR 7 HG1 THR 7 3.066 11.226 -6.334 46 HG21 THR 7 HG21 THR 7 0.803 9.848 -4.624 47 HG22 THR 7 HG22 THR 7 -0.177 9.015 -5.832 48 HG23 THR 7 HG23 THR 7 -0.351 10.756 -5.601 49 H PHE 8 H PHE 8 1.220 7.154 -5.479 50 HA PHE 8 HA PHE 8 0.304 5.844 -7.959 51 HB2 PHE 8 HB2 PHE 8 1.080 4.550 -5.332 52 HB3 PHE 8 HB3 PHE 8 0.355 3.707 -6.690 53 HD1 PHE 8 HD1 PHE 8 3.355 5.481 -5.516 54 HD2 PHE 8 HD2 PHE 8 1.660 3.045 -8.563 55 HE1 PHE 8 HE1 PHE 8 5.604 5.076 -6.439 56 HE2 PHE 8 HE2 PHE 8 3.903 2.636 -9.493 57 HZ PHE 8 HZ PHE 8 5.876 3.653 -8.430 58 H TYR 9 H TYR 9 -1.853 5.302 -8.056 59 HA TYR 9 HA TYR 9 -3.451 5.800 -5.626 60 HB2 TYR 9 HB2 TYR 9 -3.553 7.542 -7.582 61 HB3 TYR 9 HB3 TYR 9 -4.532 6.320 -8.381 62 HD1 TYR 9 HD1 TYR 9 -6.707 5.614 -7.318 63 HD2 TYR 9 HD2 TYR 9 -4.438 8.913 -5.891 64 HE1 TYR 9 HE1 TYR 9 -8.687 6.452 -6.123 65 HE2 TYR 9 HE2 TYR 9 -6.406 9.763 -4.695 66 HH TYR 9 HH TYR 9 -8.798 9.602 -4.736 67 H LEU 10 H LEU 10 -4.581 4.066 -5.026 68 HA LEU 10 HA LEU 10 -5.550 2.213 -7.066 69 HB2 LEU 10 HB2 LEU 10 -4.817 0.294 -5.539 70 HB3 LEU 10 HB3 LEU 10 -3.602 1.066 -6.538 71 HG LEU 10 HG LEU 10 -3.080 2.470 -4.422 72 HD11 LEU 10 HD11 LEU 10 -5.018 1.775 -3.115 73 HD12 LEU 10 HD12 LEU 10 -3.509 1.328 -2.320 74 HD13 LEU 10 HD13 LEU 10 -4.456 0.104 -3.165 75 HD21 LEU 10 HD21 LEU 10 -1.557 0.875 -5.408 76 HD22 LEU 10 HD22 LEU 10 -2.401 -0.457 -4.616 77 HD23 LEU 10 HD23 LEU 10 -1.529 0.735 -3.649 78 H ALA 11 H ALA 11 -7.230 0.765 -6.282 79 HA ALA 11 HA ALA 11 -8.590 1.814 -3.890 80 HB1 ALA 11 HB1 ALA 11 -9.725 2.526 -5.928 81 HB2 ALA 11 HB2 ALA 11 -10.716 1.415 -4.981 82 HB3 ALA 11 HB3 ALA 11 -9.883 0.841 -6.426 83 H LEU 12 H LEU 12 -9.140 0.390 -2.393 84 HA LEU 12 HA LEU 12 -8.819 -2.475 -3.044 85 HB2 LEU 12 HB2 LEU 12 -8.108 -1.160 -0.426 86 HB3 LEU 12 HB3 LEU 12 -7.807 -2.819 -0.890 87 HG LEU 12 HG LEU 12 -6.470 -0.395 -2.085 88 HD11 LEU 12 HD11 LEU 12 -5.774 -0.871 0.213 89 HD12 LEU 12 HD12 LEU 12 -4.483 -1.208 -0.944 90 HD13 LEU 12 HD13 LEU 12 -5.411 -2.536 -0.246 91 HD21 LEU 12 HD21 LEU 12 -6.724 -2.204 -3.711 92 HD22 LEU 12 HD22 LEU 12 -5.981 -3.331 -2.575 93 HD23 LEU 12 HD23 LEU 12 -5.038 -1.994 -3.235 94 H HIS 13 H HIS 13 -10.336 -3.858 -2.193 95 HA HIS 13 HA HIS 13 -12.774 -2.727 -1.208 96 HB2 HIS 13 HB2 HIS 13 -11.886 -5.615 -1.390 97 HB3 HIS 13 HB3 HIS 13 -13.512 -5.094 -0.959 98 HD1 HIS 13 HD1 HIS 13 -14.894 -3.884 -2.886 99 HD2 HIS 13 HD2 HIS 13 -11.348 -5.713 -4.063 100 HE1 HIS 13 HE1 HIS 13 -14.984 -3.991 -5.397 101 HE2 HIS 13 HE2 HIS 13 -12.820 -5.086 -6.092 102 H GLY 14 H GLY 14 -13.455 -2.472 0.838 103 HA2 GLY 14 HA2 GLY 14 -11.640 -2.492 2.969 104 HA3 GLY 14 HA3 GLY 14 -13.383 -2.363 3.128 105 H GLY 15 H GLY 15 -10.666 -4.260 3.697 106 HA2 GLY 15 HA2 GLY 15 -10.830 -6.048 5.298 107 HA3 GLY 15 HA3 GLY 15 -12.393 -6.467 4.618 108 H GLN 16 H GLN 16 -10.696 -5.857 1.965 109 HA GLN 16 HA GLN 16 -10.247 -8.674 1.474 110 HB2 GLN 16 HB2 GLN 16 -11.021 -6.485 -0.073 111 HB3 GLN 16 HB3 GLN 16 -9.413 -6.886 -0.655 112 HG2 GLN 16 HG2 GLN 16 -11.548 -8.959 -0.338 113 HG3 GLN 16 HG3 GLN 16 -11.395 -7.988 -1.800 114 HE21 GLN 16 HE21 GLN 16 -9.732 -8.371 -3.211 115 HE22 GLN 16 HE22 GLN 16 -8.682 -9.737 -3.064 116 H THR 17 H THR 17 -8.272 -9.592 0.861 117 HA THR 17 HA THR 17 -5.941 -8.197 1.973 118 HB THR 17 HB THR 17 -6.023 -11.080 1.055 119 HG1 THR 17 HG1 THR 17 -7.403 -9.938 3.104 120 HG21 THR 17 HG21 THR 17 -3.825 -10.104 1.568 121 HG22 THR 17 HG22 THR 17 -4.264 -11.356 2.730 122 HG23 THR 17 HG23 THR 17 -4.401 -9.654 3.172 123 H TYR 18 H TYR 18 -4.235 -7.626 0.771 124 HA TYR 18 HA TYR 18 -4.200 -8.386 -2.068 125 HB2 TYR 18 HB2 TYR 18 -3.829 -5.639 -0.875 126 HB3 TYR 18 HB3 TYR 18 -3.370 -6.047 -2.525 127 HD1 TYR 18 HD1 TYR 18 -5.066 -6.541 -4.203 128 HD2 TYR 18 HD2 TYR 18 -6.163 -5.416 -0.249 129 HE1 TYR 18 HE1 TYR 18 -7.358 -6.120 -4.972 130 HE2 TYR 18 HE2 TYR 18 -8.463 -4.986 -1.005 131 HH TYR 18 HH TYR 18 -9.628 -6.002 -4.044 132 H HIS 19 H HIS 19 -2.207 -8.485 -3.039 133 HA HIS 19 HA HIS 19 0.087 -8.706 -1.258 134 HB2 HIS 19 HB2 HIS 19 -0.653 -9.752 -3.927 135 HB3 HIS 19 HB3 HIS 19 1.044 -9.366 -3.702 136 HD1 HIS 19 HD1 HIS 19 -1.060 -12.140 -3.545 137 HD2 HIS 19 HD2 HIS 19 1.840 -10.639 -0.957 138 HE1 HIS 19 HE1 HIS 19 -0.319 -14.093 -2.147 139 HE2 HIS 19 HE2 HIS 19 1.632 -13.221 -0.808 140 H LEU 20 H LEU 20 1.356 -7.058 -0.996 141 HA LEU 20 HA LEU 20 1.376 -4.905 -2.989 142 HB2 LEU 20 HB2 LEU 20 0.567 -4.011 -0.980 143 HB3 LEU 20 HB3 LEU 20 1.647 -4.984 -0.002 144 HG LEU 20 HG LEU 20 3.527 -3.569 -0.615 145 HD11 LEU 20 HD11 LEU 20 1.514 -2.053 -2.264 146 HD12 LEU 20 HD12 LEU 20 2.883 -2.994 -2.866 147 HD13 LEU 20 HD13 LEU 20 3.165 -1.527 -1.927 148 HD21 LEU 20 HD21 LEU 20 2.175 -2.947 1.318 149 HD22 LEU 20 HD22 LEU 20 1.126 -1.979 0.281 150 HD23 LEU 20 HD23 LEU 20 2.813 -1.518 0.506 151 H ILE 21 H ILE 21 3.142 -4.636 -4.116 152 HA ILE 21 HA ILE 21 5.731 -5.447 -2.975 153 HB ILE 21 HB ILE 21 4.891 -5.888 -5.847 154 HG12 ILE 21 HG12 ILE 21 5.440 -8.125 -3.943 155 HG13 ILE 21 HG13 ILE 21 3.864 -7.341 -3.895 156 HG21 ILE 21 HG21 ILE 21 7.360 -6.721 -4.329 157 HG22 ILE 21 HG22 ILE 21 7.270 -5.512 -5.611 158 HG23 ILE 21 HG23 ILE 21 6.968 -7.211 -5.977 159 HD11 ILE 21 HD11 ILE 21 5.103 -8.620 -6.319 160 HD12 ILE 21 HD12 ILE 21 3.505 -7.874 -6.227 161 HD13 ILE 21 HD13 ILE 21 3.854 -9.330 -5.296 162 H VAL 22 H VAL 22 7.147 -3.809 -3.016 163 HA VAL 22 HA VAL 22 6.871 -1.786 -5.138 164 HB VAL 22 HB VAL 22 6.402 -0.836 -2.905 165 HG11 VAL 22 HG11 VAL 22 7.779 -2.238 -1.513 166 HG12 VAL 22 HG12 VAL 22 8.251 -0.552 -1.297 167 HG13 VAL 22 HG13 VAL 22 9.241 -1.625 -2.287 168 HG21 VAL 22 HG21 VAL 22 8.946 0.161 -4.170 169 HG22 VAL 22 HG22 VAL 22 7.916 1.078 -3.066 170 HG23 VAL 22 HG23 VAL 22 7.301 0.588 -4.646 171 H ASP 23 H ASP 23 8.620 -1.438 -6.387 172 HA ASP 23 HA ASP 23 11.244 -2.344 -5.495 173 HB2 ASP 23 HB2 ASP 23 10.226 -4.309 -6.607 174 HB3 ASP 23 HB3 ASP 23 9.966 -3.341 -8.053 175 H THR 24 H THR 24 12.964 -1.560 -6.955 176 HA THR 24 HA THR 24 12.085 0.853 -8.396 177 HB THR 24 HB THR 24 14.456 1.693 -7.926 178 HG1 THR 24 HG1 THR 24 14.291 -0.463 -6.064 179 HG21 THR 24 HG21 THR 24 12.486 2.638 -6.852 180 HG22 THR 24 HG22 THR 24 13.835 2.557 -5.719 181 HG23 THR 24 HG23 THR 24 12.532 1.372 -5.627 182 H ASP 25 H ASP 25 12.886 1.248 -10.397 183 HA ASP 25 HA ASP 25 14.096 -1.000 -11.743 184 HB2 ASP 25 HB2 ASP 25 13.821 0.330 -13.803 185 HB3 ASP 25 HB3 ASP 25 12.323 0.199 -12.890 186 H SER 26 H SER 26 15.757 -0.014 -13.619 187 HA SER 26 HA SER 26 18.173 0.194 -12.198 188 HB2 SER 26 HB2 SER 26 17.905 -0.725 -14.510 189 HB3 SER 26 HB3 SER 26 17.701 0.922 -15.097 190 HG SER 26 HG SER 26 19.934 0.525 -13.520 191 H LEU 27 H LEU 27 15.993 2.640 -13.390 192 HA LEU 27 HA LEU 27 17.959 4.759 -13.242 193 HB2 LEU 27 HB2 LEU 27 14.970 4.995 -13.553 194 HB3 LEU 27 HB3 LEU 27 16.171 6.217 -13.921 195 HG LEU 27 HG LEU 27 15.861 3.603 -15.394 196 HD11 LEU 27 HD11 LEU 27 15.059 6.405 -16.158 197 HD12 LEU 27 HD12 LEU 27 13.971 5.068 -15.783 198 HD13 LEU 27 HD13 LEU 27 14.998 4.995 -17.217 199 HD21 LEU 27 HD21 LEU 27 17.592 6.005 -15.962 200 HD22 LEU 27 HD22 LEU 27 17.413 4.592 -17.001 201 HD23 LEU 27 HD23 LEU 27 18.152 4.428 -15.409 202 H GLY 28 H GLY 28 15.601 3.280 -11.219 203 HA2 GLY 28 HA2 GLY 28 15.781 3.551 -8.837 204 HA3 GLY 28 HA3 GLY 28 16.259 5.222 -9.103 205 H ASN 29 H ASN 29 13.698 4.034 -11.052 206 HA ASN 29 HA ASN 29 11.814 5.744 -9.631 207 HB2 ASN 29 HB2 ASN 29 11.351 4.073 -12.116 208 HB3 ASN 29 HB3 ASN 29 10.278 5.310 -11.479 209 HD21 ASN 29 HD21 ASN 29 13.074 4.622 -13.308 210 HD22 ASN 29 HD22 ASN 29 13.403 6.241 -13.831 211 HA PRO 30 HA PRO 30 10.219 2.252 -7.418 212 HB2 PRO 30 HB2 PRO 30 8.105 3.494 -6.271 213 HB3 PRO 30 HB3 PRO 30 9.768 3.733 -5.717 214 HG2 PRO 30 HG2 PRO 30 8.076 5.474 -7.463 215 HG3 PRO 30 HG3 PRO 30 9.200 5.932 -6.171 216 HD2 PRO 30 HD2 PRO 30 9.815 6.065 -8.832 217 HD3 PRO 30 HD3 PRO 30 11.022 5.833 -7.554 218 H SER 31 H SER 31 8.703 0.732 -7.749 219 HA SER 31 HA SER 31 6.456 1.358 -9.532 220 HB2 SER 31 HB2 SER 31 8.196 0.187 -10.832 221 HB3 SER 31 HB3 SER 31 8.215 -1.114 -9.647 222 HG SER 31 HG SER 31 6.852 -1.879 -11.119 223 H LEU 32 H LEU 32 4.544 0.323 -8.997 224 HA LEU 32 HA LEU 32 4.623 -1.147 -6.453 225 HB2 LEU 32 HB2 LEU 32 3.804 1.297 -6.435 226 HB3 LEU 32 HB3 LEU 32 2.375 0.681 -7.243 227 HG LEU 32 HG LEU 32 2.107 -0.915 -5.299 228 HD11 LEU 32 HD11 LEU 32 4.157 0.928 -4.081 229 HD12 LEU 32 HD12 LEU 32 4.391 -0.778 -4.461 230 HD13 LEU 32 HD13 LEU 32 3.234 -0.301 -3.219 231 HD21 LEU 32 HD21 LEU 32 0.745 1.100 -5.570 232 HD22 LEU 32 HD22 LEU 32 1.969 2.040 -4.714 233 HD23 LEU 32 HD23 LEU 32 1.085 0.767 -3.872 234 H SER 33 H SER 33 3.618 -3.032 -6.447 235 HA SER 33 HA SER 33 1.567 -3.539 -8.494 236 HB2 SER 33 HB2 SER 33 3.615 -5.529 -7.484 237 HB3 SER 33 HB3 SER 33 2.377 -5.831 -8.703 238 HG SER 33 HG SER 33 3.726 -3.698 -9.479 239 H VAL 34 H VAL 34 -0.340 -3.949 -7.585 240 HA VAL 34 HA VAL 34 -0.372 -5.297 -4.967 241 HB VAL 34 HB VAL 34 -2.210 -3.096 -5.934 242 HG11 VAL 34 HG11 VAL 34 -3.378 -3.324 -3.801 243 HG12 VAL 34 HG12 VAL 34 -2.370 -4.711 -3.390 244 HG13 VAL 34 HG13 VAL 34 -3.495 -4.808 -4.745 245 HG21 VAL 34 HG21 VAL 34 -0.045 -2.345 -5.061 246 HG22 VAL 34 HG22 VAL 34 -0.345 -3.236 -3.567 247 HG23 VAL 34 HG23 VAL 34 -1.374 -1.872 -4.002 248 H ILE 35 H ILE 35 -1.348 -7.188 -5.002 249 HA ILE 35 HA ILE 35 -3.264 -7.755 -7.180 250 HB ILE 35 HB ILE 35 -1.678 -9.970 -5.971 251 HG12 ILE 35 HG12 ILE 35 -0.601 -8.088 -8.079 252 HG13 ILE 35 HG13 ILE 35 0.052 -8.318 -6.468 253 HG21 ILE 35 HG21 ILE 35 -2.671 -9.406 -8.760 254 HG22 ILE 35 HG22 ILE 35 -3.498 -10.388 -7.547 255 HG23 ILE 35 HG23 ILE 35 -1.944 -10.916 -8.199 256 HD11 ILE 35 HD11 ILE 35 1.382 -9.470 -8.143 257 HD12 ILE 35 HD12 ILE 35 -0.032 -10.398 -8.640 258 HD13 ILE 35 HD13 ILE 35 0.639 -10.613 -7.023 259 HA PRO 36 HA PRO 36 -6.024 -8.789 -3.804 260 HB2 PRO 36 HB2 PRO 36 -7.792 -10.274 -5.301 261 HB3 PRO 36 HB3 PRO 36 -7.823 -8.514 -5.185 262 HG2 PRO 36 HG2 PRO 36 -6.688 -10.252 -7.332 263 HG3 PRO 36 HG3 PRO 36 -7.579 -8.725 -7.477 264 HD2 PRO 36 HD2 PRO 36 -4.898 -8.857 -7.733 265 HD3 PRO 36 HD3 PRO 36 -5.710 -7.448 -7.019 266 H SER 37 H SER 37 -5.892 -10.399 -2.364 267 HA SER 37 HA SER 37 -4.477 -12.801 -2.979 268 HB2 SER 37 HB2 SER 37 -6.020 -12.040 -0.492 269 HB3 SER 37 HB3 SER 37 -4.899 -13.397 -0.632 270 HG SER 37 HG SER 37 -3.671 -11.209 -1.509 271 H ASN 38 H ASN 38 -7.813 -11.880 -2.718 272 HA ASN 38 HA ASN 38 -8.547 -14.545 -3.726 273 HB2 ASN 38 HB2 ASN 38 -9.514 -14.008 -1.474 274 HB3 ASN 38 HB3 ASN 38 -10.332 -12.629 -2.200 275 HD21 ASN 38 HD21 ASN 38 -11.422 -14.967 -0.858 276 HD22 ASN 38 HD22 ASN 38 -12.492 -15.726 -1.995 277 HA PRO 39 HA PRO 39 -9.040 -11.781 -7.245 278 HB2 PRO 39 HB2 PRO 39 -9.419 -13.758 -9.087 279 HB3 PRO 39 HB3 PRO 39 -7.829 -13.268 -8.493 280 HG2 PRO 39 HG2 PRO 39 -9.526 -15.592 -7.671 281 HG3 PRO 39 HG3 PRO 39 -7.773 -15.521 -7.936 282 HD2 PRO 39 HD2 PRO 39 -8.874 -15.464 -5.465 283 HD3 PRO 39 HD3 PRO 39 -7.369 -14.612 -5.858 284 H TYR 40 H TYR 40 -11.277 -14.232 -6.162 285 HA TYR 40 HA TYR 40 -13.309 -13.460 -8.058 286 HB2 TYR 40 HB2 TYR 40 -13.339 -15.398 -5.747 287 HB3 TYR 40 HB3 TYR 40 -14.729 -15.100 -6.790 288 HD1 TYR 40 HD1 TYR 40 -14.520 -15.601 -9.251 289 HD2 TYR 40 HD2 TYR 40 -11.615 -16.873 -6.415 290 HE1 TYR 40 HE1 TYR 40 -13.666 -17.239 -10.871 291 HE2 TYR 40 HE2 TYR 40 -10.752 -18.516 -8.030 292 HH TYR 40 HH TYR 40 -11.521 -19.735 -10.014 293 H GLN 41 H GLN 41 -12.309 -12.417 -4.965 294 HA GLN 41 HA GLN 41 -14.831 -11.360 -4.120 295 HB2 GLN 41 HB2 GLN 41 -11.992 -10.835 -3.266 296 HB3 GLN 41 HB3 GLN 41 -13.339 -9.917 -2.608 297 HG2 GLN 41 HG2 GLN 41 -13.038 -12.908 -2.467 298 HG3 GLN 41 HG3 GLN 41 -12.668 -11.779 -1.165 299 HE21 GLN 41 HE21 GLN 41 -15.156 -13.369 -2.964 300 HE22 GLN 41 HE22 GLN 41 -16.488 -12.886 -1.960 301 H GLU 42 H GLU 42 -12.269 -10.287 -6.193 302 HA GLU 42 HA GLU 42 -13.062 -7.558 -6.377 303 HB2 GLU 42 HB2 GLU 42 -11.619 -9.253 -8.428 304 HB3 GLU 42 HB3 GLU 42 -11.679 -7.496 -8.389 305 HG2 GLU 42 HG2 GLU 42 -10.364 -9.284 -6.360 306 HG3 GLU 42 HG3 GLU 42 -9.555 -8.291 -7.573 307 H GLN 43 H GLN 43 -14.129 -10.520 -7.826 308 HA GLN 43 HA GLN 43 -15.791 -9.200 -9.798 309 HB2 GLN 43 HB2 GLN 43 -15.708 -12.115 -8.998 310 HB3 GLN 43 HB3 GLN 43 -16.456 -11.445 -10.443 311 HG2 GLN 43 HG2 GLN 43 -14.267 -10.741 -11.255 312 HG3 GLN 43 HG3 GLN 43 -13.515 -11.397 -9.802 313 HE21 GLN 43 HE21 GLN 43 -16.178 -12.930 -11.455 314 HE22 GLN 43 HE22 GLN 43 -15.282 -14.293 -12.044 315 H LEU 44 H LEU 44 -16.168 -11.003 -6.790 316 HA LEU 44 HA LEU 44 -19.037 -10.388 -6.720 317 HB2 LEU 44 HB2 LEU 44 -17.420 -12.115 -4.844 318 HB3 LEU 44 HB3 LEU 44 -19.165 -12.034 -4.960 319 HG LEU 44 HG LEU 44 -17.390 -13.053 -7.176 320 HD11 LEU 44 HD11 LEU 44 -18.089 -15.289 -6.482 321 HD12 LEU 44 HD12 LEU 44 -18.930 -14.597 -5.093 322 HD13 LEU 44 HD13 LEU 44 -17.172 -14.476 -5.212 323 HD21 LEU 44 HD21 LEU 44 -20.364 -13.253 -6.719 324 HD22 LEU 44 HD22 LEU 44 -19.472 -13.967 -8.062 325 HD23 LEU 44 HD23 LEU 44 -19.566 -12.214 -7.900 326 H SER 45 H SER 45 -17.982 -8.083 -6.405 327 HA SER 45 HA SER 45 -16.868 -7.649 -3.782 328 HB2 SER 45 HB2 SER 45 -17.505 -5.618 -5.929 329 HB3 SER 45 HB3 SER 45 -16.459 -5.393 -4.525 330 HG SER 45 HG SER 45 -15.469 -7.475 -5.632 331 H ASP 46 H ASP 46 -18.614 -8.116 -2.401 332 HA ASP 46 HA ASP 46 -20.876 -6.295 -2.382 333 HB2 ASP 46 HB2 ASP 46 -21.618 -7.491 -0.446 334 HB3 ASP 46 HB3 ASP 46 -20.978 -8.699 -1.555 335 H THR 47 H THR 47 -17.687 -6.197 -1.588 336 HA THR 47 HA THR 47 -17.983 -4.348 0.658 337 HB THR 47 HB THR 47 -15.367 -4.583 0.535 338 HG1 THR 47 HG1 THR 47 -15.727 -7.172 -0.303 339 HG21 THR 47 HG21 THR 47 -15.470 -6.526 2.020 340 HG22 THR 47 HG22 THR 47 -17.119 -6.853 1.486 341 HG23 THR 47 HG23 THR 47 -16.760 -5.382 2.393 342 HA PRO 48 HA PRO 48 -17.388 -0.931 -2.123 343 HB2 PRO 48 HB2 PRO 48 -16.789 0.948 -0.241 344 HB3 PRO 48 HB3 PRO 48 -18.432 0.380 -0.560 345 HG2 PRO 48 HG2 PRO 48 -16.531 -0.432 1.607 346 HG3 PRO 48 HG3 PRO 48 -18.273 -0.110 1.706 347 HD2 PRO 48 HD2 PRO 48 -17.271 -2.617 1.609 348 HD3 PRO 48 HD3 PRO 48 -18.834 -2.191 0.879 349 H LEU 49 H LEU 49 -15.718 0.389 -2.930 350 HA LEU 49 HA LEU 49 -13.049 -0.577 -2.302 351 HB2 LEU 49 HB2 LEU 49 -14.198 1.037 -4.549 352 HB3 LEU 49 HB3 LEU 49 -12.470 0.993 -4.269 353 HG LEU 49 HG LEU 49 -14.188 -1.424 -4.834 354 HD11 LEU 49 HD11 LEU 49 -12.224 0.058 -6.577 355 HD12 LEU 49 HD12 LEU 49 -13.981 0.061 -6.770 356 HD13 LEU 49 HD13 LEU 49 -13.071 -1.433 -7.002 357 HD21 LEU 49 HD21 LEU 49 -12.051 -2.580 -5.060 358 HD22 LEU 49 HD22 LEU 49 -12.235 -1.910 -3.439 359 HD23 LEU 49 HD23 LEU 49 -11.195 -1.104 -4.613 360 H ILE 50 H ILE 50 -11.853 0.427 -0.889 361 HA ILE 50 HA ILE 50 -12.232 3.274 -0.374 362 HB ILE 50 HB ILE 50 -10.284 1.337 0.899 363 HG12 ILE 50 HG12 ILE 50 -12.860 2.439 2.044 364 HG13 ILE 50 HG13 ILE 50 -12.725 0.848 1.302 365 HG21 ILE 50 HG21 ILE 50 -10.072 3.106 2.625 366 HG22 ILE 50 HG22 ILE 50 -11.082 4.157 1.629 367 HG23 ILE 50 HG23 ILE 50 -9.510 3.626 1.036 368 HD11 ILE 50 HD11 ILE 50 -11.209 1.787 3.725 369 HD12 ILE 50 HD12 ILE 50 -11.123 0.180 3.003 370 HD13 ILE 50 HD13 ILE 50 -12.627 0.739 3.736 371 HA PRO 51 HA PRO 51 -8.899 3.965 -3.213 372 HB2 PRO 51 HB2 PRO 51 -9.027 6.674 -3.184 373 HB3 PRO 51 HB3 PRO 51 -10.186 5.664 -4.051 374 HG2 PRO 51 HG2 PRO 51 -10.555 7.239 -1.620 375 HG3 PRO 51 HG3 PRO 51 -11.769 6.564 -2.709 376 HD2 PRO 51 HD2 PRO 51 -10.859 5.558 -0.166 377 HD3 PRO 51 HD3 PRO 51 -12.158 4.935 -1.191 378 H LEU 52 H LEU 52 -6.762 4.212 -2.975 379 HA LEU 52 HA LEU 52 -5.796 5.546 -0.549 380 HB2 LEU 52 HB2 LEU 52 -4.970 2.845 -1.595 381 HB3 LEU 52 HB3 LEU 52 -4.042 3.738 -0.398 382 HG LEU 52 HG LEU 52 -6.448 3.728 0.810 383 HD11 LEU 52 HD11 LEU 52 -7.464 1.526 0.561 384 HD12 LEU 52 HD12 LEU 52 -6.341 1.155 -0.748 385 HD13 LEU 52 HD13 LEU 52 -7.529 2.446 -0.942 386 HD21 LEU 52 HD21 LEU 52 -4.383 3.037 1.835 387 HD22 LEU 52 HD22 LEU 52 -4.385 1.537 0.905 388 HD23 LEU 52 HD23 LEU 52 -5.628 1.824 2.124 389 H THR 53 H THR 53 -4.244 6.940 -0.871 390 HA THR 53 HA THR 53 -2.891 6.982 -3.492 391 HB THR 53 HB THR 53 -3.052 9.229 -1.468 392 HG1 THR 53 HG1 THR 53 -5.076 8.259 -2.728 393 HG21 THR 53 HG21 THR 53 -2.548 10.633 -3.428 394 HG22 THR 53 HG22 THR 53 -2.411 9.179 -4.418 395 HG23 THR 53 HG23 THR 53 -1.269 9.464 -3.103 396 H ILE 54 H ILE 54 -0.876 6.224 -3.472 397 HA ILE 54 HA ILE 54 0.565 6.233 -0.906 398 HB ILE 54 HB ILE 54 0.981 4.415 -3.283 399 HG12 ILE 54 HG12 ILE 54 -0.365 3.968 -0.609 400 HG13 ILE 54 HG13 ILE 54 -1.113 3.893 -2.200 401 HG21 ILE 54 HG21 ILE 54 2.464 3.166 -1.784 402 HG22 ILE 54 HG22 ILE 54 2.221 4.387 -0.535 403 HG23 ILE 54 HG23 ILE 54 3.033 4.815 -2.041 404 HD11 ILE 54 HD11 ILE 54 -0.738 1.676 -1.258 405 HD12 ILE 54 HD12 ILE 54 0.991 2.012 -1.162 406 HD13 ILE 54 HD13 ILE 54 0.197 1.922 -2.734 407 H PHE 55 H PHE 55 2.274 7.441 -0.720 408 HA PHE 55 HA PHE 55 3.605 8.456 -3.147 409 HB2 PHE 55 HB2 PHE 55 3.522 9.614 -0.353 410 HB3 PHE 55 HB3 PHE 55 4.517 10.232 -1.663 411 HD1 PHE 55 HD1 PHE 55 1.044 9.753 -0.518 412 HD2 PHE 55 HD2 PHE 55 3.630 11.649 -3.315 413 HE1 PHE 55 HE1 PHE 55 -0.803 11.212 -1.231 414 HE2 PHE 55 HE2 PHE 55 1.788 13.116 -4.029 415 HZ PHE 55 HZ PHE 55 -0.433 12.898 -2.988 416 H VAL 56 H VAL 56 5.747 8.150 -3.405 417 HA VAL 56 HA VAL 56 7.089 6.334 -1.585 418 HB VAL 56 HB VAL 56 7.297 6.000 -4.027 419 HG11 VAL 56 HG11 VAL 56 8.738 8.639 -3.971 420 HG12 VAL 56 HG12 VAL 56 7.198 8.293 -4.758 421 HG13 VAL 56 HG13 VAL 56 8.679 7.537 -5.347 422 HG21 VAL 56 HG21 VAL 56 9.055 5.184 -2.557 423 HG22 VAL 56 HG22 VAL 56 9.881 6.738 -2.666 424 HG23 VAL 56 HG23 VAL 56 9.730 5.718 -4.096 425 H GLY 57 H GLY 57 8.882 6.849 -0.339 426 HA2 GLY 57 HA2 GLY 57 9.388 9.728 -0.030 427 HA3 GLY 57 HA3 GLY 57 9.719 8.500 1.179 428 H GLU 58 H GLU 58 11.813 9.689 1.215 429 HA GLU 58 HA GLU 58 13.577 8.830 -0.969 430 HB2 GLU 58 HB2 GLU 58 15.121 10.651 0.044 431 HB3 GLU 58 HB3 GLU 58 13.764 11.128 -0.960 432 HG2 GLU 58 HG2 GLU 58 13.850 12.607 0.885 433 HG3 GLU 58 HG3 GLU 58 12.461 11.554 1.117 434 H ASN 59 H ASN 59 15.956 9.374 0.463 435 HA ASN 59 HA ASN 59 16.742 6.883 1.176 436 HB2 ASN 59 HB2 ASN 59 18.305 8.648 0.750 437 HB3 ASN 59 HB3 ASN 59 17.748 9.546 2.155 438 HD21 ASN 59 HD21 ASN 59 19.607 6.827 1.037 439 HD22 ASN 59 HD22 ASN 59 20.431 6.520 2.528 440 H THR 60 H THR 60 15.459 9.332 3.434 441 HA THR 60 HA THR 60 14.966 9.230 5.670 442 HB THR 60 HB THR 60 13.516 7.164 6.246 443 HG1 THR 60 HG1 THR 60 13.940 6.814 3.454 444 HG21 THR 60 HG21 THR 60 12.722 9.026 4.010 445 HG22 THR 60 HG22 THR 60 12.580 9.348 5.738 446 HG23 THR 60 HG23 THR 60 11.612 8.076 4.997 447 H GLY 61 H GLY 61 17.526 8.712 5.639 448 HA2 GLY 61 HA2 GLY 61 18.078 6.098 6.802 449 HA3 GLY 61 HA3 GLY 61 19.268 7.298 6.323 450 H VAL 62 H VAL 62 17.626 5.888 8.882 451 HA VAL 62 HA VAL 62 18.930 7.758 10.705 452 HB VAL 62 HB VAL 62 16.650 8.490 10.784 453 HG11 VAL 62 HG11 VAL 62 14.778 7.024 11.345 454 HG12 VAL 62 HG12 VAL 62 15.861 5.632 11.317 455 HG13 VAL 62 HG13 VAL 62 15.553 6.539 9.835 456 HG21 VAL 62 HG21 VAL 62 17.801 8.416 12.919 457 HG22 VAL 62 HG22 VAL 62 17.250 6.762 13.179 458 HG23 VAL 62 HG23 VAL 62 16.083 8.084 13.131 459 H1 GLY 1 H1 GLY 1 -6.117 21.020 -1.282 460 H2 GLY 1 H2 GLY 1 -7.192 22.289 -0.963 461 H3 GLY 1 H3 GLY 1 -7.735 20.906 -1.769 462 HA2 GLY 1 HA2 GLY 1 -7.304 19.569 0.209 463 HA3 GLY 1 HA3 GLY 1 -6.805 21.039 1.041 464 H ALA 2 H ALA 2 -9.108 19.039 1.318 465 HA ALA 2 HA ALA 2 -11.234 21.072 1.486 466 HB1 ALA 2 HB1 ALA 2 -11.662 19.637 -0.445 467 HB2 ALA 2 HB2 ALA 2 -12.877 19.399 0.811 468 HB3 ALA 2 HB3 ALA 2 -11.590 18.214 0.592 469 H MET 3 H MET 3 -10.428 17.746 2.465 470 HA MET 3 HA MET 3 -11.189 18.439 5.217 471 HB2 MET 3 HB2 MET 3 -12.057 15.983 3.682 472 HB3 MET 3 HB3 MET 3 -12.156 16.113 5.432 473 HG2 MET 3 HG2 MET 3 -13.640 18.062 5.172 474 HG3 MET 3 HG3 MET 3 -13.591 17.834 3.425 475 HE1 MET 3 HE1 MET 3 -13.646 15.003 6.164 476 HE2 MET 3 HE2 MET 3 -15.380 14.745 6.357 477 HE3 MET 3 HE3 MET 3 -14.654 16.270 6.865 478 H GLU 4 H GLU 4 -10.112 17.248 6.833 479 HA GLU 4 HA GLU 4 -7.451 16.465 6.106 480 HB2 GLU 4 HB2 GLU 4 -8.907 16.400 8.754 481 HB3 GLU 4 HB3 GLU 4 -7.206 16.013 8.554 482 HG2 GLU 4 HG2 GLU 4 -6.759 18.259 7.763 483 HG3 GLU 4 HG3 GLU 4 -8.470 18.658 7.881 484 H MET 5 H MET 5 -6.566 14.469 6.043 485 HA MET 5 HA MET 5 -8.396 12.185 6.380 486 HB2 MET 5 HB2 MET 5 -7.298 11.143 4.403 487 HB3 MET 5 HB3 MET 5 -8.193 12.604 4.007 488 HG2 MET 5 HG2 MET 5 -6.116 13.869 3.954 489 HG3 MET 5 HG3 MET 5 -5.211 12.422 4.386 490 HE1 MET 5 HE1 MET 5 -8.310 12.570 1.984 491 HE2 MET 5 HE2 MET 5 -7.540 12.819 0.416 492 HE3 MET 5 HE3 MET 5 -7.501 14.097 1.633 493 HA PRO 6 HA PRO 6 -5.313 10.470 8.911 494 HB2 PRO 6 HB2 PRO 6 -6.350 7.825 8.354 495 HB3 PRO 6 HB3 PRO 6 -6.498 8.803 9.809 496 HG2 PRO 6 HG2 PRO 6 -8.581 8.211 8.134 497 HG3 PRO 6 HG3 PRO 6 -8.532 9.586 9.248 498 HD2 PRO 6 HD2 PRO 6 -8.111 9.507 6.311 499 HD3 PRO 6 HD3 PRO 6 -8.804 10.786 7.331 500 H THR 7 H THR 7 -3.313 9.679 8.664 501 HA THR 7 HA THR 7 -2.608 8.756 5.948 502 HB THR 7 HB THR 7 -0.803 10.226 7.866 503 HG1 THR 7 HG1 THR 7 -2.920 11.187 6.583 504 HG21 THR 7 HG21 THR 7 -0.669 9.815 4.876 505 HG22 THR 7 HG22 THR 7 0.317 8.979 6.077 506 HG23 THR 7 HG23 THR 7 0.492 10.719 5.849 507 H PHE 8 H PHE 8 -1.093 7.118 5.723 508 HA PHE 8 HA PHE 8 -0.172 5.794 8.194 509 HB2 PHE 8 HB2 PHE 8 -0.964 4.517 5.563 510 HB3 PHE 8 HB3 PHE 8 -0.234 3.664 6.914 511 HD1 PHE 8 HD1 PHE 8 -3.232 5.450 5.758 512 HD2 PHE 8 HD2 PHE 8 -1.543 2.998 8.794 513 HE1 PHE 8 HE1 PHE 8 -5.480 5.057 6.684 514 HE2 PHE 8 HE2 PHE 8 -3.789 2.595 9.726 515 HZ PHE 8 HZ PHE 8 -5.758 3.629 8.672 516 H TYR 9 H TYR 9 1.972 5.236 8.279 517 HA TYR 9 HA TYR 9 3.574 5.743 5.849 518 HB2 TYR 9 HB2 TYR 9 3.682 7.479 7.809 519 HB3 TYR 9 HB3 TYR 9 4.657 6.252 8.607 520 HD1 TYR 9 HD1 TYR 9 6.826 5.533 7.531 521 HD2 TYR 9 HD2 TYR 9 4.573 8.857 6.126 522 HE1 TYR 9 HE1 TYR 9 8.810 6.368 6.334 523 HE2 TYR 9 HE2 TYR 9 6.543 9.699 4.930 524 HH TYR 9 HH TYR 9 8.959 9.512 4.991 525 H LEU 10 H LEU 10 4.693 4.007 5.243 526 HA LEU 10 HA LEU 10 5.655 2.141 7.270 527 HB2 LEU 10 HB2 LEU 10 4.914 0.235 5.732 528 HB3 LEU 10 HB3 LEU 10 3.705 1.003 6.739 529 HG LEU 10 HG LEU 10 3.183 2.423 4.631 530 HD11 LEU 10 HD11 LEU 10 5.117 1.718 3.320 531 HD12 LEU 10 HD12 LEU 10 3.601 1.290 2.525 532 HD13 LEU 10 HD13 LEU 10 4.538 0.052 3.362 533 HD21 LEU 10 HD21 LEU 10 1.655 0.827 5.613 534 HD22 LEU 10 HD22 LEU 10 2.492 -0.502 4.810 535 HD23 LEU 10 HD23 LEU 10 1.621 0.700 3.853 536 H ALA 11 H ALA 11 7.324 0.677 6.476 537 HA ALA 11 HA ALA 11 8.688 1.742 4.084 538 HB1 ALA 11 HB1 ALA 11 9.832 2.441 6.123 539 HB2 ALA 11 HB2 ALA 11 10.820 1.336 5.166 540 HB3 ALA 11 HB3 ALA 11 9.990 0.754 6.609 541 H LEU 12 H LEU 12 9.233 0.322 2.582 542 HA LEU 12 HA LEU 12 8.901 -2.542 3.221 543 HB2 LEU 12 HB2 LEU 12 8.182 -1.218 0.607 544 HB3 LEU 12 HB3 LEU 12 7.881 -2.876 1.073 545 HG LEU 12 HG LEU 12 6.554 -0.449 2.275 546 HD11 LEU 12 HD11 LEU 12 5.851 -0.910 -0.023 547 HD12 LEU 12 HD12 LEU 12 4.558 -1.245 1.133 548 HD13 LEU 12 HD13 LEU 12 5.479 -2.575 0.428 549 HD21 LEU 12 HD21 LEU 12 6.807 -2.265 3.896 550 HD22 LEU 12 HD22 LEU 12 6.055 -3.385 2.758 551 HD23 LEU 12 HD23 LEU 12 5.119 -2.049 3.427 552 H HIS 13 H HIS 13 10.404 -3.928 2.364 553 HA HIS 13 HA HIS 13 12.845 -2.803 1.373 554 HB2 HIS 13 HB2 HIS 13 11.948 -5.691 1.542 555 HB3 HIS 13 HB3 HIS 13 13.574 -5.171 1.112 556 HD1 HIS 13 HD1 HIS 13 14.961 -3.978 3.038 557 HD2 HIS 13 HD2 HIS 13 11.415 -5.795 4.219 558 HE1 HIS 13 HE1 HIS 13 15.062 -4.099 5.551 559 HE2 HIS 13 HE2 HIS 13 12.888 -5.167 6.250 560 H GLY 14 H GLY 14 13.522 -2.536 -0.670 561 HA2 GLY 14 HA2 GLY 14 11.706 -2.538 -2.798 562 HA3 GLY 14 HA3 GLY 14 13.450 -2.422 -2.960 563 H GLY 15 H GLY 15 10.717 -4.301 -3.537 564 HA2 GLY 15 HA2 GLY 15 10.871 -6.092 -5.141 565 HA3 GLY 15 HA3 GLY 15 12.436 -6.515 -4.463 566 H GLN 16 H GLN 16 10.747 -5.910 -1.807 567 HA GLN 16 HA GLN 16 10.279 -8.724 -1.333 568 HB2 GLN 16 HB2 GLN 16 11.071 -6.547 0.224 569 HB3 GLN 16 HB3 GLN 16 9.461 -6.944 0.810 570 HG2 GLN 16 HG2 GLN 16 11.593 -9.023 0.477 571 HG3 GLN 16 HG3 GLN 16 11.442 -8.060 1.945 572 HE21 GLN 16 HE21 GLN 16 9.785 -8.445 3.358 573 HE22 GLN 16 HE22 GLN 16 8.734 -9.809 3.210 574 H THR 17 H THR 17 8.304 -9.634 -0.718 575 HA THR 17 HA THR 17 5.973 -8.231 -1.817 576 HB THR 17 HB THR 17 6.047 -11.115 -0.901 577 HG1 THR 17 HG1 THR 17 7.422 -9.965 -2.955 578 HG21 THR 17 HG21 THR 17 3.854 -10.128 -1.417 579 HG22 THR 17 HG22 THR 17 4.290 -11.376 -2.585 580 HG23 THR 17 HG23 THR 17 4.436 -9.674 -3.019 581 H TYR 18 H TYR 18 4.282 -7.652 -0.605 582 HA TYR 18 HA TYR 18 4.249 -8.431 2.228 583 HB2 TYR 18 HB2 TYR 18 3.889 -5.676 1.048 584 HB3 TYR 18 HB3 TYR 18 3.432 -6.087 2.697 585 HD1 TYR 18 HD1 TYR 18 5.131 -6.599 4.366 586 HD2 TYR 18 HD2 TYR 18 6.217 -5.460 0.417 587 HE1 TYR 18 HE1 TYR 18 7.426 -6.186 5.132 588 HE2 TYR 18 HE2 TYR 18 8.521 -5.040 1.164 589 HH TYR 18 HH TYR 18 9.686 -6.066 4.213 590 H HIS 19 H HIS 19 2.253 -8.515 3.206 591 HA HIS 19 HA HIS 19 -0.046 -8.725 1.427 592 HB2 HIS 19 HB2 HIS 19 0.697 -9.786 4.090 593 HB3 HIS 19 HB3 HIS 19 -1.001 -9.395 3.872 594 HD1 HIS 19 HD1 HIS 19 1.081 -12.176 3.707 595 HD2 HIS 19 HD2 HIS 19 -1.805 -10.650 1.122 596 HE1 HIS 19 HE1 HIS 19 0.343 -14.117 2.292 597 HE2 HIS 19 HE2 HIS 19 -1.616 -13.235 0.978 598 H LEU 20 H LEU 20 -1.307 -7.071 1.177 599 HA LEU 20 HA LEU 20 -1.312 -4.928 3.179 600 HB2 LEU 20 HB2 LEU 20 -0.502 -4.025 1.170 601 HB3 LEU 20 HB3 LEU 20 -1.589 -4.989 0.191 602 HG LEU 20 HG LEU 20 -3.462 -3.566 0.815 603 HD11 LEU 20 HD11 LEU 20 -1.440 -2.065 2.464 604 HD12 LEU 20 HD12 LEU 20 -2.812 -3.001 3.064 605 HD13 LEU 20 HD13 LEU 20 -3.089 -1.530 2.129 606 HD21 LEU 20 HD21 LEU 20 -2.111 -2.941 -1.118 607 HD22 LEU 20 HD22 LEU 20 -1.053 -1.985 -0.079 608 HD23 LEU 20 HD23 LEU 20 -2.739 -1.512 -0.297 609 H ILE 21 H ILE 21 -3.073 -4.656 4.310 610 HA ILE 21 HA ILE 21 -5.667 -5.450 3.170 611 HB ILE 21 HB ILE 21 -4.825 -5.905 6.041 612 HG12 ILE 21 HG12 ILE 21 -5.387 -8.137 4.130 613 HG13 ILE 21 HG13 ILE 21 -3.810 -7.357 4.080 614 HG21 ILE 21 HG21 ILE 21 -7.302 -6.721 4.524 615 HG22 ILE 21 HG22 ILE 21 -7.201 -5.521 5.810 616 HG23 ILE 21 HG23 ILE 21 -6.907 -7.222 6.168 617 HD11 ILE 21 HD11 ILE 21 -5.046 -8.638 6.501 618 HD12 ILE 21 HD12 ILE 21 -3.445 -7.899 6.408 619 HD13 ILE 21 HD13 ILE 21 -3.802 -9.352 5.473 620 H VAL 22 H VAL 22 -7.081 -3.807 3.223 621 HA VAL 22 HA VAL 22 -6.782 -1.792 5.348 622 HB VAL 22 HB VAL 22 -6.318 -0.834 3.118 623 HG11 VAL 22 HG11 VAL 22 -7.713 -2.223 1.722 624 HG12 VAL 22 HG12 VAL 22 -8.175 -0.532 1.515 625 HG13 VAL 22 HG13 VAL 22 -9.165 -1.603 2.509 626 HG21 VAL 22 HG21 VAL 22 -8.852 0.172 4.393 627 HG22 VAL 22 HG22 VAL 22 -7.822 1.089 3.292 628 HG23 VAL 22 HG23 VAL 22 -7.205 0.589 4.869 629 H ASP 23 H ASP 23 -8.518 -1.451 6.614 630 HA ASP 23 HA ASP 23 -11.151 -2.325 5.714 631 HB2 ASP 23 HB2 ASP 23 -10.154 -4.304 6.824 632 HB3 ASP 23 HB3 ASP 23 -9.890 -3.345 8.274 633 H THR 24 H THR 24 -12.864 -1.568 7.224 634 HA THR 24 HA THR 24 -11.983 0.866 8.633 635 HB THR 24 HB THR 24 -14.368 1.696 8.162 636 HG1 THR 24 HG1 THR 24 -14.160 -0.434 6.286 637 HG21 THR 24 HG21 THR 24 -12.389 2.650 7.097 638 HG22 THR 24 HG22 THR 24 -13.737 2.575 5.963 639 HG23 THR 24 HG23 THR 24 -12.436 1.391 5.864 640 H ASP 25 H ASP 25 -12.768 1.244 10.640 641 HA ASP 25 HA ASP 25 -13.988 -1.000 11.977 642 HB2 ASP 25 HB2 ASP 25 -13.709 0.324 14.042 643 HB3 ASP 25 HB3 ASP 25 -12.213 0.187 13.130 644 H SER 26 H SER 26 -15.651 -0.038 13.847 645 HA SER 26 HA SER 26 -18.067 0.204 12.447 646 HB2 SER 26 HB2 SER 26 -17.807 -0.724 14.751 647 HB3 SER 26 HB3 SER 26 -17.556 0.913 15.347 648 HG SER 26 HG SER 26 -19.829 0.522 13.807 649 H LEU 27 H LEU 27 -15.870 2.642 13.642 650 HA LEU 27 HA LEU 27 -17.825 4.775 13.514 651 HB2 LEU 27 HB2 LEU 27 -14.834 4.989 13.817 652 HB3 LEU 27 HB3 LEU 27 -16.025 6.218 14.196 653 HG LEU 27 HG LEU 27 -15.720 3.590 15.650 654 HD11 LEU 27 HD11 LEU 27 -14.910 6.386 16.431 655 HD12 LEU 27 HD12 LEU 27 -13.826 5.047 16.049 656 HD13 LEU 27 HD13 LEU 27 -14.853 4.969 17.482 657 HD21 LEU 27 HD21 LEU 27 -17.440 5.998 16.229 658 HD22 LEU 27 HD22 LEU 27 -17.267 4.582 17.265 659 HD23 LEU 27 HD23 LEU 27 -18.009 4.425 15.673 660 H GLY 28 H GLY 28 -15.464 3.299 11.483 661 HA2 GLY 28 HA2 GLY 28 -15.665 3.576 9.095 662 HA3 GLY 28 HA3 GLY 28 -16.128 5.248 9.372 663 H ASN 29 H ASN 29 -13.573 4.051 11.313 664 HA ASN 29 HA ASN 29 -11.680 5.749 9.893 665 HB2 ASN 29 HB2 ASN 29 -11.218 4.059 12.366 666 HB3 ASN 29 HB3 ASN 29 -10.146 5.298 11.732 667 HD21 ASN 29 HD21 ASN 29 -12.950 4.617 13.566 668 HD22 ASN 29 HD22 ASN 29 -13.261 6.237 14.098 669 HA PRO 30 HA PRO 30 -10.110 2.255 7.654 670 HB2 PRO 30 HB2 PRO 30 -7.994 3.490 6.511 671 HB3 PRO 30 HB3 PRO 30 -9.654 3.738 5.962 672 HG2 PRO 30 HG2 PRO 30 -7.955 5.467 7.704 673 HG3 PRO 30 HG3 PRO 30 -9.081 5.929 6.417 674 HD2 PRO 30 HD2 PRO 30 -9.677 6.058 9.084 675 HD3 PRO 30 HD3 PRO 30 -10.893 5.846 7.810 676 H SER 31 H SER 31 -8.597 0.725 7.973 677 HA SER 31 HA SER 31 -6.349 1.331 9.759 678 HB2 SER 31 HB2 SER 31 -8.100 0.164 11.054 679 HB3 SER 31 HB3 SER 31 -8.112 -1.135 9.867 680 HG SER 31 HG SER 31 -6.735 -1.933 11.287 681 H LEU 32 H LEU 32 -4.445 0.293 9.219 682 HA LEU 32 HA LEU 32 -4.534 -1.167 6.668 683 HB2 LEU 32 HB2 LEU 32 -3.696 1.274 6.653 684 HB3 LEU 32 HB3 LEU 32 -2.270 0.645 7.456 685 HG LEU 32 HG LEU 32 -2.017 -0.944 5.507 686 HD11 LEU 32 HD11 LEU 32 -4.061 0.916 4.302 687 HD12 LEU 32 HD12 LEU 32 -4.304 -0.791 4.670 688 HD13 LEU 32 HD13 LEU 32 -3.144 -0.312 3.431 689 HD21 LEU 32 HD21 LEU 32 -0.643 1.058 5.788 690 HD22 LEU 32 HD22 LEU 32 -1.863 2.010 4.939 691 HD23 LEU 32 HD23 LEU 32 -0.987 0.738 4.088 692 H SER 33 H SER 33 -3.537 -3.054 6.648 693 HA SER 33 HA SER 33 -1.480 -3.590 8.686 694 HB2 SER 33 HB2 SER 33 -3.548 -5.562 7.677 695 HB3 SER 33 HB3 SER 33 -2.303 -5.880 8.886 696 HG SER 33 HG SER 33 -3.635 -3.736 9.670 697 H VAL 34 H VAL 34 0.415 -4.007 7.772 698 HA VAL 34 HA VAL 34 0.447 -5.341 5.149 699 HB VAL 34 HB VAL 34 2.289 -3.146 6.123 700 HG11 VAL 34 HG11 VAL 34 3.448 -3.366 3.991 701 HG12 VAL 34 HG12 VAL 34 2.434 -4.747 3.573 702 HG13 VAL 34 HG13 VAL 34 3.561 -4.859 4.925 703 HG21 VAL 34 HG21 VAL 34 0.125 -2.384 5.259 704 HG22 VAL 34 HG22 VAL 34 0.413 -3.275 3.765 705 HG23 VAL 34 HG23 VAL 34 1.452 -1.915 4.195 706 H ILE 35 H ILE 35 1.411 -7.227 5.175 707 HA ILE 35 HA ILE 35 3.327 -7.819 7.345 708 HB ILE 35 HB ILE 35 1.729 -10.021 6.130 709 HG12 ILE 35 HG12 ILE 35 0.667 -8.137 8.247 710 HG13 ILE 35 HG13 ILE 35 0.007 -8.361 6.636 711 HG21 ILE 35 HG21 ILE 35 2.740 -9.475 8.914 712 HG22 ILE 35 HG22 ILE 35 3.548 -10.462 7.696 713 HG23 ILE 35 HG23 ILE 35 1.990 -10.974 8.356 714 HD11 ILE 35 HD11 ILE 35 -1.324 -9.509 8.316 715 HD12 ILE 35 HD12 ILE 35 0.087 -10.454 8.796 716 HD13 ILE 35 HD13 ILE 35 -0.598 -10.648 7.184 717 HA PRO 36 HA PRO 36 6.074 -8.846 3.967 718 HB2 PRO 36 HB2 PRO 36 7.841 -10.344 5.446 719 HB3 PRO 36 HB3 PRO 36 7.874 -8.581 5.345 720 HG2 PRO 36 HG2 PRO 36 6.740 -10.335 7.480 721 HG3 PRO 36 HG3 PRO 36 7.640 -8.816 7.636 722 HD2 PRO 36 HD2 PRO 36 4.957 -8.925 7.898 723 HD3 PRO 36 HD3 PRO 36 5.777 -7.520 7.186 724 H SER 37 H SER 37 5.932 -10.447 2.517 725 HA SER 37 HA SER 37 4.507 -12.847 3.118 726 HB2 SER 37 HB2 SER 37 6.054 -12.076 0.637 727 HB3 SER 37 HB3 SER 37 4.925 -13.428 0.765 728 HG SER 37 HG SER 37 3.703 -11.253 1.661 729 H ASN 38 H ASN 38 7.849 -11.939 2.856 730 HA ASN 38 HA ASN 38 8.569 -14.617 3.849 731 HB2 ASN 38 HB2 ASN 38 9.538 -14.083 1.602 732 HB3 ASN 38 HB3 ASN 38 10.356 -12.701 2.319 733 HD21 ASN 38 HD21 ASN 38 11.432 -15.049 0.984 734 HD22 ASN 38 HD22 ASN 38 12.508 -15.795 2.116 735 HA PRO 39 HA PRO 39 9.087 -11.872 7.378 736 HB2 PRO 39 HB2 PRO 39 9.467 -13.860 9.210 737 HB3 PRO 39 HB3 PRO 39 7.877 -13.361 8.623 738 HG2 PRO 39 HG2 PRO 39 9.560 -15.686 7.786 739 HG3 PRO 39 HG3 PRO 39 7.810 -15.608 8.057 740 HD2 PRO 39 HD2 PRO 39 8.899 -15.545 5.584 741 HD3 PRO 39 HD3 PRO 39 7.400 -14.685 5.988 742 H TYR 40 H TYR 40 11.309 -14.333 6.278 743 HA TYR 40 HA TYR 40 13.351 -13.574 8.171 744 HB2 TYR 40 HB2 TYR 40 13.363 -15.506 5.850 745 HB3 TYR 40 HB3 TYR 40 14.757 -15.219 6.890 746 HD1 TYR 40 HD1 TYR 40 14.547 -15.719 9.357 747 HD2 TYR 40 HD2 TYR 40 11.640 -16.969 6.515 748 HE1 TYR 40 HE1 TYR 40 13.680 -17.358 10.973 749 HE2 TYR 40 HE2 TYR 40 10.764 -18.609 8.121 750 HH TYR 40 HH TYR 40 11.620 -19.863 10.127 751 H GLN 41 H GLN 41 12.342 -12.508 5.086 752 HA GLN 41 HA GLN 41 14.867 -11.460 4.242 753 HB2 GLN 41 HB2 GLN 41 12.031 -10.915 3.396 754 HB3 GLN 41 HB3 GLN 41 13.388 -10.010 2.736 755 HG2 GLN 41 HG2 GLN 41 13.071 -13.000 2.594 756 HG3 GLN 41 HG3 GLN 41 12.695 -11.870 1.292 757 HE21 GLN 41 HE21 GLN 41 15.196 -13.457 3.083 758 HE22 GLN 41 HE22 GLN 41 16.514 -12.986 2.067 759 H GLU 42 H GLU 42 12.316 -10.387 6.328 760 HA GLU 42 HA GLU 42 13.118 -7.665 6.516 761 HB2 GLU 42 HB2 GLU 42 11.673 -9.354 8.572 762 HB3 GLU 42 HB3 GLU 42 11.740 -7.599 8.534 763 HG2 GLU 42 HG2 GLU 42 10.414 -9.378 6.502 764 HG3 GLU 42 HG3 GLU 42 9.610 -8.387 7.716 765 H GLN 43 H GLN 43 14.179 -10.634 7.955 766 HA GLN 43 HA GLN 43 15.853 -9.326 9.930 767 HB2 GLN 43 HB2 GLN 43 15.757 -12.237 9.117 768 HB3 GLN 43 HB3 GLN 43 16.510 -11.576 10.563 769 HG2 GLN 43 HG2 GLN 43 14.325 -10.869 11.385 770 HG3 GLN 43 HG3 GLN 43 13.569 -11.518 9.933 771 HE21 GLN 43 HE21 GLN 43 16.237 -13.080 11.557 772 HE22 GLN 43 HE22 GLN 43 15.330 -14.426 12.156 773 H LEU 44 H LEU 44 16.213 -11.120 6.912 774 HA LEU 44 HA LEU 44 19.085 -10.524 6.835 775 HB2 LEU 44 HB2 LEU 44 17.451 -12.238 4.961 776 HB3 LEU 44 HB3 LEU 44 19.199 -12.167 5.068 777 HG LEU 44 HG LEU 44 17.427 -13.182 7.286 778 HD11 LEU 44 HD11 LEU 44 18.118 -15.413 6.579 779 HD12 LEU 44 HD12 LEU 44 18.961 -14.714 5.194 780 HD13 LEU 44 HD13 LEU 44 17.204 -14.589 5.314 781 HD21 LEU 44 HD21 LEU 44 20.398 -13.393 6.820 782 HD22 LEU 44 HD22 LEU 44 19.505 -14.108 8.160 783 HD23 LEU 44 HD23 LEU 44 19.610 -12.355 8.008 784 H SER 45 H SER 45 18.047 -8.219 6.531 785 HA SER 45 HA SER 45 16.929 -7.763 3.914 786 HB2 SER 45 HB2 SER 45 17.577 -5.738 6.061 787 HB3 SER 45 HB3 SER 45 16.521 -5.514 4.665 788 HG SER 45 HG SER 45 15.519 -7.577 5.751 789 H ASP 46 H ASP 46 18.654 -8.229 2.524 790 HA ASP 46 HA ASP 46 20.928 -6.417 2.513 791 HB2 ASP 46 HB2 ASP 46 21.666 -7.605 0.571 792 HB3 ASP 46 HB3 ASP 46 21.029 -8.816 1.680 793 H THR 47 H THR 47 17.743 -6.298 1.720 794 HA THR 47 HA THR 47 18.045 -4.440 -0.517 795 HB THR 47 HB THR 47 15.430 -4.662 -0.395 796 HG1 THR 47 HG1 THR 47 15.767 -7.249 0.448 797 HG21 THR 47 HG21 THR 47 15.525 -6.608 -1.876 798 HG22 THR 47 HG22 THR 47 17.172 -6.938 -1.341 799 HG23 THR 47 HG23 THR 47 16.818 -5.468 -2.247 800 HA PRO 48 HA PRO 48 17.474 -1.033 2.281 801 HB2 PRO 48 HB2 PRO 48 16.875 0.854 0.409 802 HB3 PRO 48 HB3 PRO 48 18.516 0.277 0.717 803 HG2 PRO 48 HG2 PRO 48 16.603 -0.516 -1.443 804 HG3 PRO 48 HG3 PRO 48 18.345 -0.202 -1.549 805 HD2 PRO 48 HD2 PRO 48 17.334 -2.704 -1.457 806 HD3 PRO 48 HD3 PRO 48 18.900 -2.285 -0.734 807 H LEU 49 H LEU 49 15.819 0.281 3.109 808 HA LEU 49 HA LEU 49 13.131 -0.660 2.476 809 HB2 LEU 49 HB2 LEU 49 14.297 0.935 4.726 810 HB3 LEU 49 HB3 LEU 49 12.568 0.903 4.455 811 HG LEU 49 HG LEU 49 14.275 -1.525 4.999 812 HD11 LEU 49 HD11 LEU 49 12.323 -0.042 6.753 813 HD12 LEU 49 HD12 LEU 49 14.078 -0.049 6.941 814 HD13 LEU 49 HD13 LEU 49 13.163 -1.540 7.170 815 HD21 LEU 49 HD21 LEU 49 12.132 -2.674 5.228 816 HD22 LEU 49 HD22 LEU 49 12.319 -1.999 3.609 817 HD23 LEU 49 HD23 LEU 49 11.284 -1.192 4.787 818 H ILE 50 H ILE 50 11.942 0.356 1.069 819 HA ILE 50 HA ILE 50 12.327 3.204 0.563 820 HB ILE 50 HB ILE 50 10.370 1.276 -0.712 821 HG12 ILE 50 HG12 ILE 50 12.944 2.380 -1.858 822 HG13 ILE 50 HG13 ILE 50 12.810 0.786 -1.125 823 HG21 ILE 50 HG21 ILE 50 10.153 3.053 -2.427 824 HG22 ILE 50 HG22 ILE 50 11.174 4.098 -1.433 825 HG23 ILE 50 HG23 ILE 50 9.604 3.571 -0.833 826 HD11 ILE 50 HD11 ILE 50 11.282 1.733 -3.538 827 HD12 ILE 50 HD12 ILE 50 11.205 0.123 -2.823 828 HD13 ILE 50 HD13 ILE 50 12.705 0.689 -3.560 829 HA PRO 51 HA PRO 51 9.004 3.895 3.415 830 HB2 PRO 51 HB2 PRO 51 9.145 6.605 3.398 831 HB3 PRO 51 HB3 PRO 51 10.299 5.586 4.260 832 HG2 PRO 51 HG2 PRO 51 10.673 7.168 1.831 833 HG3 PRO 51 HG3 PRO 51 11.885 6.484 2.919 834 HD2 PRO 51 HD2 PRO 51 10.977 5.490 0.371 835 HD3 PRO 51 HD3 PRO 51 12.266 4.855 1.402 836 H LEU 52 H LEU 52 6.870 4.153 3.183 837 HA LEU 52 HA LEU 52 5.904 5.502 0.763 838 HB2 LEU 52 HB2 LEU 52 5.067 2.802 1.808 839 HB3 LEU 52 HB3 LEU 52 4.140 3.702 0.617 840 HG LEU 52 HG LEU 52 6.537 3.680 -0.608 841 HD11 LEU 52 HD11 LEU 52 7.556 1.481 -0.364 842 HD12 LEU 52 HD12 LEU 52 6.438 1.103 0.946 843 HD13 LEU 52 HD13 LEU 52 7.623 2.394 1.144 844 HD21 LEU 52 HD21 LEU 52 4.456 2.986 -1.619 845 HD22 LEU 52 HD22 LEU 52 4.474 1.488 -0.690 846 HD23 LEU 52 HD23 LEU 52 5.707 1.777 -1.919 847 H THR 53 H THR 53 4.363 6.905 1.098 848 HA THR 53 HA THR 53 3.013 6.943 3.720 849 HB THR 53 HB THR 53 3.176 9.194 1.702 850 HG1 THR 53 HG1 THR 53 5.194 8.196 2.981 851 HG21 THR 53 HG21 THR 53 2.690 10.592 3.678 852 HG22 THR 53 HG22 THR 53 2.549 9.133 4.658 853 HG23 THR 53 HG23 THR 53 1.402 9.432 3.349 854 H ILE 54 H ILE 54 0.996 6.193 3.700 855 HA ILE 54 HA ILE 54 -0.453 6.219 1.139 856 HB ILE 54 HB ILE 54 -0.873 4.396 3.510 857 HG12 ILE 54 HG12 ILE 54 0.471 3.951 0.835 858 HG13 ILE 54 HG13 ILE 54 1.216 3.858 2.426 859 HG21 ILE 54 HG21 ILE 54 -2.366 3.155 2.013 860 HG22 ILE 54 HG22 ILE 54 -2.124 4.380 0.766 861 HG23 ILE 54 HG23 ILE 54 -2.928 4.806 2.276 862 HD11 ILE 54 HD11 ILE 54 0.826 1.650 1.472 863 HD12 ILE 54 HD12 ILE 54 -0.902 2.000 1.379 864 HD13 ILE 54 HD13 ILE 54 -0.106 1.895 2.950 865 H PHE 55 H PHE 55 -2.159 7.436 0.964 866 HA PHE 55 HA PHE 55 -3.482 8.446 3.397 867 HB2 PHE 55 HB2 PHE 55 -3.393 9.612 0.608 868 HB3 PHE 55 HB3 PHE 55 -4.387 10.233 1.920 869 HD1 PHE 55 HD1 PHE 55 -0.916 9.748 0.768 870 HD2 PHE 55 HD2 PHE 55 -3.485 11.642 3.581 871 HE1 PHE 55 HE1 PHE 55 0.941 11.195 1.485 872 HE2 PHE 55 HE2 PHE 55 -1.636 13.095 4.301 873 HZ PHE 55 HZ PHE 55 0.583 12.874 3.252 874 H VAL 56 H VAL 56 -5.620 8.143 3.662 875 HA VAL 56 HA VAL 56 -6.967 6.332 1.839 876 HB VAL 56 HB VAL 56 -7.178 6.000 4.276 877 HG11 VAL 56 HG11 VAL 56 -8.606 8.648 4.235 878 HG12 VAL 56 HG12 VAL 56 -7.063 8.294 5.016 879 HG13 VAL 56 HG13 VAL 56 -8.545 7.540 5.605 880 HG21 VAL 56 HG21 VAL 56 -8.940 5.203 2.806 881 HG22 VAL 56 HG22 VAL 56 -9.757 6.760 2.920 882 HG23 VAL 56 HG23 VAL 56 -9.610 5.734 4.349 883 H GLY 57 H GLY 57 -8.767 6.875 0.591 884 HA2 GLY 57 HA2 GLY 57 -9.262 9.759 0.311 885 HA3 GLY 57 HA3 GLY 57 -9.597 8.546 -0.914 886 H GLU 58 H GLU 58 -11.679 9.740 -0.938 887 HA GLU 58 HA GLU 58 -13.445 8.873 1.246 888 HB2 GLU 58 HB2 GLU 58 -14.980 10.701 0.246 889 HB3 GLU 58 HB3 GLU 58 -13.622 11.171 1.253 890 HG2 GLU 58 HG2 GLU 58 -13.705 12.663 -0.577 891 HG3 GLU 58 HG3 GLU 58 -12.325 11.600 -0.836 892 H ASN 59 H ASN 59 -15.825 9.441 -0.181 893 HA ASN 59 HA ASN 59 -16.629 6.954 -0.899 894 HB2 ASN 59 HB2 ASN 59 -18.181 8.731 -0.467 895 HB3 ASN 59 HB3 ASN 59 -17.624 9.622 -1.875 896 HD21 ASN 59 HD21 ASN 59 -19.486 6.911 -0.745 897 HD22 ASN 59 HD22 ASN 59 -20.338 6.621 -2.224 898 H THR 60 H THR 60 -15.341 9.405 -3.150 899 HA THR 60 HA THR 60 -14.850 9.312 -5.384 900 HB THR 60 HB THR 60 -13.425 7.242 -5.979 901 HG1 THR 60 HG1 THR 60 -13.824 6.869 -3.183 902 HG21 THR 60 HG21 THR 60 -12.612 9.083 -3.736 903 HG22 THR 60 HG22 THR 60 -12.474 9.410 -5.462 904 HG23 THR 60 HG23 THR 60 -11.508 8.130 -4.729 905 H GLY 61 H GLY 61 -17.420 8.805 -5.355 906 HA2 GLY 61 HA2 GLY 61 -17.980 6.194 -6.522 907 HA3 GLY 61 HA3 GLY 61 -19.164 7.395 -6.035 908 H VAL 62 H VAL 62 -17.543 5.986 -8.613 909 HA VAL 62 HA VAL 62 -18.837 7.882 -10.419 910 HB VAL 62 HB VAL 62 -16.553 8.596 -10.496 911 HG11 VAL 62 HG11 VAL 62 -14.691 7.117 -11.071 912 HG12 VAL 62 HG12 VAL 62 -15.786 5.733 -11.046 913 HG13 VAL 62 HG13 VAL 62 -15.467 6.631 -9.563 914 HG21 VAL 62 HG21 VAL 62 -17.710 8.546 -12.629 915 HG22 VAL 62 HG22 VAL 62 -17.169 6.890 -12.904 916 HG23 VAL 62 HG23 VAL 62 -15.995 8.203 -12.851 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 11.646 20.080 2.498 2 H2 GLY 1 H2 GLY 1 11.322 19.214 1.079 3 H3 GLY 1 H3 GLY 1 10.044 19.758 2.046 4 HA2 GLY 1 HA2 GLY 1 10.702 22.063 1.598 5 HA3 GLY 1 HA3 GLY 1 11.934 21.441 0.505 6 H ALA 2 H ALA 2 10.819 22.742 -1.108 7 HA ALA 2 HA ALA 2 8.128 21.982 -1.847 8 HB1 ALA 2 HB1 ALA 2 10.055 23.883 -3.177 9 HB2 ALA 2 HB2 ALA 2 8.813 24.316 -2.003 10 HB3 ALA 2 HB3 ALA 2 8.352 23.687 -3.585 11 H MET 3 H MET 3 8.785 19.707 -2.196 12 HA MET 3 HA MET 3 9.417 19.348 -5.029 13 HB2 MET 3 HB2 MET 3 10.861 17.418 -4.550 14 HB3 MET 3 HB3 MET 3 11.518 18.896 -3.865 15 HG2 MET 3 HG2 MET 3 10.722 18.257 -1.662 16 HG3 MET 3 HG3 MET 3 9.993 16.799 -2.334 17 HE1 MET 3 HE1 MET 3 13.086 14.700 -3.408 18 HE2 MET 3 HE2 MET 3 12.120 15.782 -4.410 19 HE3 MET 3 HE3 MET 3 11.333 14.736 -3.230 20 H GLU 4 H GLU 4 8.448 17.532 -5.966 21 HA GLU 4 HA GLU 4 6.183 16.520 -4.425 22 HB2 GLU 4 HB2 GLU 4 5.837 17.594 -6.678 23 HB3 GLU 4 HB3 GLU 4 6.688 16.227 -7.388 24 HG2 GLU 4 HG2 GLU 4 4.257 15.984 -7.534 25 HG3 GLU 4 HG3 GLU 4 4.998 14.705 -6.573 26 H MET 5 H MET 5 5.722 14.336 -4.259 27 HA MET 5 HA MET 5 8.012 12.554 -4.787 28 HB2 MET 5 HB2 MET 5 7.235 11.251 -2.811 29 HB3 MET 5 HB3 MET 5 7.767 12.877 -2.412 30 HG2 MET 5 HG2 MET 5 5.371 13.578 -2.424 31 HG3 MET 5 HG3 MET 5 4.942 11.878 -2.608 32 HE1 MET 5 HE1 MET 5 6.694 14.535 -0.287 33 HE2 MET 5 HE2 MET 5 7.941 13.322 -0.573 34 HE3 MET 5 HE3 MET 5 7.244 13.511 1.038 35 HA PRO 6 HA PRO 6 5.773 10.134 -7.667 36 HB2 PRO 6 HB2 PRO 6 6.641 7.944 -5.813 37 HB3 PRO 6 HB3 PRO 6 6.644 7.979 -7.580 38 HG2 PRO 6 HG2 PRO 6 8.892 8.430 -6.275 39 HG3 PRO 6 HG3 PRO 6 8.468 9.462 -7.657 40 HD2 PRO 6 HD2 PRO 6 8.357 10.063 -4.737 41 HD3 PRO 6 HD3 PRO 6 8.699 11.149 -6.100 42 H THR 7 H THR 7 3.672 9.669 -7.847 43 HA THR 7 HA THR 7 2.261 8.961 -5.382 44 HB THR 7 HB THR 7 1.026 10.470 -7.668 45 HG1 THR 7 HG1 THR 7 2.876 11.343 -5.869 46 HG21 THR 7 HG21 THR 7 0.296 10.281 -4.748 47 HG22 THR 7 HG22 THR 7 -0.495 9.405 -6.060 48 HG23 THR 7 HG23 THR 7 -0.589 11.165 -5.991 49 H PHE 8 H PHE 8 1.058 7.184 -5.375 50 HA PHE 8 HA PHE 8 0.162 6.048 -7.949 51 HB2 PHE 8 HB2 PHE 8 0.920 4.586 -5.403 52 HB3 PHE 8 HB3 PHE 8 0.243 3.827 -6.834 53 HD1 PHE 8 HD1 PHE 8 3.195 5.603 -5.505 54 HD2 PHE 8 HD2 PHE 8 1.609 3.249 -8.676 55 HE1 PHE 8 HE1 PHE 8 5.469 5.258 -6.380 56 HE2 PHE 8 HE2 PHE 8 3.886 2.897 -9.558 57 HZ PHE 8 HZ PHE 8 5.816 3.904 -8.409 58 H TYR 9 H TYR 9 -2.012 5.471 -8.065 59 HA TYR 9 HA TYR 9 -3.589 5.897 -5.607 60 HB2 TYR 9 HB2 TYR 9 -3.712 7.677 -7.512 61 HB3 TYR 9 HB3 TYR 9 -4.673 6.469 -8.356 62 HD1 TYR 9 HD1 TYR 9 -6.880 5.762 -7.393 63 HD2 TYR 9 HD2 TYR 9 -4.610 8.951 -5.731 64 HE1 TYR 9 HE1 TYR 9 -8.887 6.568 -6.206 65 HE2 TYR 9 HE2 TYR 9 -6.600 9.764 -4.542 66 HH TYR 9 HH TYR 9 -8.969 9.644 -4.627 67 H LEU 10 H LEU 10 -4.690 4.148 -5.016 68 HA LEU 10 HA LEU 10 -5.746 2.359 -7.064 69 HB2 LEU 10 HB2 LEU 10 -5.012 0.405 -5.538 70 HB3 LEU 10 HB3 LEU 10 -3.851 1.118 -6.639 71 HG LEU 10 HG LEU 10 -3.107 2.529 -4.602 72 HD11 LEU 10 HD11 LEU 10 -4.497 0.267 -3.178 73 HD12 LEU 10 HD12 LEU 10 -4.982 1.961 -3.144 74 HD13 LEU 10 HD13 LEU 10 -3.441 1.472 -2.441 75 HD21 LEU 10 HD21 LEU 10 -1.738 0.837 -5.645 76 HD22 LEU 10 HD22 LEU 10 -2.589 -0.433 -4.767 77 HD23 LEU 10 HD23 LEU 10 -1.594 0.733 -3.890 78 H ALA 11 H ALA 11 -7.462 0.960 -6.288 79 HA ALA 11 HA ALA 11 -8.670 1.922 -3.773 80 HB1 ALA 11 HB1 ALA 11 -10.105 1.051 -6.274 81 HB2 ALA 11 HB2 ALA 11 -9.941 2.709 -5.694 82 HB3 ALA 11 HB3 ALA 11 -10.866 1.534 -4.756 83 H LEU 12 H LEU 12 -9.137 0.452 -2.299 84 HA LEU 12 HA LEU 12 -8.695 -2.367 -3.048 85 HB2 LEU 12 HB2 LEU 12 -8.115 -1.058 -0.394 86 HB3 LEU 12 HB3 LEU 12 -7.742 -2.708 -0.851 87 HG LEU 12 HG LEU 12 -6.492 -0.245 -2.073 88 HD11 LEU 12 HD11 LEU 12 -5.418 -2.239 -0.083 89 HD12 LEU 12 HD12 LEU 12 -5.792 -0.544 0.228 90 HD13 LEU 12 HD13 LEU 12 -4.476 -0.970 -0.867 91 HD21 LEU 12 HD21 LEU 12 -4.944 -1.830 -3.111 92 HD22 LEU 12 HD22 LEU 12 -6.603 -2.119 -3.635 93 HD23 LEU 12 HD23 LEU 12 -5.863 -3.173 -2.431 94 H HIS 13 H HIS 13 -10.108 -3.891 -2.286 95 HA HIS 13 HA HIS 13 -12.666 -3.009 -1.366 96 HB2 HIS 13 HB2 HIS 13 -11.483 -5.794 -1.586 97 HB3 HIS 13 HB3 HIS 13 -13.152 -5.466 -1.131 98 HD1 HIS 13 HD1 HIS 13 -14.645 -4.262 -3.029 99 HD2 HIS 13 HD2 HIS 13 -11.023 -5.883 -4.272 100 HE1 HIS 13 HE1 HIS 13 -14.782 -4.393 -5.531 101 HE2 HIS 13 HE2 HIS 13 -12.513 -5.193 -6.276 102 H GLY 14 H GLY 14 -13.349 -2.691 0.644 103 HA2 GLY 14 HA2 GLY 14 -11.629 -2.678 2.844 104 HA3 GLY 14 HA3 GLY 14 -13.382 -2.616 2.939 105 H GLY 15 H GLY 15 -10.713 -4.311 3.849 106 HA2 GLY 15 HA2 GLY 15 -10.787 -6.176 5.284 107 HA3 GLY 15 HA3 GLY 15 -12.348 -6.612 4.612 108 H GLN 16 H GLN 16 -10.482 -5.890 2.017 109 HA GLN 16 HA GLN 16 -10.006 -8.689 1.432 110 HB2 GLN 16 HB2 GLN 16 -10.579 -6.393 -0.096 111 HB3 GLN 16 HB3 GLN 16 -8.958 -6.892 -0.560 112 HG2 GLN 16 HG2 GLN 16 -11.446 -8.583 -0.627 113 HG3 GLN 16 HG3 GLN 16 -10.601 -7.901 -2.014 114 HE21 GLN 16 HE21 GLN 16 -10.547 -10.295 0.478 115 HE22 GLN 16 HE22 GLN 16 -9.286 -11.277 -0.187 116 H THR 17 H THR 17 -7.995 -9.554 0.854 117 HA THR 17 HA THR 17 -5.683 -8.156 2.014 118 HB THR 17 HB THR 17 -5.689 -11.035 1.096 119 HG1 THR 17 HG1 THR 17 -7.058 -9.912 3.237 120 HG21 THR 17 HG21 THR 17 -4.180 -9.546 3.255 121 HG22 THR 17 HG22 THR 17 -3.543 -10.017 1.680 122 HG23 THR 17 HG23 THR 17 -3.986 -11.253 2.854 123 H TYR 18 H TYR 18 -4.013 -7.560 0.766 124 HA TYR 18 HA TYR 18 -4.029 -8.359 -2.060 125 HB2 TYR 18 HB2 TYR 18 -3.710 -5.602 -0.890 126 HB3 TYR 18 HB3 TYR 18 -3.170 -6.004 -2.519 127 HD1 TYR 18 HD1 TYR 18 -4.791 -6.588 -4.251 128 HD2 TYR 18 HD2 TYR 18 -6.058 -5.385 -0.374 129 HE1 TYR 18 HE1 TYR 18 -7.054 -6.220 -5.119 130 HE2 TYR 18 HE2 TYR 18 -8.332 -5.006 -1.232 131 HH TYR 18 HH TYR 18 -9.349 -6.121 -4.294 132 H HIS 19 H HIS 19 -2.046 -8.396 -3.097 133 HA HIS 19 HA HIS 19 0.259 -8.682 -1.324 134 HB2 HIS 19 HB2 HIS 19 -0.496 -9.615 -4.038 135 HB3 HIS 19 HB3 HIS 19 1.206 -9.288 -3.789 136 HD1 HIS 19 HD1 HIS 19 -0.461 -12.115 -4.152 137 HD2 HIS 19 HD2 HIS 19 1.453 -10.629 -0.772 138 HE1 HIS 19 HE1 HIS 19 0.037 -14.118 -2.727 139 HE2 HIS 19 HE2 HIS 19 1.375 -13.220 -0.788 140 H LEU 20 H LEU 20 1.481 -7.011 -1.022 141 HA LEU 20 HA LEU 20 1.465 -4.806 -2.948 142 HB2 LEU 20 HB2 LEU 20 0.673 -4.074 -0.841 143 HB3 LEU 20 HB3 LEU 20 1.902 -4.975 0.024 144 HG LEU 20 HG LEU 20 3.611 -3.413 -0.690 145 HD11 LEU 20 HD11 LEU 20 2.768 -2.863 -2.878 146 HD12 LEU 20 HD12 LEU 20 3.018 -1.391 -1.937 147 HD13 LEU 20 HD13 LEU 20 1.387 -2.026 -2.165 148 HD21 LEU 20 HD21 LEU 20 2.834 -1.431 0.510 149 HD22 LEU 20 HD22 LEU 20 2.375 -2.913 1.346 150 HD23 LEU 20 HD23 LEU 20 1.175 -2.019 0.411 151 H ILE 21 H ILE 21 3.198 -4.498 -4.114 152 HA ILE 21 HA ILE 21 5.808 -5.353 -3.057 153 HB ILE 21 HB ILE 21 4.876 -5.726 -5.912 154 HG12 ILE 21 HG12 ILE 21 5.526 -7.999 -4.084 155 HG13 ILE 21 HG13 ILE 21 3.951 -7.230 -3.943 156 HG21 ILE 21 HG21 ILE 21 6.958 -7.000 -6.175 157 HG22 ILE 21 HG22 ILE 21 7.403 -6.604 -4.514 158 HG23 ILE 21 HG23 ILE 21 7.271 -5.325 -5.722 159 HD11 ILE 21 HD11 ILE 21 3.903 -9.197 -5.384 160 HD12 ILE 21 HD12 ILE 21 5.073 -8.430 -6.460 161 HD13 ILE 21 HD13 ILE 21 3.469 -7.724 -6.252 162 H VAL 22 H VAL 22 7.219 -3.722 -3.073 163 HA VAL 22 HA VAL 22 6.901 -1.626 -5.115 164 HB VAL 22 HB VAL 22 6.674 -0.765 -2.804 165 HG11 VAL 22 HG11 VAL 22 9.516 -1.713 -2.496 166 HG12 VAL 22 HG12 VAL 22 8.106 -2.320 -1.627 167 HG13 VAL 22 HG13 VAL 22 8.667 -0.669 -1.356 168 HG21 VAL 22 HG21 VAL 22 7.486 0.715 -4.537 169 HG22 VAL 22 HG22 VAL 22 9.138 0.163 -4.266 170 HG23 VAL 22 HG23 VAL 22 8.295 1.071 -3.011 171 H ASP 23 H ASP 23 8.640 -1.093 -6.343 172 HA ASP 23 HA ASP 23 11.203 -2.405 -5.909 173 HB2 ASP 23 HB2 ASP 23 9.575 -3.938 -7.209 174 HB3 ASP 23 HB3 ASP 23 9.743 -2.786 -8.521 175 H THR 24 H THR 24 12.705 -1.675 -7.821 176 HA THR 24 HA THR 24 11.978 1.081 -8.558 177 HB THR 24 HB THR 24 14.538 1.480 -8.452 178 HG1 THR 24 HG1 THR 24 14.639 -0.978 -7.812 179 HG21 THR 24 HG21 THR 24 14.363 2.179 -6.110 180 HG22 THR 24 HG22 THR 24 12.914 1.192 -5.919 181 HG23 THR 24 HG23 THR 24 12.898 2.583 -7.006 182 H ASP 25 H ASP 25 12.327 1.678 -10.614 183 HA ASP 25 HA ASP 25 12.905 -0.402 -12.513 184 HB2 ASP 25 HB2 ASP 25 11.968 0.978 -14.086 185 HB3 ASP 25 HB3 ASP 25 11.268 1.706 -12.644 186 H SER 26 H SER 26 14.336 0.563 -14.529 187 HA SER 26 HA SER 26 16.984 0.335 -13.648 188 HB2 SER 26 HB2 SER 26 16.081 1.560 -16.261 189 HB3 SER 26 HB3 SER 26 17.604 0.732 -15.935 190 HG SER 26 HG SER 26 15.973 -1.073 -15.306 191 H LEU 27 H LEU 27 14.971 3.162 -14.149 192 HA LEU 27 HA LEU 27 17.197 5.008 -14.135 193 HB2 LEU 27 HB2 LEU 27 14.261 5.610 -13.840 194 HB3 LEU 27 HB3 LEU 27 15.526 6.730 -14.302 195 HG LEU 27 HG LEU 27 14.636 4.367 -15.955 196 HD11 LEU 27 HD11 LEU 27 13.580 6.018 -17.401 197 HD12 LEU 27 HD12 LEU 27 14.036 7.302 -16.279 198 HD13 LEU 27 HD13 LEU 27 12.888 6.060 -15.778 199 HD21 LEU 27 HD21 LEU 27 15.966 5.412 -17.721 200 HD22 LEU 27 HD22 LEU 27 16.968 4.990 -16.332 201 HD23 LEU 27 HD23 LEU 27 16.482 6.665 -16.594 202 H GLY 28 H GLY 28 15.079 3.591 -11.790 203 HA2 GLY 28 HA2 GLY 28 15.866 3.622 -9.479 204 HA3 GLY 28 HA3 GLY 28 16.332 5.296 -9.728 205 H ASN 29 H ASN 29 13.387 4.499 -11.188 206 HA ASN 29 HA ASN 29 11.929 6.021 -9.154 207 HB2 ASN 29 HB2 ASN 29 11.014 5.009 -11.866 208 HB3 ASN 29 HB3 ASN 29 10.120 6.099 -10.816 209 HD21 ASN 29 HD21 ASN 29 12.704 5.754 -13.046 210 HD22 ASN 29 HD22 ASN 29 13.059 7.441 -13.236 211 HA PRO 30 HA PRO 30 10.219 2.402 -7.365 212 HB2 PRO 30 HB2 PRO 30 8.079 3.493 -6.148 213 HB3 PRO 30 HB3 PRO 30 9.732 3.800 -5.594 214 HG2 PRO 30 HG2 PRO 30 7.988 5.488 -7.357 215 HG3 PRO 30 HG3 PRO 30 8.949 5.980 -5.950 216 HD2 PRO 30 HD2 PRO 30 9.834 6.334 -8.466 217 HD3 PRO 30 HD3 PRO 30 10.936 5.930 -7.133 218 H SER 31 H SER 31 8.702 0.891 -7.754 219 HA SER 31 HA SER 31 6.472 1.574 -9.544 220 HB2 SER 31 HB2 SER 31 8.237 0.368 -10.811 221 HB3 SER 31 HB3 SER 31 8.156 -0.942 -9.637 222 HG SER 31 HG SER 31 5.935 -0.069 -11.178 223 H LEU 32 H LEU 32 4.542 0.538 -9.028 224 HA LEU 32 HA LEU 32 4.608 -0.898 -6.464 225 HB2 LEU 32 HB2 LEU 32 3.733 1.489 -6.445 226 HB3 LEU 32 HB3 LEU 32 2.377 0.895 -7.386 227 HG LEU 32 HG LEU 32 1.962 -0.754 -5.501 228 HD11 LEU 32 HD11 LEU 32 2.867 -0.151 -3.313 229 HD12 LEU 32 HD12 LEU 32 3.842 1.114 -4.061 230 HD13 LEU 32 HD13 LEU 32 4.155 -0.580 -4.441 231 HD21 LEU 32 HD21 LEU 32 0.761 0.885 -4.176 232 HD22 LEU 32 HD22 LEU 32 0.599 1.241 -5.895 233 HD23 LEU 32 HD23 LEU 32 1.704 2.188 -4.898 234 H SER 33 H SER 33 3.670 -2.817 -6.450 235 HA SER 33 HA SER 33 1.640 -3.391 -8.499 236 HB2 SER 33 HB2 SER 33 3.903 -4.561 -8.833 237 HB3 SER 33 HB3 SER 33 3.503 -5.483 -7.387 238 HG SER 33 HG SER 33 2.621 -5.791 -9.928 239 H VAL 34 H VAL 34 -0.233 -3.937 -7.676 240 HA VAL 34 HA VAL 34 -0.313 -5.164 -5.010 241 HB VAL 34 HB VAL 34 -2.118 -2.977 -6.058 242 HG11 VAL 34 HG11 VAL 34 -3.444 -3.254 -4.019 243 HG12 VAL 34 HG12 VAL 34 -2.487 -4.672 -3.592 244 HG13 VAL 34 HG13 VAL 34 -3.508 -4.699 -5.028 245 HG21 VAL 34 HG21 VAL 34 -0.042 -2.241 -5.002 246 HG22 VAL 34 HG22 VAL 34 -0.421 -3.201 -3.571 247 HG23 VAL 34 HG23 VAL 34 -1.438 -1.825 -4.009 248 H ILE 35 H ILE 35 -1.229 -7.068 -5.027 249 HA ILE 35 HA ILE 35 -3.032 -7.770 -7.259 250 HB ILE 35 HB ILE 35 -1.304 -9.836 -5.971 251 HG12 ILE 35 HG12 ILE 35 -0.384 -7.979 -8.177 252 HG13 ILE 35 HG13 ILE 35 0.254 -8.016 -6.545 253 HG21 ILE 35 HG21 ILE 35 -2.363 -9.461 -8.763 254 HG22 ILE 35 HG22 ILE 35 -3.077 -10.480 -7.514 255 HG23 ILE 35 HG23 ILE 35 -1.487 -10.873 -8.174 256 HD11 ILE 35 HD11 ILE 35 0.448 -10.229 -8.570 257 HD12 ILE 35 HD12 ILE 35 1.074 -10.283 -6.922 258 HD13 ILE 35 HD13 ILE 35 1.744 -9.133 -8.083 259 HA PRO 36 HA PRO 36 -5.840 -8.798 -3.935 260 HB2 PRO 36 HB2 PRO 36 -7.511 -10.383 -5.446 261 HB3 PRO 36 HB3 PRO 36 -7.601 -8.621 -5.373 262 HG2 PRO 36 HG2 PRO 36 -6.320 -10.366 -7.440 263 HG3 PRO 36 HG3 PRO 36 -7.278 -8.888 -7.654 264 HD2 PRO 36 HD2 PRO 36 -4.593 -8.871 -7.821 265 HD3 PRO 36 HD3 PRO 36 -5.493 -7.508 -7.123 266 H SER 37 H SER 37 -5.727 -10.362 -2.438 267 HA SER 37 HA SER 37 -4.254 -12.767 -2.966 268 HB2 SER 37 HB2 SER 37 -5.807 -11.958 -0.500 269 HB3 SER 37 HB3 SER 37 -4.648 -13.286 -0.606 270 HG SER 37 HG SER 37 -3.825 -10.730 -1.389 271 H ASN 38 H ASN 38 -7.552 -11.796 -2.939 272 HA ASN 38 HA ASN 38 -8.267 -14.516 -3.787 273 HB2 ASN 38 HB2 ASN 38 -9.200 -14.023 -1.519 274 HB3 ASN 38 HB3 ASN 38 -10.063 -12.654 -2.214 275 HD21 ASN 38 HD21 ASN 38 -9.855 -16.099 -1.996 276 HD22 ASN 38 HD22 ASN 38 -11.401 -16.446 -2.700 277 HA PRO 39 HA PRO 39 -9.109 -11.782 -7.280 278 HB2 PRO 39 HB2 PRO 39 -9.218 -13.748 -9.136 279 HB3 PRO 39 HB3 PRO 39 -7.694 -13.116 -8.506 280 HG2 PRO 39 HG2 PRO 39 -9.180 -15.601 -7.731 281 HG3 PRO 39 HG3 PRO 39 -7.442 -15.378 -8.021 282 HD2 PRO 39 HD2 PRO 39 -8.505 -15.443 -5.533 283 HD3 PRO 39 HD3 PRO 39 -7.086 -14.455 -5.939 284 H TYR 40 H TYR 40 -10.994 -14.277 -5.913 285 HA TYR 40 HA TYR 40 -13.130 -14.199 -7.820 286 HB2 TYR 40 HB2 TYR 40 -13.065 -15.359 -5.026 287 HB3 TYR 40 HB3 TYR 40 -14.301 -15.670 -6.243 288 HD1 TYR 40 HD1 TYR 40 -13.750 -17.000 -8.258 289 HD2 TYR 40 HD2 TYR 40 -10.937 -16.463 -5.111 290 HE1 TYR 40 HE1 TYR 40 -12.410 -18.863 -9.144 291 HE2 TYR 40 HE2 TYR 40 -9.588 -18.316 -5.992 292 HH TYR 40 HH TYR 40 -10.079 -19.648 -9.080 293 H GLN 41 H GLN 41 -12.391 -12.640 -4.772 294 HA GLN 41 HA GLN 41 -14.953 -11.410 -4.518 295 HB2 GLN 41 HB2 GLN 41 -12.295 -10.926 -3.201 296 HB3 GLN 41 HB3 GLN 41 -13.671 -9.867 -2.910 297 HG2 GLN 41 HG2 GLN 41 -14.978 -11.823 -2.169 298 HG3 GLN 41 HG3 GLN 41 -13.547 -12.827 -2.387 299 HE21 GLN 41 HE21 GLN 41 -11.895 -12.707 -0.929 300 HE22 GLN 41 HE22 GLN 41 -12.028 -11.890 0.592 301 H GLU 42 H GLU 42 -12.150 -10.742 -6.385 302 HA GLU 42 HA GLU 42 -12.642 -7.983 -6.862 303 HB2 GLU 42 HB2 GLU 42 -11.170 -10.057 -8.493 304 HB3 GLU 42 HB3 GLU 42 -11.220 -8.347 -8.901 305 HG2 GLU 42 HG2 GLU 42 -10.114 -9.488 -6.349 306 HG3 GLU 42 HG3 GLU 42 -9.158 -8.994 -7.744 307 H GLN 43 H GLN 43 -13.787 -10.953 -8.405 308 HA GLN 43 HA GLN 43 -15.348 -9.408 -10.303 309 HB2 GLN 43 HB2 GLN 43 -16.205 -11.613 -11.073 310 HB3 GLN 43 HB3 GLN 43 -14.457 -11.474 -11.146 311 HG2 GLN 43 HG2 GLN 43 -14.241 -12.788 -9.129 312 HG3 GLN 43 HG3 GLN 43 -15.992 -12.880 -8.983 313 HE21 GLN 43 HE21 GLN 43 -14.318 -13.068 -12.045 314 HE22 GLN 43 HE22 GLN 43 -14.667 -14.735 -12.348 315 H LEU 44 H LEU 44 -15.887 -11.387 -7.432 316 HA LEU 44 HA LEU 44 -18.730 -10.669 -7.396 317 HB2 LEU 44 HB2 LEU 44 -17.140 -12.517 -5.605 318 HB3 LEU 44 HB3 LEU 44 -18.884 -12.323 -5.593 319 HG LEU 44 HG LEU 44 -17.440 -13.276 -8.052 320 HD11 LEU 44 HD11 LEU 44 -17.932 -15.567 -7.341 321 HD12 LEU 44 HD12 LEU 44 -18.468 -14.961 -5.774 322 HD13 LEU 44 HD13 LEU 44 -16.783 -14.773 -6.264 323 HD21 LEU 44 HD21 LEU 44 -20.257 -13.619 -7.040 324 HD22 LEU 44 HD22 LEU 44 -19.616 -14.278 -8.545 325 HD23 LEU 44 HD23 LEU 44 -19.738 -12.532 -8.328 326 H SER 45 H SER 45 -17.707 -8.396 -7.024 327 HA SER 45 HA SER 45 -16.535 -7.992 -4.422 328 HB2 SER 45 HB2 SER 45 -17.264 -5.857 -6.422 329 HB3 SER 45 HB3 SER 45 -16.054 -5.786 -5.138 330 HG SER 45 HG SER 45 -15.117 -7.682 -6.345 331 H ASP 46 H ASP 46 -18.341 -8.605 -3.119 332 HA ASP 46 HA ASP 46 -20.539 -6.716 -2.952 333 HB2 ASP 46 HB2 ASP 46 -20.864 -9.117 -2.384 334 HB3 ASP 46 HB3 ASP 46 -19.739 -8.932 -1.042 335 H THR 47 H THR 47 -17.377 -6.681 -2.192 336 HA THR 47 HA THR 47 -17.639 -5.129 0.274 337 HB THR 47 HB THR 47 -15.020 -5.281 0.020 338 HG1 THR 47 HG1 THR 47 -15.056 -7.716 -0.983 339 HG21 THR 47 HG21 THR 47 -16.706 -7.665 0.794 340 HG22 THR 47 HG22 THR 47 -16.320 -6.295 1.834 341 HG23 THR 47 HG23 THR 47 -15.037 -7.376 1.288 342 HA PRO 48 HA PRO 48 -17.276 -1.433 -2.169 343 HB2 PRO 48 HB2 PRO 48 -16.851 0.308 -0.121 344 HB3 PRO 48 HB3 PRO 48 -18.439 -0.371 -0.497 345 HG2 PRO 48 HG2 PRO 48 -16.468 -1.203 1.592 346 HG3 PRO 48 HG3 PRO 48 -18.230 -1.044 1.716 347 HD2 PRO 48 HD2 PRO 48 -17.008 -3.433 1.395 348 HD3 PRO 48 HD3 PRO 48 -18.611 -3.087 0.720 349 H LEU 49 H LEU 49 -15.734 0.133 -2.782 350 HA LEU 49 HA LEU 49 -12.977 -0.648 -2.185 351 HB2 LEU 49 HB2 LEU 49 -14.204 0.965 -4.411 352 HB3 LEU 49 HB3 LEU 49 -12.475 0.895 -4.147 353 HG LEU 49 HG LEU 49 -14.230 -1.480 -4.782 354 HD11 LEU 49 HD11 LEU 49 -13.091 -1.434 -6.944 355 HD12 LEU 49 HD12 LEU 49 -12.240 0.041 -6.467 356 HD13 LEU 49 HD13 LEU 49 -13.995 0.056 -6.668 357 HD21 LEU 49 HD21 LEU 49 -11.231 -1.233 -4.571 358 HD22 LEU 49 HD22 LEU 49 -12.134 -2.679 -5.036 359 HD23 LEU 49 HD23 LEU 49 -12.281 -2.034 -3.401 360 H ILE 50 H ILE 50 -11.800 0.513 -0.854 361 HA ILE 50 HA ILE 50 -12.422 3.359 -0.489 362 HB ILE 50 HB ILE 50 -10.442 1.627 1.016 363 HG12 ILE 50 HG12 ILE 50 -13.101 2.728 1.946 364 HG13 ILE 50 HG13 ILE 50 -12.864 1.082 1.380 365 HG21 ILE 50 HG21 ILE 50 -11.375 4.454 1.550 366 HG22 ILE 50 HG22 ILE 50 -9.787 3.992 0.943 367 HG23 ILE 50 HG23 ILE 50 -10.278 3.519 2.569 368 HD11 ILE 50 HD11 ILE 50 -12.877 1.203 3.811 369 HD12 ILE 50 HD12 ILE 50 -11.521 2.333 3.769 370 HD13 ILE 50 HD13 ILE 50 -11.305 0.672 3.210 371 HA PRO 51 HA PRO 51 -9.009 4.100 -3.274 372 HB2 PRO 51 HB2 PRO 51 -9.085 6.794 -3.211 373 HB3 PRO 51 HB3 PRO 51 -10.278 5.839 -4.100 374 HG2 PRO 51 HG2 PRO 51 -10.502 7.137 -1.419 375 HG3 PRO 51 HG3 PRO 51 -11.693 7.048 -2.725 376 HD2 PRO 51 HD2 PRO 51 -11.736 5.407 -0.526 377 HD3 PRO 51 HD3 PRO 51 -12.412 4.962 -2.106 378 H LEU 52 H LEU 52 -6.897 4.248 -2.897 379 HA LEU 52 HA LEU 52 -5.963 5.656 -0.496 380 HB2 LEU 52 HB2 LEU 52 -5.125 2.916 -1.445 381 HB3 LEU 52 HB3 LEU 52 -4.201 3.853 -0.282 382 HG LEU 52 HG LEU 52 -6.569 3.869 0.967 383 HD11 LEU 52 HD11 LEU 52 -6.552 1.297 -0.593 384 HD12 LEU 52 HD12 LEU 52 -7.734 2.599 -0.725 385 HD13 LEU 52 HD13 LEU 52 -7.614 1.661 0.763 386 HD21 LEU 52 HD21 LEU 52 -4.471 3.130 1.933 387 HD22 LEU 52 HD22 LEU 52 -4.575 1.611 1.040 388 HD23 LEU 52 HD23 LEU 52 -5.757 1.978 2.296 389 H THR 53 H THR 53 -4.271 6.956 -0.812 390 HA THR 53 HA THR 53 -2.972 6.873 -3.463 391 HB THR 53 HB THR 53 -2.952 9.235 -1.587 392 HG1 THR 53 HG1 THR 53 -5.133 8.288 -2.475 393 HG21 THR 53 HG21 THR 53 -1.344 9.238 -3.438 394 HG22 THR 53 HG22 THR 53 -2.573 10.484 -3.663 395 HG23 THR 53 HG23 THR 53 -2.660 8.980 -4.583 396 H ILE 54 H ILE 54 -0.955 6.131 -3.450 397 HA ILE 54 HA ILE 54 0.512 6.161 -0.900 398 HB ILE 54 HB ILE 54 0.938 4.366 -3.293 399 HG12 ILE 54 HG12 ILE 54 -0.343 3.874 -0.601 400 HG13 ILE 54 HG13 ILE 54 -1.119 3.774 -2.178 401 HG21 ILE 54 HG21 ILE 54 2.232 4.355 -0.568 402 HG22 ILE 54 HG22 ILE 54 3.005 4.802 -2.087 403 HG23 ILE 54 HG23 ILE 54 2.474 3.140 -1.822 404 HD11 ILE 54 HD11 ILE 54 0.237 1.846 -2.737 405 HD12 ILE 54 HD12 ILE 54 -0.658 1.573 -1.243 406 HD13 ILE 54 HD13 ILE 54 1.065 1.960 -1.185 407 H PHE 55 H PHE 55 2.207 7.392 -0.722 408 HA PHE 55 HA PHE 55 3.467 8.465 -3.159 409 HB2 PHE 55 HB2 PHE 55 3.329 9.600 -0.360 410 HB3 PHE 55 HB3 PHE 55 4.284 10.292 -1.661 411 HD1 PHE 55 HD1 PHE 55 0.856 9.575 -0.532 412 HD2 PHE 55 HD2 PHE 55 3.309 11.680 -3.294 413 HE1 PHE 55 HE1 PHE 55 -1.082 10.931 -1.222 414 HE2 PHE 55 HE2 PHE 55 1.383 13.040 -3.988 415 HZ PHE 55 HZ PHE 55 -0.820 12.665 -2.950 416 H VAL 56 H VAL 56 5.584 8.067 -3.505 417 HA VAL 56 HA VAL 56 7.010 6.426 -1.585 418 HB VAL 56 HB VAL 56 7.436 7.154 -4.423 419 HG11 VAL 56 HG11 VAL 56 9.771 6.545 -2.596 420 HG12 VAL 56 HG12 VAL 56 9.507 8.049 -3.474 421 HG13 VAL 56 HG13 VAL 56 9.831 6.559 -4.358 422 HG21 VAL 56 HG21 VAL 56 6.582 5.001 -3.779 423 HG22 VAL 56 HG22 VAL 56 7.965 4.743 -2.713 424 HG23 VAL 56 HG23 VAL 56 8.199 4.808 -4.466 425 H GLY 57 H GLY 57 8.520 7.092 -0.210 426 HA2 GLY 57 HA2 GLY 57 8.840 9.941 0.048 427 HA3 GLY 57 HA3 GLY 57 9.411 8.737 1.175 428 H GLU 58 H GLU 58 10.690 11.066 0.092 429 HA GLU 58 HA GLU 58 12.909 9.980 -1.436 430 HB2 GLU 58 HB2 GLU 58 13.719 12.305 -1.441 431 HB3 GLU 58 HB3 GLU 58 12.043 12.235 -1.977 432 HG2 GLU 58 HG2 GLU 58 12.677 12.705 0.895 433 HG3 GLU 58 HG3 GLU 58 12.777 14.040 -0.256 434 H ASN 59 H ASN 59 12.031 9.468 1.393 435 HA ASN 59 HA ASN 59 14.058 10.591 3.076 436 HB2 ASN 59 HB2 ASN 59 11.688 10.273 3.710 437 HB3 ASN 59 HB3 ASN 59 11.928 8.535 3.625 438 HD21 ASN 59 HD21 ASN 59 11.321 8.359 5.806 439 HD22 ASN 59 HD22 ASN 59 12.405 8.805 7.085 440 H THR 60 H THR 60 15.790 9.587 1.748 441 HA THR 60 HA THR 60 16.254 6.755 2.237 442 HB THR 60 HB THR 60 18.405 7.300 0.914 443 HG1 THR 60 HG1 THR 60 18.600 9.285 0.146 444 HG21 THR 60 HG21 THR 60 16.502 6.096 -0.041 445 HG22 THR 60 HG22 THR 60 17.203 7.202 -1.223 446 HG23 THR 60 HG23 THR 60 15.702 7.626 -0.398 447 H GLY 61 H GLY 61 16.587 9.425 4.013 448 HA2 GLY 61 HA2 GLY 61 18.622 8.222 5.683 449 HA3 GLY 61 HA3 GLY 61 19.043 9.794 5.012 450 H VAL 62 H VAL 62 18.187 8.565 7.764 451 HA VAL 62 HA VAL 62 15.975 10.351 8.416 452 HB VAL 62 HB VAL 62 17.430 8.374 10.189 453 HG11 VAL 62 HG11 VAL 62 15.494 8.591 11.663 454 HG12 VAL 62 HG12 VAL 62 14.807 9.808 10.587 455 HG13 VAL 62 HG13 VAL 62 16.311 10.138 11.445 456 HG21 VAL 62 HG21 VAL 62 16.341 7.228 8.351 457 HG22 VAL 62 HG22 VAL 62 14.835 8.086 8.674 458 HG23 VAL 62 HG23 VAL 62 15.466 6.931 9.851 459 H1 GLY 1 H1 GLY 1 -11.455 20.142 -2.175 460 H2 GLY 1 H2 GLY 1 -11.119 19.264 -0.768 461 H3 GLY 1 H3 GLY 1 -9.849 19.813 -1.748 462 HA2 GLY 1 HA2 GLY 1 -10.486 22.119 -1.268 463 HA3 GLY 1 HA3 GLY 1 -11.721 21.502 -0.179 464 H ALA 2 H ALA 2 -10.600 22.797 1.435 465 HA ALA 2 HA ALA 2 -7.922 22.006 2.182 466 HB1 ALA 2 HB1 ALA 2 -9.838 23.909 3.522 467 HB2 ALA 2 HB2 ALA 2 -8.587 24.342 2.356 468 HB3 ALA 2 HB3 ALA 2 -8.137 23.695 3.934 469 H MET 3 H MET 3 -8.595 19.731 2.512 470 HA MET 3 HA MET 3 -9.228 19.356 5.344 471 HB2 MET 3 HB2 MET 3 -10.679 17.434 4.855 472 HB3 MET 3 HB3 MET 3 -11.334 18.919 4.178 473 HG2 MET 3 HG2 MET 3 -10.534 18.293 1.975 474 HG3 MET 3 HG3 MET 3 -9.810 16.830 2.637 475 HE1 MET 3 HE1 MET 3 -12.922 14.736 3.685 476 HE2 MET 3 HE2 MET 3 -11.956 15.809 4.699 477 HE3 MET 3 HE3 MET 3 -11.168 14.760 3.520 478 H GLU 4 H GLU 4 -8.262 17.541 6.276 479 HA GLU 4 HA GLU 4 -6.008 16.520 4.723 480 HB2 GLU 4 HB2 GLU 4 -5.658 17.574 6.987 481 HB3 GLU 4 HB3 GLU 4 -6.517 16.206 7.685 482 HG2 GLU 4 HG2 GLU 4 -4.093 15.952 7.832 483 HG3 GLU 4 HG3 GLU 4 -4.832 14.683 6.854 484 H MET 5 H MET 5 -5.554 14.331 4.558 485 HA MET 5 HA MET 5 -7.853 12.557 5.063 486 HB2 MET 5 HB2 MET 5 -7.079 11.262 3.082 487 HB3 MET 5 HB3 MET 5 -7.602 12.892 2.691 488 HG2 MET 5 HG2 MET 5 -5.206 13.582 2.703 489 HG3 MET 5 HG3 MET 5 -4.781 11.881 2.885 490 HE1 MET 5 HE1 MET 5 -6.525 14.548 0.566 491 HE2 MET 5 HE2 MET 5 -7.778 13.340 0.849 492 HE3 MET 5 HE3 MET 5 -7.076 13.525 -0.760 493 HA PRO 6 HA PRO 6 -5.628 10.108 7.929 494 HB2 PRO 6 HB2 PRO 6 -6.502 7.934 6.066 495 HB3 PRO 6 HB3 PRO 6 -6.509 7.964 7.832 496 HG2 PRO 6 HG2 PRO 6 -8.755 8.424 6.518 497 HG3 PRO 6 HG3 PRO 6 -8.333 9.445 7.908 498 HD2 PRO 6 HD2 PRO 6 -8.212 10.070 4.992 499 HD3 PRO 6 HD3 PRO 6 -8.551 11.143 6.366 500 H THR 7 H THR 7 -3.528 9.641 8.107 501 HA THR 7 HA THR 7 -2.122 8.933 5.637 502 HB THR 7 HB THR 7 -0.880 10.421 7.937 503 HG1 THR 7 HG1 THR 7 -2.731 11.312 6.163 504 HG21 THR 7 HG21 THR 7 -0.149 10.242 5.016 505 HG22 THR 7 HG22 THR 7 0.637 9.354 6.323 506 HG23 THR 7 HG23 THR 7 0.744 11.113 6.265 507 H PHE 8 H PHE 8 -0.926 7.156 5.616 508 HA PHE 8 HA PHE 8 -0.045 5.994 8.183 509 HB2 PHE 8 HB2 PHE 8 -0.803 4.547 5.627 510 HB3 PHE 8 HB3 PHE 8 -0.131 3.783 7.059 511 HD1 PHE 8 HD1 PHE 8 -3.071 5.577 5.734 512 HD2 PHE 8 HD2 PHE 8 -1.506 3.194 8.894 513 HE1 PHE 8 HE1 PHE 8 -5.349 5.243 6.609 514 HE2 PHE 8 HE2 PHE 8 -3.781 2.855 9.775 515 HZ PHE 8 HZ PHE 8 -5.705 3.879 8.632 516 H TYR 9 H TYR 9 2.114 5.380 8.294 517 HA TYR 9 HA TYR 9 3.708 5.831 5.847 518 HB2 TYR 9 HB2 TYR 9 3.839 7.602 7.763 519 HB3 TYR 9 HB3 TYR 9 4.793 6.383 8.598 520 HD1 TYR 9 HD1 TYR 9 6.996 5.671 7.635 521 HD2 TYR 9 HD2 TYR 9 4.742 8.880 5.986 522 HE1 TYR 9 HE1 TYR 9 9.008 6.480 6.461 523 HE2 TYR 9 HE2 TYR 9 6.741 9.693 4.813 524 HH TYR 9 HH TYR 9 9.113 9.566 4.925 525 H LEU 10 H LEU 10 4.808 4.087 5.251 526 HA LEU 10 HA LEU 10 5.848 2.275 7.285 527 HB2 LEU 10 HB2 LEU 10 5.103 0.338 5.748 528 HB3 LEU 10 HB3 LEU 10 3.945 1.053 6.851 529 HG LEU 10 HG LEU 10 3.215 2.480 4.821 530 HD11 LEU 10 HD11 LEU 10 4.594 0.217 3.386 531 HD12 LEU 10 HD12 LEU 10 5.088 1.910 3.359 532 HD13 LEU 10 HD13 LEU 10 3.545 1.431 2.655 533 HD21 LEU 10 HD21 LEU 10 1.834 0.790 5.852 534 HD22 LEU 10 HD22 LEU 10 2.681 -0.480 4.968 535 HD23 LEU 10 HD23 LEU 10 1.693 0.695 4.096 536 H ALA 11 H ALA 11 7.550 0.868 6.485 537 HA ALA 11 HA ALA 11 8.774 1.849 3.993 538 HB1 ALA 11 HB1 ALA 11 10.192 0.953 6.497 539 HB2 ALA 11 HB2 ALA 11 10.040 2.615 5.924 540 HB3 ALA 11 HB3 ALA 11 10.967 1.442 4.987 541 H LEU 12 H LEU 12 9.229 0.379 2.514 542 HA LEU 12 HA LEU 12 8.776 -2.443 3.245 543 HB2 LEU 12 HB2 LEU 12 8.205 -1.109 0.599 544 HB3 LEU 12 HB3 LEU 12 7.822 -2.759 1.040 545 HG LEU 12 HG LEU 12 6.582 -0.301 2.278 546 HD11 LEU 12 HD11 LEU 12 5.506 -2.278 0.273 547 HD12 LEU 12 HD12 LEU 12 5.887 -0.581 -0.023 548 HD13 LEU 12 HD13 LEU 12 4.567 -1.011 1.064 549 HD21 LEU 12 HD21 LEU 12 5.025 -1.883 3.306 550 HD22 LEU 12 HD22 LEU 12 6.682 -2.182 3.832 551 HD23 LEU 12 HD23 LEU 12 5.940 -3.229 2.624 552 H HIS 13 H HIS 13 10.188 -3.964 2.472 553 HA HIS 13 HA HIS 13 12.748 -3.089 1.560 554 HB2 HIS 13 HB2 HIS 13 11.547 -5.869 1.754 555 HB3 HIS 13 HB3 HIS 13 13.219 -5.551 1.308 556 HD1 HIS 13 HD1 HIS 13 14.713 -4.360 3.221 557 HD2 HIS 13 HD2 HIS 13 11.081 -5.974 4.447 558 HE1 HIS 13 HE1 HIS 13 14.841 -4.500 5.726 559 HE2 HIS 13 HE2 HIS 13 12.567 -5.285 6.450 560 H GLY 14 H GLY 14 13.442 -2.767 -0.450 561 HA2 GLY 14 HA2 GLY 14 11.715 -2.720 -2.646 562 HA3 GLY 14 HA3 GLY 14 13.469 -2.668 -2.744 563 H GLY 15 H GLY 15 10.785 -4.345 -3.658 564 HA2 GLY 15 HA2 GLY 15 10.857 -6.203 -5.107 565 HA3 GLY 15 HA3 GLY 15 12.418 -6.647 -4.436 566 H GLN 16 H GLN 16 10.554 -5.938 -1.839 567 HA GLN 16 HA GLN 16 10.063 -8.739 -1.280 568 HB2 GLN 16 HB2 GLN 16 10.637 -6.451 0.271 569 HB3 GLN 16 HB3 GLN 16 9.016 -6.957 0.726 570 HG2 GLN 16 HG2 GLN 16 11.499 -8.650 0.780 571 HG3 GLN 16 HG3 GLN 16 10.660 -7.969 2.173 572 HE21 GLN 16 HE21 GLN 16 10.589 -10.353 -0.340 573 HE22 GLN 16 HE22 GLN 16 9.329 -11.336 0.338 574 H THR 17 H THR 17 8.049 -9.593 -0.704 575 HA THR 17 HA THR 17 5.742 -8.179 -1.857 576 HB THR 17 HB THR 17 5.740 -11.067 -0.964 577 HG1 THR 17 HG1 THR 17 7.121 -9.924 -3.077 578 HG21 THR 17 HG21 THR 17 4.239 -9.558 -3.115 579 HG22 THR 17 HG22 THR 17 3.597 -10.036 -1.544 580 HG23 THR 17 HG23 THR 17 4.038 -11.266 -2.726 581 H TYR 18 H TYR 18 4.080 -7.585 -0.608 582 HA TYR 18 HA TYR 18 4.081 -8.399 2.215 583 HB2 TYR 18 HB2 TYR 18 3.774 -5.635 1.057 584 HB3 TYR 18 HB3 TYR 18 3.236 -6.044 2.682 585 HD1 TYR 18 HD1 TYR 18 4.851 -6.641 4.415 586 HD2 TYR 18 HD2 TYR 18 6.129 -5.428 0.541 587 HE1 TYR 18 HE1 TYR 18 7.117 -6.282 5.287 588 HE2 TYR 18 HE2 TYR 18 8.402 -5.062 1.404 589 HH TYR 18 HH TYR 18 9.404 -6.168 4.490 590 H HIS 19 H HIS 19 2.102 -8.440 3.245 591 HA HIS 19 HA HIS 19 -0.206 -8.699 1.470 592 HB2 HIS 19 HB2 HIS 19 0.543 -9.649 4.179 593 HB3 HIS 19 HB3 HIS 19 -1.156 -9.314 3.927 594 HD1 HIS 19 HD1 HIS 19 0.517 -12.141 4.281 595 HD2 HIS 19 HD2 HIS 19 -1.411 -10.639 0.909 596 HE1 HIS 19 HE1 HIS 19 -0.006 -14.140 2.852 597 HE2 HIS 19 HE2 HIS 19 -1.387 -13.232 0.951 598 H LEU 20 H LEU 20 -1.420 -7.021 1.177 599 HA LEU 20 HA LEU 20 -1.395 -4.822 3.114 600 HB2 LEU 20 HB2 LEU 20 -0.597 -4.082 1.011 601 HB3 LEU 20 HB3 LEU 20 -1.831 -4.972 0.141 602 HG LEU 20 HG LEU 20 -3.532 -3.406 0.866 603 HD11 LEU 20 HD11 LEU 20 -2.680 -2.871 3.059 604 HD12 LEU 20 HD12 LEU 20 -2.924 -1.393 2.127 605 HD13 LEU 20 HD13 LEU 20 -1.298 -2.038 2.349 606 HD21 LEU 20 HD21 LEU 20 -2.743 -1.419 -0.317 607 HD22 LEU 20 HD22 LEU 20 -2.295 -2.899 -1.165 608 HD23 LEU 20 HD23 LEU 20 -1.087 -2.021 -0.223 609 H ILE 21 H ILE 21 -3.127 -4.510 4.282 610 HA ILE 21 HA ILE 21 -5.739 -5.348 3.222 611 HB ILE 21 HB ILE 21 -4.808 -5.746 6.075 612 HG12 ILE 21 HG12 ILE 21 -5.472 -8.003 4.231 613 HG13 ILE 21 HG13 ILE 21 -3.890 -7.238 4.091 614 HG21 ILE 21 HG21 ILE 21 -6.899 -7.005 6.327 615 HG22 ILE 21 HG22 ILE 21 -7.341 -6.597 4.668 616 HG23 ILE 21 HG23 ILE 21 -7.199 -5.323 5.884 617 HD11 ILE 21 HD11 ILE 21 -3.852 -9.210 5.526 618 HD12 ILE 21 HD12 ILE 21 -5.022 -8.444 6.603 619 HD13 ILE 21 HD13 ILE 21 -3.413 -7.744 6.399 620 H VAL 22 H VAL 22 -7.139 -3.706 3.245 621 HA VAL 22 HA VAL 22 -6.817 -1.627 5.303 622 HB VAL 22 HB VAL 22 -6.584 -0.756 2.999 623 HG11 VAL 22 HG11 VAL 22 -9.429 -1.686 2.680 624 HG12 VAL 22 HG12 VAL 22 -8.020 -2.292 1.809 625 HG13 VAL 22 HG13 VAL 22 -8.574 -0.639 1.544 626 HG21 VAL 22 HG21 VAL 22 -7.392 0.723 4.734 627 HG22 VAL 22 HG22 VAL 22 -9.047 0.181 4.454 628 HG23 VAL 22 HG23 VAL 22 -8.195 1.087 3.204 629 H ASP 23 H ASP 23 -8.558 -1.087 6.524 630 HA ASP 23 HA ASP 23 -11.118 -2.394 6.087 631 HB2 ASP 23 HB2 ASP 23 -9.494 -3.937 7.378 632 HB3 ASP 23 HB3 ASP 23 -9.664 -2.794 8.700 633 H THR 24 H THR 24 -12.614 -1.675 8.018 634 HA THR 24 HA THR 24 -11.886 1.080 8.759 635 HB THR 24 HB THR 24 -14.447 1.492 8.642 636 HG1 THR 24 HG1 THR 24 -14.549 -0.953 8.000 637 HG21 THR 24 HG21 THR 24 -14.260 2.207 6.308 638 HG22 THR 24 HG22 THR 24 -12.813 1.217 6.115 639 HG23 THR 24 HG23 THR 24 -12.794 2.601 7.209 640 H ASP 25 H ASP 25 -12.219 1.649 10.819 641 HA ASP 25 HA ASP 25 -12.827 -0.430 12.700 642 HB2 ASP 25 HB2 ASP 25 -11.887 0.935 14.282 643 HB3 ASP 25 HB3 ASP 25 -11.182 1.668 12.846 644 H SER 26 H SER 26 -14.246 0.565 14.723 645 HA SER 26 HA SER 26 -16.894 0.326 13.835 646 HB2 SER 26 HB2 SER 26 -15.984 1.530 16.456 647 HB3 SER 26 HB3 SER 26 -17.511 0.708 16.125 648 HG SER 26 HG SER 26 -15.948 -1.113 15.489 649 H LEU 27 H LEU 27 -14.874 3.140 14.347 650 HA LEU 27 HA LEU 27 -17.089 4.996 14.358 651 HB2 LEU 27 HB2 LEU 27 -14.151 5.589 14.059 652 HB3 LEU 27 HB3 LEU 27 -15.410 6.710 14.531 653 HG LEU 27 HG LEU 27 -14.526 4.330 16.165 654 HD11 LEU 27 HD11 LEU 27 -13.471 5.975 17.624 655 HD12 LEU 27 HD12 LEU 27 -13.927 7.264 16.512 656 HD13 LEU 27 HD13 LEU 27 -12.778 6.027 16.003 657 HD21 LEU 27 HD21 LEU 27 -15.854 5.363 17.939 658 HD22 LEU 27 HD22 LEU 27 -16.854 4.958 16.545 659 HD23 LEU 27 HD23 LEU 27 -16.364 6.628 16.823 660 H GLY 28 H GLY 28 -14.965 3.595 12.004 661 HA2 GLY 28 HA2 GLY 28 -15.754 3.630 9.698 662 HA3 GLY 28 HA3 GLY 28 -16.216 5.306 9.948 663 H ASN 29 H ASN 29 -13.276 4.497 11.409 664 HA ASN 29 HA ASN 29 -11.808 6.017 9.381 665 HB2 ASN 29 HB2 ASN 29 -10.903 4.977 12.086 666 HB3 ASN 29 HB3 ASN 29 -9.998 6.069 11.045 667 HD21 ASN 29 HD21 ASN 29 -12.592 5.733 13.270 668 HD22 ASN 29 HD22 ASN 29 -12.937 7.425 13.462 669 HA PRO 30 HA PRO 30 -10.120 2.404 7.571 670 HB2 PRO 30 HB2 PRO 30 -7.967 3.487 6.369 671 HB3 PRO 30 HB3 PRO 30 -9.616 3.802 5.806 672 HG2 PRO 30 HG2 PRO 30 -7.872 5.478 7.582 673 HG3 PRO 30 HG3 PRO 30 -8.831 5.982 6.179 674 HD2 PRO 30 HD2 PRO 30 -9.708 6.323 8.702 675 HD3 PRO 30 HD3 PRO 30 -10.817 5.939 7.367 676 H SER 31 H SER 31 -8.612 0.879 7.960 677 HA SER 31 HA SER 31 -6.374 1.535 9.749 678 HB2 SER 31 HB2 SER 31 -8.156 0.330 10.998 679 HB3 SER 31 HB3 SER 31 -8.063 -0.977 9.823 680 HG SER 31 HG SER 31 -5.810 -0.116 11.311 681 H LEU 32 H LEU 32 -4.453 0.501 9.237 682 HA LEU 32 HA LEU 32 -4.517 -0.922 6.658 683 HB2 LEU 32 HB2 LEU 32 -3.634 1.463 6.647 684 HB3 LEU 32 HB3 LEU 32 -2.282 0.864 7.586 685 HG LEU 32 HG LEU 32 -1.871 -0.781 5.694 686 HD11 LEU 32 HD11 LEU 32 -2.773 -0.160 3.515 687 HD12 LEU 32 HD12 LEU 32 -3.744 1.103 4.273 688 HD13 LEU 32 HD13 LEU 32 -4.059 -0.593 4.644 689 HD21 LEU 32 HD21 LEU 32 -0.661 0.860 4.382 690 HD22 LEU 32 HD22 LEU 32 -0.502 1.208 6.102 691 HD23 LEU 32 HD23 LEU 32 -1.601 2.162 5.107 692 H SER 33 H SER 33 -3.594 -2.839 6.631 693 HA SER 33 HA SER 33 -1.565 -3.445 8.676 694 HB2 SER 33 HB2 SER 33 -3.842 -4.598 8.990 695 HB3 SER 33 HB3 SER 33 -3.442 -5.510 7.539 696 HG SER 33 HG SER 33 -2.613 -5.885 10.067 697 H VAL 34 H VAL 34 0.298 -3.988 7.850 698 HA VAL 34 HA VAL 34 0.385 -5.205 5.174 699 HB VAL 34 HB VAL 34 2.195 -3.035 6.246 700 HG11 VAL 34 HG11 VAL 34 3.522 -3.304 4.202 701 HG12 VAL 34 HG12 VAL 34 2.559 -4.715 3.764 702 HG13 VAL 34 HG13 VAL 34 3.581 -4.758 5.201 703 HG21 VAL 34 HG21 VAL 34 0.126 -2.283 5.193 704 HG22 VAL 34 HG22 VAL 34 0.499 -3.238 3.757 705 HG23 VAL 34 HG23 VAL 34 1.522 -1.867 4.199 706 H ILE 35 H ILE 35 1.288 -7.109 5.183 707 HA ILE 35 HA ILE 35 3.086 -7.829 7.411 708 HB ILE 35 HB ILE 35 1.351 -9.884 6.118 709 HG12 ILE 35 HG12 ILE 35 0.431 -8.031 8.325 710 HG13 ILE 35 HG13 ILE 35 -0.203 -8.063 6.690 711 HG21 ILE 35 HG21 ILE 35 2.408 -9.527 8.916 712 HG22 ILE 35 HG22 ILE 35 3.116 -10.542 7.662 713 HG23 ILE 35 HG23 ILE 35 1.522 -10.932 8.316 714 HD11 ILE 35 HD11 ILE 35 -0.410 -10.282 8.711 715 HD12 ILE 35 HD12 ILE 35 -1.034 -10.326 7.060 716 HD13 ILE 35 HD13 ILE 35 -1.698 -9.179 8.225 717 HA PRO 36 HA PRO 36 5.887 -8.854 4.083 718 HB2 PRO 36 HB2 PRO 36 7.544 -10.462 5.582 719 HB3 PRO 36 HB3 PRO 36 7.650 -8.699 5.520 720 HG2 PRO 36 HG2 PRO 36 6.359 -10.451 7.573 721 HG3 PRO 36 HG3 PRO 36 7.322 -8.977 7.799 722 HD2 PRO 36 HD2 PRO 36 4.638 -8.951 7.967 723 HD3 PRO 36 HD3 PRO 36 5.545 -7.588 7.279 724 H SER 37 H SER 37 5.773 -10.410 2.576 725 HA SER 37 HA SER 37 4.286 -12.813 3.088 726 HB2 SER 37 HB2 SER 37 5.852 -12.006 0.628 727 HB3 SER 37 HB3 SER 37 4.676 -13.317 0.726 728 HG SER 37 HG SER 37 3.854 -10.785 1.542 729 H ASN 38 H ASN 38 7.585 -11.853 3.073 730 HA ASN 38 HA ASN 38 8.287 -14.581 3.901 731 HB2 ASN 38 HB2 ASN 38 9.222 -14.078 1.642 732 HB3 ASN 38 HB3 ASN 38 10.097 -12.721 2.342 733 HD21 ASN 38 HD21 ASN 38 9.863 -16.155 2.086 734 HD22 ASN 38 HD22 ASN 38 11.394 -16.526 2.802 735 HA PRO 39 HA PRO 39 9.142 -11.876 7.417 736 HB2 PRO 39 HB2 PRO 39 9.236 -13.858 9.264 737 HB3 PRO 39 HB3 PRO 39 7.715 -13.212 8.637 738 HG2 PRO 39 HG2 PRO 39 9.187 -15.698 7.845 739 HG3 PRO 39 HG3 PRO 39 7.451 -15.471 8.131 740 HD2 PRO 39 HD2 PRO 39 8.521 -15.522 5.644 741 HD3 PRO 39 HD3 PRO 39 7.107 -14.529 6.052 742 H TYR 40 H TYR 40 11.011 -14.372 6.035 743 HA TYR 40 HA TYR 40 13.147 -14.325 7.946 744 HB2 TYR 40 HB2 TYR 40 13.079 -15.460 5.141 745 HB3 TYR 40 HB3 TYR 40 14.312 -15.785 6.359 746 HD1 TYR 40 HD1 TYR 40 13.757 -17.123 8.361 747 HD2 TYR 40 HD2 TYR 40 10.950 -16.559 5.212 748 HE1 TYR 40 HE1 TYR 40 12.405 -18.985 9.235 749 HE2 TYR 40 HE2 TYR 40 9.592 -18.414 6.081 750 HH TYR 40 HH TYR 40 10.074 -19.763 9.153 751 H GLN 41 H GLN 41 12.421 -12.743 4.905 752 HA GLN 41 HA GLN 41 14.986 -11.519 4.660 753 HB2 GLN 41 HB2 GLN 41 12.331 -11.013 3.345 754 HB3 GLN 41 HB3 GLN 41 13.715 -9.962 3.061 755 HG2 GLN 41 HG2 GLN 41 15.009 -11.925 2.316 756 HG3 GLN 41 HG3 GLN 41 13.568 -12.917 2.519 757 HE21 GLN 41 HE21 GLN 41 11.929 -12.778 1.040 758 HE22 GLN 41 HE22 GLN 41 12.074 -11.932 -0.460 759 H GLU 42 H GLU 42 12.189 -10.851 6.534 760 HA GLU 42 HA GLU 42 12.690 -8.095 7.023 761 HB2 GLU 42 HB2 GLU 42 11.207 -10.178 8.635 762 HB3 GLU 42 HB3 GLU 42 11.266 -8.475 9.066 763 HG2 GLU 42 HG2 GLU 42 10.157 -9.584 6.499 764 HG3 GLU 42 HG3 GLU 42 9.200 -9.090 7.895 765 H GLN 43 H GLN 43 13.824 -11.084 8.540 766 HA GLN 43 HA GLN 43 15.386 -9.560 10.459 767 HB2 GLN 43 HB2 GLN 43 16.237 -11.771 11.214 768 HB3 GLN 43 HB3 GLN 43 14.492 -11.627 11.290 769 HG2 GLN 43 HG2 GLN 43 14.268 -12.925 9.265 770 HG3 GLN 43 HG3 GLN 43 16.019 -13.025 9.118 771 HE21 GLN 43 HE21 GLN 43 14.349 -13.227 12.169 772 HE22 GLN 43 HE22 GLN 43 14.670 -14.903 12.460 773 H LEU 44 H LEU 44 15.920 -11.510 7.574 774 HA LEU 44 HA LEU 44 18.768 -10.815 7.552 775 HB2 LEU 44 HB2 LEU 44 17.166 -12.640 5.747 776 HB3 LEU 44 HB3 LEU 44 18.911 -12.459 5.733 777 HG LEU 44 HG LEU 44 17.464 -13.418 8.185 778 HD11 LEU 44 HD11 LEU 44 17.941 -15.708 7.463 779 HD12 LEU 44 HD12 LEU 44 18.483 -15.093 5.901 780 HD13 LEU 44 HD13 LEU 44 16.800 -14.900 6.391 781 HD21 LEU 44 HD21 LEU 44 20.282 -13.760 7.175 782 HD22 LEU 44 HD22 LEU 44 19.637 -14.428 8.676 783 HD23 LEU 44 HD23 LEU 44 19.762 -12.681 8.469 784 H SER 45 H SER 45 17.758 -8.533 7.188 785 HA SER 45 HA SER 45 16.585 -8.113 4.588 786 HB2 SER 45 HB2 SER 45 17.326 -5.992 6.602 787 HB3 SER 45 HB3 SER 45 16.120 -5.904 5.315 788 HG SER 45 HG SER 45 15.177 -7.811 6.514 789 H ASP 46 H ASP 46 18.389 -8.725 3.269 790 HA ASP 46 HA ASP 46 20.602 -6.848 3.123 791 HB2 ASP 46 HB2 ASP 46 20.905 -9.254 2.539 792 HB3 ASP 46 HB3 ASP 46 19.806 -9.039 1.183 793 H THR 47 H THR 47 17.445 -6.789 2.362 794 HA THR 47 HA THR 47 17.709 -5.215 -0.087 795 HB THR 47 HB THR 47 15.086 -5.364 0.164 796 HG1 THR 47 HG1 THR 47 15.107 -7.803 1.141 797 HG21 THR 47 HG21 THR 47 16.761 -7.750 -0.624 798 HG22 THR 47 HG22 THR 47 16.381 -6.373 -1.658 799 HG23 THR 47 HG23 THR 47 15.095 -7.451 -1.118 800 HA PRO 48 HA PRO 48 17.363 -1.538 2.383 801 HB2 PRO 48 HB2 PRO 48 16.954 0.220 0.347 802 HB3 PRO 48 HB3 PRO 48 18.535 -0.474 0.721 803 HG2 PRO 48 HG2 PRO 48 16.563 -1.281 -1.383 804 HG3 PRO 48 HG3 PRO 48 18.326 -1.128 -1.497 805 HD2 PRO 48 HD2 PRO 48 17.091 -3.516 -1.196 806 HD3 PRO 48 HD3 PRO 48 18.694 -3.179 -0.511 807 H LEU 49 H LEU 49 15.829 0.040 3.000 808 HA LEU 49 HA LEU 49 13.066 -0.731 2.397 809 HB2 LEU 49 HB2 LEU 49 14.305 0.851 4.634 810 HB3 LEU 49 HB3 LEU 49 12.575 0.798 4.374 811 HG LEU 49 HG LEU 49 14.316 -1.591 4.988 812 HD11 LEU 49 HD11 LEU 49 13.178 -1.547 7.152 813 HD12 LEU 49 HD12 LEU 49 12.335 -0.068 6.675 814 HD13 LEU 49 HD13 LEU 49 14.091 -0.063 6.878 815 HD21 LEU 49 HD21 LEU 49 11.317 -1.327 4.779 816 HD22 LEU 49 HD22 LEU 49 12.210 -2.781 5.230 817 HD23 LEU 49 HD23 LEU 49 12.358 -2.124 3.600 818 H ILE 50 H ILE 50 11.905 0.446 1.064 819 HA ILE 50 HA ILE 50 12.536 3.291 0.720 820 HB ILE 50 HB ILE 50 10.549 1.575 -0.791 821 HG12 ILE 50 HG12 ILE 50 13.214 2.666 -1.712 822 HG13 ILE 50 HG13 ILE 50 12.963 1.019 -1.161 823 HG21 ILE 50 HG21 ILE 50 11.492 4.402 -1.303 824 HG22 ILE 50 HG22 ILE 50 9.902 3.938 -0.701 825 HG23 ILE 50 HG23 ILE 50 10.396 3.480 -2.332 826 HD11 ILE 50 HD11 ILE 50 12.982 1.161 -3.590 827 HD12 ILE 50 HD12 ILE 50 11.631 2.294 -3.537 828 HD13 ILE 50 HD13 ILE 50 11.408 0.630 -2.993 829 HA PRO 51 HA PRO 51 9.124 4.027 3.512 830 HB2 PRO 51 HB2 PRO 51 9.211 6.721 3.460 831 HB3 PRO 51 HB3 PRO 51 10.401 5.759 4.348 832 HG2 PRO 51 HG2 PRO 51 10.634 7.070 1.674 833 HG3 PRO 51 HG3 PRO 51 11.825 6.965 2.981 834 HD2 PRO 51 HD2 PRO 51 11.857 5.342 0.768 835 HD3 PRO 51 HD3 PRO 51 12.535 4.882 2.344 836 H LEU 52 H LEU 52 7.013 4.184 3.135 837 HA LEU 52 HA LEU 52 6.093 5.617 0.741 838 HB2 LEU 52 HB2 LEU 52 5.230 2.876 1.669 839 HB3 LEU 52 HB3 LEU 52 4.320 3.827 0.510 840 HG LEU 52 HG LEU 52 6.688 3.831 -0.737 841 HD11 LEU 52 HD11 LEU 52 6.656 1.252 0.810 842 HD12 LEU 52 HD12 LEU 52 7.844 2.547 0.951 843 HD13 LEU 52 HD13 LEU 52 7.719 1.622 -0.547 844 HD21 LEU 52 HD21 LEU 52 4.582 3.106 -1.704 845 HD22 LEU 52 HD22 LEU 52 4.684 1.584 -0.817 846 HD23 LEU 52 HD23 LEU 52 5.866 1.954 -2.073 847 H THR 53 H THR 53 4.401 6.922 1.063 848 HA THR 53 HA THR 53 3.101 6.831 3.711 849 HB THR 53 HB THR 53 3.084 9.202 1.848 850 HG1 THR 53 HG1 THR 53 5.264 8.238 2.750 851 HG21 THR 53 HG21 THR 53 1.480 9.207 3.701 852 HG22 THR 53 HG22 THR 53 2.721 10.438 3.939 853 HG23 THR 53 HG23 THR 53 2.793 8.928 4.846 854 H ILE 54 H ILE 54 1.081 6.091 3.691 855 HA ILE 54 HA ILE 54 -0.383 6.154 1.141 856 HB ILE 54 HB ILE 54 -0.819 4.345 3.520 857 HG12 ILE 54 HG12 ILE 54 0.465 3.861 0.822 858 HG13 ILE 54 HG13 ILE 54 1.238 3.750 2.399 859 HG21 ILE 54 HG21 ILE 54 -2.114 4.357 0.796 860 HG22 ILE 54 HG22 ILE 54 -2.888 4.795 2.320 861 HG23 ILE 54 HG23 ILE 54 -2.361 3.135 2.044 862 HD11 ILE 54 HD11 ILE 54 -0.126 1.823 2.948 863 HD12 ILE 54 HD12 ILE 54 0.764 1.555 1.449 864 HD13 ILE 54 HD13 ILE 54 -0.954 1.954 1.398 865 H PHE 55 H PHE 55 -2.076 7.391 0.971 866 HA PHE 55 HA PHE 55 -3.326 8.460 3.414 867 HB2 PHE 55 HB2 PHE 55 -3.181 9.605 0.621 868 HB3 PHE 55 HB3 PHE 55 -4.138 10.299 1.924 869 HD1 PHE 55 HD1 PHE 55 -0.710 9.567 0.796 870 HD2 PHE 55 HD2 PHE 55 -3.157 11.672 3.563 871 HE1 PHE 55 HE1 PHE 55 1.236 10.906 1.493 872 HE2 PHE 55 HE2 PHE 55 -1.219 13.016 4.265 873 HZ PHE 55 HZ PHE 55 0.980 12.635 3.231 874 H VAL 56 H VAL 56 -5.451 8.066 3.754 875 HA VAL 56 HA VAL 56 -6.881 6.446 1.821 876 HB VAL 56 HB VAL 56 -7.307 7.153 4.662 877 HG11 VAL 56 HG11 VAL 56 -9.642 6.578 2.827 878 HG12 VAL 56 HG12 VAL 56 -9.365 8.073 3.718 879 HG13 VAL 56 HG13 VAL 56 -9.705 6.581 4.589 880 HG21 VAL 56 HG21 VAL 56 -6.464 5.002 4.005 881 HG22 VAL 56 HG22 VAL 56 -7.847 4.755 2.935 882 HG23 VAL 56 HG23 VAL 56 -8.083 4.809 4.687 883 H GLY 57 H GLY 57 -8.382 7.132 0.451 884 HA2 GLY 57 HA2 GLY 57 -8.690 9.981 0.206 885 HA3 GLY 57 HA3 GLY 57 -9.268 8.783 -0.924 886 H GLU 58 H GLU 58 -10.531 11.115 0.183 887 HA GLU 58 HA GLU 58 -12.763 10.029 1.689 888 HB2 GLU 58 HB2 GLU 58 -13.557 12.358 1.710 889 HB3 GLU 58 HB3 GLU 58 -11.880 12.273 2.244 890 HG2 GLU 58 HG2 GLU 58 -12.504 12.763 -0.624 891 HG3 GLU 58 HG3 GLU 58 -12.606 14.092 0.531 892 H ASN 59 H ASN 59 -11.881 9.538 -1.146 893 HA ASN 59 HA ASN 59 -13.905 10.678 -2.820 894 HB2 ASN 59 HB2 ASN 59 -11.537 10.341 -3.457 895 HB3 ASN 59 HB3 ASN 59 -11.794 8.605 -3.381 896 HD21 ASN 59 HD21 ASN 59 -11.187 8.439 -5.568 897 HD22 ASN 59 HD22 ASN 59 -12.259 8.910 -6.846 898 H THR 60 H THR 60 -15.646 9.672 -1.508 899 HA THR 60 HA THR 60 -16.119 6.842 -2.012 900 HB THR 60 HB THR 60 -18.266 7.386 -0.694 901 HG1 THR 60 HG1 THR 60 -18.456 9.355 0.132 902 HG21 THR 60 HG21 THR 60 -16.372 6.179 0.276 903 HG22 THR 60 HG22 THR 60 -17.075 7.289 1.452 904 HG23 THR 60 HG23 THR 60 -15.569 7.709 0.633 905 H GLY 61 H GLY 61 -16.435 9.528 -3.770 906 HA2 GLY 61 HA2 GLY 61 -18.475 8.343 -5.444 907 HA3 GLY 61 HA3 GLY 61 -18.888 9.913 -4.762 908 H VAL 62 H VAL 62 -18.037 8.698 -7.521 909 HA VAL 62 HA VAL 62 -15.809 10.466 -8.156 910 HB VAL 62 HB VAL 62 -17.282 8.522 -9.946 911 HG11 VAL 62 HG11 VAL 62 -15.342 8.739 -11.424 912 HG12 VAL 62 HG12 VAL 62 -14.647 9.940 -10.338 913 HG13 VAL 62 HG13 VAL 62 -16.151 10.288 -11.191 914 HG21 VAL 62 HG21 VAL 62 -16.210 7.346 -8.118 915 HG22 VAL 62 HG22 VAL 62 -14.694 8.192 -8.430 916 HG23 VAL 62 HG23 VAL 62 -15.330 7.056 -9.619
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